+---------------------------------------------------+ | | | WANNIER90 | | | +---------------------------------------------------+ | | | Welcome to the Maximally-Localized | | Generalized Wannier Functions code | | http://www.wannier.org | | | | | | Wannier90 Developer Group: | | Giovanni Pizzi (EPFL) | | Valerio Vitale (Cambridge) | | David Vanderbilt (Rutgers University) | | Nicola Marzari (EPFL) | | Ivo Souza (Universidad del Pais Vasco) | | Arash A. Mostofi (Imperial College London) | | Jonathan R. Yates (University of Oxford) | | | | For the full list of Wannier90 3.x authors, | | please check the code documentation and the | | README on the GitHub page of the code | | | | | | Please cite | | | | [ref] "An updated version of Wannier90: | | A Tool for Obtaining Maximally Localised | | Wannier Functions", A. A. Mostofi, | | J. R. Yates, G. Pizzi, Y. S. Lee, | | I. Souza, D. Vanderbilt and N. Marzari, | | Comput. Phys. Commun. 185, 2309 (2014) | | http://dx.doi.org/10.1016/j.cpc.2014.05.003| | | | in any publications arising from the use of | | this code. For the method please cite | | | | [ref] "Maximally Localized Generalised Wannier | | Functions for Composite Energy Bands" | | N. Marzari and D. Vanderbilt | | Phys. Rev. B 56 12847 (1997) | | | | [ref] "Maximally Localized Wannier Functions | | for Entangled Energy Bands" | | I. Souza, N. Marzari and D. Vanderbilt | | Phys. Rev. B 65 035109 (2001) | | | | | | Copyright (c) 1996-2019 | | The Wannier90 Developer Group and | | individual contributors | | | | Release: 3.0.0 27th February 2019 | | | | This program is free software; you can | | redistribute it and/or modify it under the terms | | of the GNU General Public License as published by | | the Free Software Foundation; either version 2 of | | the License, or (at your option) any later version| | | | This program is distributed in the hope that it | | will be useful, but WITHOUT ANY WARRANTY; without | | even the implied warranty of MERCHANTABILITY or | | FITNESS FOR A PARTICULAR PURPOSE. See the GNU | | General Public License for more details. | | | | You should have received a copy of the GNU General| | Public License along with this program; if not, | | write to the Free Software Foundation, Inc., | | 675 Mass Ave, Cambridge, MA 02139, USA. | | | +---------------------------------------------------+ | Execution started on 25Jan2021 at 01:29:49 | +---------------------------------------------------+ ****************************************************************************** * -> Using CODATA 2006 constant values * * (http://physics.nist.gov/cuu/Constants/index.html) * * -> Using Bohr value from CODATA * ****************************************************************************** Running in serial (with serial executable) ------ SYSTEM ------ Lattice Vectors (Ang) a_1 4.293691 0.000000 0.000000 a_2 0.000000 40.000029 0.000000 a_3 0.000000 0.000000 15.000004 Unit Cell Volume: 2576.21716 (Ang^3) Reciprocal-Space Vectors (Ang^-1) b_1 1.463353 0.000000 0.000000 b_2 0.000000 0.157080 0.000000 b_3 0.000000 0.000000 0.418879 *----------------------------------------------------------------------------* | Site Fractional Coordinate Cartesian Coordinate (Ang) | +----------------------------------------------------------------------------+ | C 1 0.82361 0.47074 0.22064 | 3.53631 18.82958 3.30953 | | C 2 0.65590 0.43983 0.22064 | 2.81625 17.59331 3.30961 | | C 3 0.32198 0.43983 0.22064 | 1.38249 17.59331 3.30961 | | C 4 0.15432 0.47074 0.22064 | 0.66258 18.82960 3.30954 | | C 5 0.32200 0.50165 0.22064 | 1.38256 20.06591 3.30954 | | C 6 0.65593 0.50165 0.22064 | 2.81637 20.06593 3.30953 | | C 7 0.82135 0.40911 0.22065 | 3.52661 16.36422 3.30980 | | C 8 0.64830 0.37896 0.22067 | 2.78360 15.15841 3.31010 | | C 9 0.32945 0.37896 0.22067 | 1.41454 15.15841 3.31008 | | C 10 0.15648 0.40911 0.22065 | 0.67186 16.36432 3.30979 | | C 11 0.15653 0.53238 0.22064 | 0.67209 21.29509 3.30964 | | C 12 0.32951 0.56253 0.22066 | 1.41480 22.50122 3.30990 | | C 13 0.64838 0.56253 0.22066 | 2.78393 22.50124 3.30991 | | C 14 0.82139 0.53238 0.22064 | 3.52678 21.29508 3.30965 | | H 1 0.76808 0.35501 0.22070 | 3.29792 14.20031 3.31048 | | H 2 0.20956 0.35501 0.22070 | 0.89980 14.20055 3.31045 | | H 3 0.20967 0.58648 0.22069 | 0.90026 23.45924 3.31029 | | H 4 0.76819 0.58648 0.22069 | 3.29839 23.45927 3.31031 | *----------------------------------------------------------------------------* ------------ K-POINT GRID ------------ Grid size = 60 x 1 x 1 Total points = 60 *---------------------------------- MAIN ------------------------------------* | Number of Wannier Functions : 18 | | Number of Objective Wannier Functions : 18 | | Number of input Bloch states : 18 | | Output verbosity (1=low, 5=high) : 1 | | Timing Level (1=low, 5=high) : 1 | | Optimisation (0=memory, 3=speed) : 3 | | Length Unit : Ang | | Post-processing setup (write *.nnkp) : F | | Using Gamma-only branch of algorithms : F | *----------------------------------------------------------------------------* *------------------------------- WANNIERISE ---------------------------------* | Total number of iterations : 1000 | | Number of CG steps before reset : 5 | | Trial step length for line search : 2.000 | | Convergence tolerence : 0.100E-09 | | Convergence window : -1 | | Iterations between writing output : 10 | | Iterations between backing up to disk : 100 | | Write r^2_nm to file : F | | Write xyz WF centres to file : F | | Write on-site energies <0n|H|0n> to file : F | | Use guiding centre to control phases : T | | Use phases for initial projections : F | | Iterations before starting guiding centres: 0 | | Iterations between using guiding centres : 1 | *----------------------------------------------------------------------------* *-------------------------------- PLOTTING ----------------------------------* | Plotting interpolated bandstructure : T | | Number of K-path sections : 1 | | Divisions along first K-path section : 100 | | Output format : gnuplot | | Output mode : s-k | *----------------------------------------------------------------------------* | K-space path sections: | | From: G 0.000 0.000 0.000 To: Z 0.500 0.000 0.000 | *----------------------------------------------------------------------------* *------------------------------- TRANSPORT ----------------------------------* | Transport mode : bulk | | Hamiltonian from external files : F | | System extended in : x | | Centre of the unit cell to which WF are translated (fract. coords): | | 0.000000, 0.000000, 0.000000 | | Fermi energy (eV) : -3.304 | *----------------------------------------------------------------------------* Time to read parameters 0.052 (sec) *---------------------------------- K-MESH ----------------------------------* +----------------------------------------------------------------------------+ | Distance to Nearest-Neighbour Shells | | ------------------------------------ | | Shell Distance (Ang^-1) Multiplicity | | ----- ----------------- ------------ | | 1 0.024389 2 | | 2 0.048778 2 | | 3 0.073168 2 | | 4 0.097557 2 | | 5 0.121946 2 | | 6 0.146335 2 | | 7 0.157080 2 | | 8 0.158962 4 | | 9 0.164479 4 | | 10 0.170725 2 | | 11 0.173284 4 | | 12 0.184909 4 | | 13 0.195114 2 | | 14 0.198859 4 | | 15 0.214681 4 | | 16 0.219503 2 | | 17 0.231993 4 | | 18 0.243892 2 | | 19 0.250486 4 | | 20 0.268281 2 | | 21 0.269918 4 | | 22 0.290099 4 | | 23 0.292671 2 | | 24 0.310884 4 | | 25 0.314159 2 | | 26 0.315104 4 | | 27 0.317060 2 | | 28 0.317923 4 | | 29 0.322567 4 | | 30 0.328958 4 | | 31 0.332160 4 | | 32 0.336997 4 | | 33 0.341449 2 | | 34 0.346569 4 | | 35 0.353837 4 | | 36 0.357551 4 | | 37 0.365838 2 | | 38 0.369818 4 | | 39 0.375848 4 | | 40 0.383246 4 | | 41 0.390227 2 | | 42 0.397718 4 | | 43 0.398135 4 | | 44 0.413123 4 | | 45 0.414617 2 | | 46 0.418879 2 | | 47 0.419588 4 | | 48 0.420656 4 | | 49 0.421709 4 | | 50 0.425221 4 | | 51 0.429362 4 | | 52 0.430089 4 | | 53 0.436269 4 | | 54 0.439006 2 | | 55 0.443375 4 | | 56 0.443704 4 | | 57 0.446344 4 | | 58 0.447363 4 | | 59 0.448027 8 | | 60 0.450014 8 | | 61 0.452334 4 | | 62 0.453307 8 | | 63 0.457876 8 | | 64 0.462092 4 | | 65 0.463395 2 | | 66 0.463686 8 | | 67 0.463986 4 | | 68 0.466262 4 | | 69 0.470688 8 | | 70 0.471239 2 | | 71 0.471869 4 | | 72 0.472907 4 | | 73 0.473756 4 | | 74 0.476885 4 | | 75 0.478832 8 | | 76 0.481231 4 | | 77 0.482217 4 | | 78 0.484709 4 | | 79 0.486761 4 | | 80 0.487784 2 | | 81 0.488060 8 | | 82 0.489294 4 | | 83 0.493437 4 | | 84 0.497428 4 | | 85 0.498312 8 | | 86 0.500972 4 | | 87 0.501211 4 | | 88 0.509526 8 | | 89 0.510034 4 | | 90 0.510995 4 | | 91 0.512174 2 | | 92 0.512452 4 | | 93 0.519853 4 | | 94 0.520195 4 | | 95 0.521640 8 | | 96 0.523599 4 | | 97 0.524166 8 | | 98 0.525344 4 | | 99 0.525866 8 | | 100 0.528686 8 | | 101 0.530612 4 | | 102 0.532609 8 | | 103 0.534593 8 | | 104 0.535720 4 | | 105 0.536563 2 | | 106 0.537612 8 | | 107 0.539835 4 | | 108 0.540414 4 | | 109 0.542255 4 | | 110 0.543663 8 | | 111 0.548325 8 | | 112 0.550729 8 | | 113 0.554727 4 | | 114 0.556145 4 | | 115 0.558771 8 | | 116 0.559083 4 | | 117 0.559849 4 | | 118 0.560952 2 | | 119 0.562780 8 | | 120 0.567747 8 | | 121 0.567972 4 | | 122 0.572483 4 | | 123 0.577615 8 | | 124 0.577902 8 | | 125 0.580198 4 | | 126 0.581939 4 | | 127 0.582530 4 | | 128 0.585341 2 | | 129 0.588328 8 | | 130 0.589378 4 | | 131 0.593642 8 | | 132 0.596576 4 | | 133 0.599843 8 | | 134 0.600847 4 | | 135 0.606051 4 | | 136 0.606783 4 | | 137 0.609730 2 | | 138 0.609951 8 | | 139 0.611836 4 | | 140 0.612113 8 | | 141 0.621768 4 | | 142 0.624656 4 | | 143 0.625094 8 | | 144 0.626785 8 | | 145 0.627672 4 | | 146 0.628318 2 | | 147 0.628791 4 | | 148 0.629639 4 | | 149 0.630209 4 | | 150 0.630496 4 | | 151 0.630968 8 | | 152 0.632380 8 | | 153 0.632564 4 | | 154 0.634120 2 | | 155 0.634727 8 | | 156 0.635847 4 | | 157 0.637999 8 | | 158 0.638743 8 | | 159 0.640043 4 | | 160 0.642181 8 | | 161 0.642933 4 | | 162 0.642957 4 | | 163 0.644043 4 | | 164 0.644103 8 | | 165 0.645134 4 | | 166 0.647255 8 | | 167 0.651099 4 | | 168 0.653018 8 | | 169 0.653201 8 | | 170 0.653285 4 | | 171 0.657916 4 | | 172 0.658509 2 | | 173 0.659996 8 | | 174 0.660909 4 | | 175 0.661650 4 | | 176 0.661866 8 | | 177 0.664319 4 | | 178 0.665556 4 | | 179 0.667613 8 | | 180 0.667879 8 | | 181 0.673993 4 | | 182 0.676024 8 | | 183 0.676984 4 | | 184 0.678232 4 | | 185 0.680041 8 | | 186 0.680705 4 | | 187 0.682898 2 | | 188 0.683197 4 | | 189 0.683287 8 | | 190 0.685201 8 | | 191 0.685906 4 | | 192 0.693138 4 | | 193 0.695112 8 | | 194 0.695980 4 | | 195 0.698594 8 | | 196 0.699207 8 | | 197 0.700090 4 | | 198 0.700731 4 | | 199 0.703783 4 | | 200 0.705728 8 | | 201 0.707287 2 | | 202 0.707675 4 | | 203 0.714119 4 | | 204 0.715102 4 | | 205 0.715604 8 | | 206 0.717017 8 | | 207 0.717496 8 | | 208 0.719780 4 | | 209 0.724520 4 | | 210 0.727063 4 | | 211 0.728946 8 | | 212 0.729609 4 | | 213 0.731676 2 | | 214 0.732446 8 | | 215 0.732621 4 | | 216 0.736721 8 | | 217 0.739636 4 | | 218 0.739750 4 | | 219 0.741487 8 | | 220 0.748348 4 | | 221 0.749703 8 | | 222 0.751459 4 | | 223 0.751695 4 | | 224 0.752789 4 | | 225 0.754607 8 | | 226 0.755144 4 | | 227 0.755538 8 | | 228 0.756066 2 | | 229 0.756244 8 | | 230 0.756718 8 | | 231 0.758681 8 | | 232 0.759978 4 | | 233 0.761420 8 | | 234 0.764927 8 | | 235 0.766492 4 | | 236 0.767348 8 | | 237 0.768278 8 | | 238 0.769193 8 | | 239 0.770608 4 | | 240 0.772211 4 | | 241 0.773919 4 | | 242 0.774203 8 | | 243 0.776042 8 | | 244 0.779944 8 | | 245 0.780444 4 | | 246 0.780455 2 | | 247 0.780717 4 | | 248 0.782471 8 | | 249 0.785353 8 | | 250 0.785398 2 | | 251 0.785776 4 | | 252 0.786400 8 | | 253 0.786911 4 | | 254 0.788798 4 | | 255 0.790046 4 | | 256 0.791433 4 | | 257 0.793553 8 | | 258 0.794808 4 | | 259 0.795435 4 | | 260 0.796095 8 | | 261 0.796105 4 | | 262 0.796270 4 | | 263 0.797157 8 | | 264 0.798914 4 | | 265 0.801130 4 | | 266 0.801385 8 | | 267 0.803696 8 | | 268 0.803739 4 | | 269 0.804844 2 | | 270 0.809271 4 | | 271 0.809753 4 | | 272 0.809876 8 | | 273 0.810620 4 | | 274 0.812310 8 | | 275 0.815494 4 | | 276 0.816384 8 | | 277 0.818738 4 | | 278 0.819006 8 | | 279 0.820029 4 | | 280 0.822019 4 | | 281 0.822352 8 | | 282 0.822395 4 | | 283 0.826246 4 | | 284 0.827904 8 | | 285 0.828752 8 | | 286 0.829233 2 | | 287 0.829708 4 | | 288 0.829954 4 | | 289 0.836892 8 | | 290 0.837758 2 | | 291 0.838113 4 | | 292 0.838156 4 | | 293 0.839095 8 | | 294 0.839177 4 | | 295 0.840947 4 | | 296 0.841302 8 | | 297 0.841312 4 | | 298 0.842289 4 | | 299 0.843095 4 | | 300 0.843419 4 | | 301 0.843915 8 | | 302 0.843980 4 | | 303 0.846587 4 | | 304 0.846981 4 | | 305 0.849895 4 | | 306 0.850012 8 | | 307 0.850442 4 | | 308 0.852357 4 | | 309 0.852706 8 | | 310 0.853623 2 | | 311 0.853751 8 | | 312 0.854977 4 | | 313 0.855491 8 | | 314 0.856409 4 | | 315 0.857604 8 | | 316 0.857922 8 | | 317 0.858725 4 | | 318 0.860179 4 | | 319 0.860319 8 | | 320 0.860526 8 | | 321 0.861036 8 | | 322 0.861481 8 | | 323 0.863985 4 | | 324 0.864346 4 | | 325 0.864827 8 | | 326 0.866037 4 | | 327 0.866422 4 | | 328 0.867955 4 | | 329 0.869286 8 | | 330 0.870297 4 | | 331 0.872537 4 | | 332 0.873481 8 | | 333 0.874403 8 | | 334 0.875531 4 | | 335 0.876999 4 | | 336 0.877095 8 | | 337 0.878012 2 | | 338 0.878504 8 | | 339 0.879666 4 | | 340 0.880006 8 | | 341 0.880167 8 | | 342 0.885759 4 | | 343 0.885990 8 | | 344 0.886564 8 | | 345 0.886749 4 | | 346 0.887409 4 | | 347 0.888120 4 | | 348 0.890117 4 | | 349 0.890451 8 | | 350 0.890899 4 | | 351 0.891453 8 | | 352 0.891952 4 | | 353 0.892688 4 | | 354 0.893119 8 | | 355 0.893581 8 | | 356 0.894222 8 | | 357 0.894726 4 | | 358 0.895058 8 | | 359 0.895448 8 | | 360 0.895748 4 | | 361 0.896054 8 | | 362 0.897712 8 | | 363 0.898432 8 | | 364 0.898986 8 | | 365 0.899580 8 | | 366 0.899725 8 | | 367 0.899764 4 | | 368 0.900029 8 | | 369 0.901204 8 | | 370 0.902066 8 | | 371 0.902401 2 | | 372 0.902998 8 | | 373 0.904669 4 | | 374 0.906342 8 | | 375 0.906614 8 | | 376 0.907322 4 | | 377 0.909417 8 | | 378 0.909597 4 | | 379 0.910174 4 | | 380 0.910868 8 | | 381 0.911251 8 | | 382 0.911679 8 | | 383 0.911688 4 | | 384 0.911912 4 | | 385 0.912450 8 | | 386 0.914153 4 | | 387 0.915753 8 | | 388 0.915970 4 | | 389 0.916783 8 | | 390 0.918205 8 | | 391 0.919669 8 | | 392 0.920819 8 | | 393 0.921258 8 | | 394 0.922926 8 | | 395 0.924184 4 | | 396 0.924545 4 | | 397 0.926360 8 | | 398 0.926790 2 | | 399 0.927371 8 | | 400 0.927550 8 | | 401 0.927973 4 | | 402 0.929025 4 | | 403 0.929449 8 | | 404 0.929669 8 | | 405 0.932524 4 | | 406 0.932652 4 | | 407 0.934082 8 | | 408 0.934743 4 | | 409 0.936998 8 | | 410 0.937438 8 | | 411 0.937641 4 | | 412 0.939822 8 | | 413 0.940007 4 | | 414 0.940697 8 | | 415 0.941377 8 | | 416 0.942211 8 | | 417 0.944900 8 | | 418 0.945814 4 | | 419 0.946065 4 | | 420 0.947513 8 | | 421 0.947850 8 | | 422 0.949242 8 | | 423 0.950858 4 | | 424 0.951179 2 | | 425 0.951183 4 | | 426 0.953361 8 | | 427 0.953779 4 | | 428 0.955441 8 | | 429 0.955523 4 | | 430 0.957378 4 | | 431 0.957665 8 | | 432 0.958769 8 | | 433 0.960172 8 | | 434 0.961199 4 | | 435 0.961509 8 | | 436 0.962365 8 | | 437 0.962436 8 | | 438 0.963745 8 | | 439 0.963980 8 | | 440 0.964062 4 | | 441 0.964435 4 | | 442 0.965151 4 | | 443 0.965855 8 | | 444 0.966137 8 | | 445 0.966629 8 | | 446 0.968904 8 | | 447 0.969418 4 | | 448 0.970179 8 | | 449 0.970574 8 | | 450 0.971898 8 | | 451 0.972275 8 | | 452 0.972813 4 | | 453 0.975058 4 | | 454 0.975569 2 | | 455 0.976121 8 | | 456 0.976243 8 | | 457 0.978589 4 | | 458 0.979527 4 | | 459 0.980706 8 | | 460 0.980802 8 | | 461 0.981916 4 | | 462 0.981945 8 | | 463 0.982062 8 | | 464 0.983066 4 | | 465 0.984460 8 | | 466 0.985413 8 | | 467 0.985944 8 | | 468 0.986079 8 | | 469 0.986124 8 | | 470 0.988134 4 | | 471 0.991659 8 | | 472 0.992489 8 | | 473 0.994294 4 | | 474 0.994401 8 | | 475 0.994856 4 | | 476 0.994880 4 | | 477 0.996479 4 | | 478 0.996624 8 | | 479 0.997937 8 | | 480 0.999958 2 | | 481 1.001412 8 | | 482 1.001718 4 | | 483 1.001937 8 | | 484 1.001945 4 | | 485 1.003312 8 | | 486 1.003516 8 | | 487 1.004769 8 | | 488 1.007180 8 | | 489 1.007205 8 | | 490 1.007606 8 | | 491 1.008219 4 | | 492 1.009434 4 | | 493 1.012142 8 | | 494 1.012220 4 | | 495 1.015009 8 | | 496 1.017054 4 | | 497 1.018034 4 | | 498 1.018132 8 | | 499 1.019052 8 | | 500 1.020045 8 | | 501 1.020382 8 | | 502 1.021057 4 | | 503 1.021989 4 | | 504 1.022282 8 | | 505 1.022399 8 | | 506 1.024347 2 | | 507 1.024905 4 | | 508 1.024931 4 | | 509 1.026952 8 | | 510 1.028466 8 | | 511 1.029113 8 | | 512 1.030949 8 | | 513 1.033991 8 | | 514 1.034649 8 | | 515 1.036151 4 | | 516 1.036321 4 | | 517 1.037392 8 | | 518 1.039328 4 | | 519 1.039331 8 | | 520 1.039714 4 | | 521 1.040390 4 | | 522 1.040769 4 | | 523 1.041707 8 | | 524 1.043280 8 | | 525 1.043304 8 | | 526 1.046810 8 | | 527 1.047197 4 | | 528 1.047481 8 | | 529 1.047990 8 | | 530 1.048147 4 | | 531 1.048333 8 | | 532 1.048736 2 | | 533 1.049750 8 | | 534 1.050688 4 | | 535 1.051131 8 | | 536 1.051472 8 | | 537 1.051731 8 | | 538 1.052129 8 | | 539 1.054273 8 | | 540 1.056031 8 | | 541 1.056707 8 | | 542 1.056932 4 | | 543 1.057372 8 | | 544 1.059932 4 | | 545 1.060435 4 | | 546 1.061022 8 | | 547 1.061224 8 | | 548 1.061512 4 | | 549 1.061694 4 | | 550 1.062365 8 | | 551 1.064470 8 | | 552 1.065219 8 | | 553 1.065332 8 | | 554 1.065585 4 | | 555 1.067070 8 | | 556 1.068587 8 | | 557 1.069186 8 | | 558 1.069955 8 | | 559 1.071440 4 | | 560 1.073125 2 | | 561 1.073251 8 | | 562 1.073406 4 | | 563 1.075223 8 | | 564 1.077101 8 | | 565 1.077886 8 | | 566 1.078925 8 | | 567 1.079670 4 | | 568 1.080827 4 | | 569 1.080939 8 | | 570 1.081016 8 | | 571 1.082730 8 | | 572 1.083420 4 | | 573 1.084147 4 | | 574 1.084561 4 | | 575 1.085771 8 | | 576 1.085980 8 | | 577 1.087326 8 | | 578 1.089140 8 | | 579 1.090176 4 | | 580 1.092182 8 | | 581 1.092894 8 | | 582 1.094143 8 | | 583 1.094780 4 | | 584 1.095468 8 | | 585 1.096400 4 | | 586 1.096650 8 | | 587 1.097515 2 | | 588 1.099596 4 | | 589 1.100819 8 | | 590 1.100842 8 | | 591 1.101458 8 | | 592 1.103638 8 | | 593 1.105433 4 | | 594 1.106683 4 | | 595 1.107199 8 | | 596 1.107223 8 | | 597 1.107230 4 | | 598 1.107595 8 | | 599 1.108699 4 | | 600 1.109261 8 | | 601 1.110931 8 | | 602 1.112290 4 | | 603 1.112911 8 | | 604 1.117542 8 | | 605 1.117775 8 | | 606 1.118166 4 | | 607 1.119698 4 | | 608 1.120922 8 | | 609 1.121549 8 | | 610 1.121900 8 | | 611 1.121904 2 | | 612 1.123327 8 | | 613 1.124555 4 | | 614 1.125401 8 | | 615 1.125559 8 | | 616 1.126290 8 | | 617 1.127543 4 | | 618 1.128483 4 | | 619 1.128748 8 | | 620 1.129295 4 | | 621 1.132847 4 | | 622 1.135495 8 | | 623 1.136910 8 | | 624 1.138277 8 | | 625 1.139363 8 | | 626 1.139699 8 | | 627 1.139967 4 | | 628 1.140167 8 | | 629 1.140522 8 | | 630 1.141169 8 | | 631 1.141593 4 | | 632 1.142137 4 | | 633 1.144966 4 | | 634 1.145145 8 | | 635 1.146293 2 | | 636 1.148341 4 | | 637 1.148600 8 | | 638 1.149377 8 | | 639 1.149745 4 | | 640 1.150410 8 | | 641 1.150670 8 | | 642 1.151526 8 | | 643 1.151980 4 | | 644 1.152241 8 | | 645 1.152478 8 | | 646 1.154798 8 | | 647 1.155230 8 | | 648 1.155691 8 | | 649 1.155805 8 | | 650 1.157006 4 | | 651 1.157628 8 | | 652 1.158079 8 | | 653 1.159966 4 | | 654 1.160396 4 | | 655 1.160963 8 | | 656 1.161576 8 | | 657 1.161728 4 | | 658 1.162640 8 | | 659 1.164799 8 | | 660 1.165060 4 | | 661 1.165134 8 | | 662 1.165737 8 | | 663 1.167880 8 | | 664 1.169132 8 | | 665 1.170682 2 | | 666 1.171396 8 | | 667 1.172034 4 | | 668 1.172179 8 | | 669 1.172300 8 | | 670 1.173955 8 | | 671 1.174733 4 | | 672 1.176657 8 | | 673 1.176678 8 | | 674 1.178030 4 | | 675 1.178756 4 | | 676 1.179090 8 | | 677 1.179264 8 | | 678 1.180974 4 | | 679 1.181174 4 | | 680 1.182134 8 | | 681 1.183815 8 | | 682 1.185050 8 | | 683 1.185189 8 | | 684 1.187284 8 | | 685 1.187977 8 | | 686 1.188564 4 | | 687 1.189176 8 | | 688 1.191308 8 | | 689 1.193381 8 | | 690 1.194049 8 | | 691 1.194405 4 | | 692 1.195072 2 | | 693 1.195485 8 | | 694 1.196039 4 | | 695 1.196318 4 | | 696 1.197551 4 | | 697 1.198030 8 | | 698 1.199686 8 | | 699 1.200035 8 | | 700 1.201695 4 | | 701 1.202835 8 | | 702 1.203457 8 | | 703 1.205208 8 | | 704 1.205351 4 | | 705 1.206310 8 | | 706 1.207809 8 | | 707 1.207996 8 | | 708 1.211773 8 | | 709 1.212103 4 | | 710 1.212833 8 | | 711 1.213566 4 | | 712 1.214490 8 | | 713 1.214821 4 | | 714 1.216016 8 | | 715 1.216527 8 | | 716 1.216854 4 | | 717 1.219461 2 | | 718 1.219902 8 | | 719 1.220429 4 | | 720 1.220899 8 | | 721 1.222551 4 | | 722 1.222922 8 | | 723 1.223672 8 | | 724 1.223690 8 | | 725 1.224226 8 | | 726 1.229396 8 | | 727 1.229536 4 | | 728 1.230496 8 | | 729 1.231327 4 | | 730 1.233280 8 | | 731 1.233528 4 | | 732 1.233684 8 | | 733 1.235675 4 | | 734 1.236610 8 | | 735 1.237035 8 | | 736 1.238073 8 | | 737 1.238149 8 | | 738 1.238314 8 | | 739 1.239376 4 | | 740 1.241306 8 | | 741 1.243365 4 | | 742 1.243536 4 | | 743 1.243850 2 | | 744 1.244638 8 | | 745 1.247646 8 | | 746 1.249311 4 | | 747 1.250189 8 | | 748 1.250285 8 | | 749 1.252431 4 | | 750 1.253060 8 | | 751 1.253248 8 | | 752 1.253570 8 | | 753 1.253666 8 | | 754 1.253729 4 | | 755 1.256637 2 | | 756 1.256873 4 | | 757 1.257382 8 | | 758 1.257583 4 | | 759 1.258765 4 | | 760 1.259147 8 | | 761 1.259278 4 | | 762 1.260216 8 | | 763 1.260418 4 | | 764 1.261968 4 | | 765 1.262540 4 | | 766 1.263676 8 | | 767 1.264643 4 | | 768 1.265128 4 | | 769 1.265727 8 | | 770 1.266355 4 | | 771 1.266416 4 | | 772 1.266651 8 | | 773 1.267355 8 | | 774 1.267510 4 | | 775 1.267512 8 | | 776 1.267532 8 | | 777 1.268181 4 | | 778 1.268239 2 | | 779 1.268528 8 | | 780 1.269461 8 | | 781 1.270168 8 | | 782 1.270772 8 | | 783 1.271521 4 | | 784 1.271694 4 | | 785 1.272274 8 | | 786 1.272608 8 | | 787 1.274843 8 | | 788 1.275663 4 | | 789 1.276060 8 | | 790 1.277206 8 | | 791 1.277487 8 | | 792 1.277872 8 | | 793 1.277930 4 | | 794 1.278028 8 | | 795 1.280086 4 | | 796 1.281358 8 | | 797 1.282440 8 | | 798 1.282910 4 | | 799 1.284625 4 | | 800 1.284956 4 | | 801 1.285009 8 | | 802 1.285298 8 | | 803 1.285525 8 | | 804 1.285866 4 | | 805 1.285913 4 | | 806 1.286932 8 | | 807 1.288206 8 | | 808 1.288919 8 | | 809 1.289397 4 | | 810 1.289687 8 | | 811 1.290268 4 | | 812 1.290789 4 | | 813 1.291610 8 | | 814 1.292320 8 | | 815 1.292628 2 | | 816 1.294521 8 | | 817 1.295311 4 | | 818 1.295471 8 | | 819 1.295541 8 | | 820 1.296018 4 | | 821 1.296230 8 | | 822 1.297376 8 | | 823 1.298930 8 | | 824 1.298980 8 | | 825 1.299795 8 | | 826 1.300176 8 | | 827 1.301039 8 | | 828 1.301848 8 | | 829 1.302138 4 | | 830 1.302199 4 | | 831 1.302709 8 | | 832 1.303551 8 | | 833 1.304513 4 | | 834 1.304742 8 | | 835 1.305502 8 | | 836 1.305862 8 | | 837 1.306037 8 | | 838 1.306514 8 | | 839 1.306571 4 | | 840 1.307200 4 | | 841 1.307345 4 | | 842 1.308248 8 | | 843 1.308806 4 | | 844 1.309924 8 | | 845 1.310228 4 | | 846 1.311639 8 | | 847 1.311791 8 | | 848 1.312190 8 | | 849 1.312487 4 | | 850 1.313778 8 | | 851 1.313936 8 | | 852 1.315832 4 | | 853 1.317018 2 | | 854 1.318072 8 | | 855 1.318199 8 | | 856 1.318420 8 | | 857 1.320622 8 | | 858 1.320756 8 | | 859 1.321853 8 | | 860 1.322803 8 | | 861 1.323270 4 | | 862 1.323301 4 | | 863 1.323733 8 | | 864 1.323753 8 | | 865 1.325174 8 | | 866 1.326352 4 | | 867 1.327117 8 | | 868 1.327964 8 | | 869 1.328639 4 | | 870 1.329670 8 | | 871 1.329830 4 | | 872 1.330124 4 | | 873 1.330257 4 | | 874 1.331113 4 | | 875 1.332209 8 | | 876 1.332560 8 | | 877 1.332591 8 | | 878 1.333551 8 | | 879 1.335232 8 | | 880 1.335624 4 | | 881 1.335758 8 | | 882 1.336053 8 | | 883 1.338740 8 | | 884 1.339355 4 | | 885 1.339559 8 | | 886 1.340349 8 | | 887 1.341407 2 | | 888 1.341808 8 | | 889 1.342089 4 | | 890 1.342269 4 | | 891 1.342310 8 | | 892 1.342975 8 | | 893 1.344082 8 | | 894 1.344829 8 | | 895 1.345630 8 | | 896 1.345983 8 | | 897 1.347617 8 | | 898 1.347987 4 | | 899 1.348534 8 | | 900 1.348682 8 | | 901 1.349562 8 | | 902 1.349588 4 | | 903 1.350043 8 | | 904 1.350178 4 | | 905 1.350573 4 | | 906 1.351034 8 | | 907 1.351193 8 | | 908 1.351429 8 | | 909 1.352274 8 | | 910 1.352373 8 | | 911 1.352815 8 | | 912 1.352904 8 | | 913 1.352958 4 | | 914 1.353969 4 | | 915 1.356197 8 | | 916 1.357003 4 | | 917 1.357054 8 | | 918 1.357108 8 | | 919 1.358804 4 | | 920 1.359920 8 | | 921 1.360051 8 | | 922 1.360081 8 | | 923 1.361410 4 | | 924 1.361631 8 | | 925 1.364069 8 | | 926 1.365796 2 | | 927 1.366064 8 | | 928 1.366395 4 | | 929 1.366575 8 | | 930 1.367683 8 | | 931 1.367853 8 | | 932 1.368640 8 | | 933 1.369495 4 | | 934 1.369539 8 | | 935 1.370442 8 | | 936 1.371812 4 | | 937 1.372074 8 | | 938 1.372673 8 | | 939 1.372811 8 | | 940 1.373629 8 | | 941 1.374799 4 | | 942 1.374890 8 | | 943 1.375394 8 | | 944 1.375557 8 | | 945 1.375706 8 | | 946 1.375847 4 | | 947 1.376155 4 | | 948 1.377704 4 | | 949 1.378543 8 | | 950 1.379032 8 | | 951 1.380716 4 | | 952 1.382026 4 | | 953 1.382371 8 | | 954 1.384112 8 | | 955 1.384843 8 | | 956 1.385091 8 | | 957 1.386276 4 | | 958 1.387018 8 | | 959 1.388451 8 | | 960 1.389546 4 | | 961 1.389622 8 | | 962 1.390185 2 | | 963 1.390924 8 | | 964 1.391057 8 | | 965 1.392894 8 | | 966 1.393105 8 | | 967 1.393537 4 | | 968 1.394241 8 | | 969 1.394521 8 | | 970 1.394648 8 | | 971 1.395147 8 | | 972 1.396749 4 | | 973 1.397187 8 | | 974 1.397669 8 | | 975 1.398414 8 | | 976 1.398786 4 | | 977 1.399032 4 | | 978 1.400181 4 | | 979 1.401462 4 | | 980 1.402045 8 | | 981 1.402306 8 | | 982 1.404674 8 | | 983 1.404703 8 | | 984 1.404962 4 | | 985 1.405174 8 | | 986 1.405287 4 | | 987 1.405554 8 | | 988 1.405809 8 | | 989 1.406866 8 | | 990 1.407567 4 | | 991 1.408345 8 | | 992 1.408964 8 | | 993 1.409733 4 | | 994 1.410245 8 | | 995 1.411559 8 | | 996 1.412065 8 | | 997 1.412563 8 | | 998 1.413099 8 | | 999 1.413662 8 | | *** 1.414039 8 | | *** 1.414575 2 | +----------------------------------------------------------------------------+ | The b-vectors are chosen automatically | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | SVD found small singular value, Rejecting this shell and trying the next | | The following shells are used: 1, 7, 46 | +----------------------------------------------------------------------------+ | Shell # Nearest-Neighbours | | ----- -------------------- | | 1 2 | | 7 2 | | 46 2 | +----------------------------------------------------------------------------+ | Completeness relation is fully satisfied [Eq. (B1), PRB 56, 12847 (1997)] | +----------------------------------------------------------------------------+ | b_k Vectors (Ang^-1) and Weights (Ang^2) | | ---------------------------------------- | | No. b_k(x) b_k(y) b_k(z) w_b | | --- -------------------------------- -------- | | 1 0.024389 0.000000 0.000000 840.570528 | | 2 -0.024389 0.000000 0.000000 840.570528 | | 3 0.000000 0.157080 0.000000 20.264266 | | 4 0.000000 -0.157080 0.000000 20.264266 | | 5 0.000000 0.000000 0.418879 2.849660 | | 6 0.000000 0.000000 -0.418879 2.849660 | +----------------------------------------------------------------------------+ | b_k Directions (Ang^-1) | | ----------------------- | | No. x y z | | --- -------------------------------- | | 1 0.024389 0.000000 0.000000 | | 2 0.000000 0.157080 0.000000 | | 3 0.000000 0.000000 0.418879 | +----------------------------------------------------------------------------+ Time to get kmesh 2.990 (sec) *============================================================================* | MEMORY ESTIMATE | | Maximum RAM allocated during each phase of the calculation | *============================================================================* | Wannierise: 5.05 Mb | | plot_wannier: 5.05 Mb | *----------------------------------------------------------------------------* Starting a new Wannier90 calculation ... Reading overlaps from GrapACW.mmn : Created on 18Jan2021 at 21:16:28 Reading projections from GrapACW.amn : Created on 18Jan2021 at 21:15: 5 Time to read overlaps 0.375 (sec) Writing checkpoint file GrapACW.chk... done *------------------------------- WANNIERISE ---------------------------------* +--------------------------------------------------------------------+<-- CONV | Iter Delta Spread RMS Gradient Spread (Ang^2) Time |<-- CONV +--------------------------------------------------------------------+<-- CONV ------------------------------------------------------------------------------ Initial State WF centre and spread 1 ( 4.741454, 18.746659, 3.337010 ) 1081.37473921 WF centre and spread 2 ( 3.528909, 17.283968, 3.318513 ) 783.70805890 WF centre and spread 3 ( 0.847313, 17.317059, 3.317604 ) 776.11668626 WF centre and spread 4 ( 1.457219, 18.750113, 3.342946 ) 1059.79758810 WF centre and spread 5 ( 2.020357, 20.395436, 3.315332 ) 813.74292598 WF centre and spread 6 ( 4.698125, 20.347856, 3.313222 ) 813.89258671 WF centre and spread 7 ( 3.853262, 16.549359, 3.315221 ) 646.94823611 WF centre and spread 8 ( 3.187971, 17.208494, 3.276571 ) 1021.19278532 WF centre and spread 9 ( 0.005047, 17.191937, 3.278351 ) 1034.62572643 WF centre and spread 10 ( -0.424386, 16.532429, 3.314427 ) 625.22047839 WF centre and spread 11 ( 0.720361, 21.228975, 3.323583 ) 679.95201938 WF centre and spread 12 ( 1.677411, 20.588128, 3.278799 ) 992.59926926 WF centre and spread 13 ( 3.349977, 20.644817, 3.279087 ) 994.94942989 WF centre and spread 14 ( 5.183140, 21.181335, 3.317140 ) 699.91642628 WF centre and spread 15 ( 3.170303, 15.298118, 3.310214 ) 111.06543691 WF centre and spread 16 ( 1.012934, 15.296795, 3.310229 ) 110.84412712 WF centre and spread 17 ( 0.991803, 22.371885, 3.310359 ) 110.68156642 WF centre and spread 18 ( 3.225672, 22.373381, 3.310286 ) 110.58154676 Sum of centres and spreads ( 43.246875,339.306742, 59.568894 ) 12467.20963344 0 0.125E+05 0.0000000000 12467.2095722354 0.00 <-- CONV O_D= 723.9527846 O_OD= 11143.5018108 O_TOT= 12467.2095722 <-- SPRD ------------------------------------------------------------------------------ Cycle: 1 WF centre and spread 1 ( 5.204787, 18.979952, 3.336002 ) 952.11900803 WF centre and spread 2 ( 3.633234, 17.223821, 3.320816 ) 550.56916363 WF centre and spread 3 ( 0.906168, 17.327996, 3.317058 ) 574.97419574 WF centre and spread 4 ( 1.522876, 18.671036, 3.342530 ) 861.17393049 WF centre and spread 5 ( 1.918515,-19.543269, 3.313820 ) 610.21859367 WF centre and spread 6 ( 4.874640,-19.649174, 3.313111 ) 606.84324594 WF centre and spread 7 ( 4.162883, 16.525531, 3.312731 ) 460.78272206 WF centre and spread 8 ( 4.264487, 17.219944, 3.272245 ) 796.84731761 WF centre and spread 9 ( 1.238686, 17.273126, 3.270007 ) 825.21078484 WF centre and spread 10 ( 0.129777, 16.496299, 3.318482 ) 449.12152116 WF centre and spread 11 ( 1.185876,-18.737392, 3.330072 ) 491.54687661 WF centre and spread 12 ( 3.134089,-19.584302, 3.277579 ) 778.72562132 WF centre and spread 13 ( 2.595540,-19.442942, 3.281508 ) 814.70859148 WF centre and spread 14 ( 5.013836,-18.795469, 3.318317 ) 490.83434733 WF centre and spread 15 ( 3.170730, 15.289043, 3.310921 ) 96.00480045 WF centre and spread 16 ( 0.992945, 15.286652, 3.310842 ) 94.87654875 WF centre and spread 17 ( 1.060391,-17.601070, 3.310905 ) 96.95162475 WF centre and spread 18 ( 3.165109,-17.590366, 3.310777 ) 95.81473520 Sum of centres and spreads ( 48.174569, 19.349417, 59.567723 ) 9647.32362905 1 -0.282E+04 755.9887919694 9647.3235597629 0.08 <-- CONV O_D= 936.5028173 O_OD= 8111.0657656 O_TOT= 9647.3235598 <-- SPRD Delta: O_D= 0.2125500E+03 O_OD= -0.3032436E+04 O_TOT= -0.2819886E+04 <-- DLTA ------------------------------------------------------------------------------ Cycle: 10 WF centre and spread 1 ( 4.705549, 18.696082, 3.329465 ) 169.68674729 WF centre and spread 2 ( 4.394985, 16.955093, 3.321846 ) 119.92506290 WF centre and spread 3 ( 1.983926, 16.958495, 3.313810 ) 135.59326511 WF centre and spread 4 ( 2.170896, 18.941192, 3.343745 ) 204.23975993 WF centre and spread 5 ( 0.998020,-19.464487, 3.307549 ) 121.86379440 WF centre and spread 6 ( 4.517143,-19.257528, 3.311446 ) 141.80283159 WF centre and spread 7 ( 4.642532, 16.459110, 3.309395 ) 98.13819635 WF centre and spread 8 ( 5.881570, 17.113080, 3.283275 ) 234.22188448 WF centre and spread 9 ( 0.888102, 17.118323, 3.267855 ) 217.30678870 WF centre and spread 10 ( 0.566136, 16.438570, 3.328292 ) 124.47616087 WF centre and spread 11 ( 1.176115,-18.512685, 3.325942 ) 104.71941929 WF centre and spread 12 ( 4.608711,-19.482656, 3.286620 ) 232.18236903 WF centre and spread 13 ( 1.746591,-19.454414, 3.275215 ) 232.81739041 WF centre and spread 14 ( 4.214299,-18.684864, 3.329499 ) 141.73650678 WF centre and spread 15 ( 2.796904, 15.279406, 3.307420 ) 60.43956599 WF centre and spread 16 ( 1.151174, 15.230574, 3.310235 ) 73.05294420 WF centre and spread 17 ( 0.763462,-17.411969, 3.309680 ) 70.63368174 WF centre and spread 18 ( 3.252304,-17.527544, 3.306947 ) 74.65471050 Sum of centres and spreads ( 50.458420, 19.393781, 59.568236 ) 2557.49107955 10 -0.117E+03 296.4462056140 2557.4910025509 0.64 <-- CONV O_D= 117.6089077 O_OD= 1840.1271180 O_TOT= 2557.4910026 <-- SPRD Delta: O_D= -0.1150557E+02 O_OD= -0.1050726E+03 O_TOT= -0.1165782E+03 <-- DLTA ------------------------------------------------------------------------------ Cycle: 20 WF centre and spread 1 ( 5.131431, 18.542168, 3.326833 ) 102.23407946 WF centre and spread 2 ( 3.937614, 16.905671, 3.322623 ) 55.65016273 WF centre and spread 3 ( 2.666001, 16.425134, 3.310025 ) 71.50807198 WF centre and spread 4 ( 1.241665, 18.800272, 3.341385 ) 113.64170588 WF centre and spread 5 ( 0.985809,-19.317386, 3.309133 ) 59.52079260 WF centre and spread 6 ( 3.987813,-19.089088, 3.311152 ) 63.89636703 WF centre and spread 7 ( 4.476737, 16.484942, 3.310383 ) 56.71794437 WF centre and spread 8 ( 6.041999, 17.600076, 3.306540 ) 162.24505399 WF centre and spread 9 ( 0.834408, 16.851076, 3.262588 ) 136.46235631 WF centre and spread 10 ( 0.483184, 16.430112, 3.330220 ) 79.22473768 WF centre and spread 11 ( 0.758714,-18.495988, 3.321183 ) 53.55956755 WF centre and spread 12 ( 4.961391,-18.225127, 3.290760 ) 145.19618740 WF centre and spread 13 ( 2.003235,-19.929598, 3.277921 ) 138.80670591 WF centre and spread 14 ( 3.757976,-18.841869, 3.330800 ) 65.96788833 WF centre and spread 15 ( 2.452669, 15.375053, 3.305562 ) 58.67619708 WF centre and spread 16 ( 1.167960, 15.149404, 3.308669 ) 63.80954334 WF centre and spread 17 ( 0.701823,-17.286389, 3.309052 ) 71.76187728 WF centre and spread 18 ( 3.482294,-17.566263, 3.302096 ) 74.71623561 Sum of centres and spreads ( 49.072723, 19.812201, 59.576925 ) 1573.59547454 20 -0.307E+02 96.6909766104 1573.5953992725 1.23 <-- CONV O_D= 41.9310447 O_OD= 931.9093777 O_TOT= 1573.5953993 <-- SPRD Delta: O_D= -0.6911344E+01 O_OD= -0.2376065E+02 O_TOT= -0.3067199E+02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 30 WF centre and spread 1 ( 5.588850, 18.469827, 3.310094 ) 108.97417724 WF centre and spread 2 ( 3.704350, 17.010980, 3.321471 ) 42.63602490 WF centre and spread 3 ( 2.709687, 16.449069, 3.309631 ) 53.40271318 WF centre and spread 4 ( 1.110202, 18.459979, 3.319834 ) 119.43141833 WF centre and spread 5 ( 1.360460,-19.361009, 3.307693 ) 48.94213290 WF centre and spread 6 ( 3.467228,-19.160430, 3.314430 ) 41.23336864 WF centre and spread 7 ( 4.313742, 16.482248, 3.307178 ) 44.18315253 WF centre and spread 8 ( 4.957750, 17.710962, 3.327247 ) 164.66421627 WF centre and spread 9 ( 0.604893, 16.895515, 3.258102 ) 115.45682288 WF centre and spread 10 ( 0.479086, 16.354836, 3.331718 ) 75.63130375 WF centre and spread 11 ( 0.630188,-18.464410, 3.319947 ) 45.37796566 WF centre and spread 12 ( 4.286737,-17.612312, 3.284688 ) 158.83829562 WF centre and spread 13 ( 1.940934, 19.724872, 3.289132 ) 121.81436087 WF centre and spread 14 ( 3.885849,-18.883097, 3.324588 ) 50.88589732 WF centre and spread 15 ( 2.255025, 15.538446, 3.311180 ) 57.52893506 WF centre and spread 16 ( 1.114098, 15.032453, 3.309881 ) 52.92685034 WF centre and spread 17 ( 0.679793,-17.198050, 3.310242 ) 73.82029490 WF centre and spread 18 ( 3.760729,-17.738336, 3.304154 ) 88.71524245 Sum of centres and spreads ( 46.849597, 59.711543, 59.561209 ) 1464.46317284 30 -0.815E+02 187.9808887174 1464.4631049370 1.79 <-- CONV O_D= 53.2554786 O_OD= 811.4526495 O_TOT= 1464.4631049 <-- SPRD Delta: O_D= -0.1152882E+02 O_OD= -0.6995020E+02 O_TOT= -0.8147901E+02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 40 WF centre and spread 1 ( 5.610371, 18.443812, 3.314082 ) 106.37793085 WF centre and spread 2 ( 3.702485, 16.999587, 3.321127 ) 33.14687883 WF centre and spread 3 ( 2.709474, 16.464689, 3.309540 ) 46.65320215 WF centre and spread 4 ( 1.097719, 18.379786, 3.313457 ) 113.52114573 WF centre and spread 5 ( 1.400421,-19.326454, 3.307661 ) 40.30436290 WF centre and spread 6 ( 3.438850,-19.144473, 3.314800 ) 34.75207502 WF centre and spread 7 ( 4.276129, 16.487122, 3.307900 ) 39.03132022 WF centre and spread 8 ( 5.357163, 17.917145, 3.329037 ) 150.04984194 WF centre and spread 9 ( 0.576217, 16.745856, 3.256756 ) 97.50104417 WF centre and spread 10 ( 0.522124, 16.326629, 3.330755 ) 70.38413396 WF centre and spread 11 ( 0.624434,-18.464005, 3.318863 ) 37.05867421 WF centre and spread 12 ( 4.185375,-17.520111, 3.283685 ) 124.91252354 WF centre and spread 13 ( 2.102453, 19.695697, 3.292978 ) 111.20171705 WF centre and spread 14 ( 3.900672,-18.863982, 3.324294 ) 45.56448478 WF centre and spread 15 ( 2.234241, 15.577167, 3.310306 ) 52.07133054 WF centre and spread 16 ( 1.094632, 15.004788, 3.309029 ) 46.57720106 WF centre and spread 17 ( 0.623286,-17.172067, 3.309905 ) 70.27362550 WF centre and spread 18 ( 3.827877,-17.818549, 3.304782 ) 86.05177231 Sum of centres and spreads ( 47.283924, 59.732637, 59.558958 ) 1305.43326476 40 -0.275E+01 140.2364942880 1305.4331952054 2.37 <-- CONV O_D= 28.5853426 O_OD= 677.0928757 O_TOT= 1305.4331952 <-- SPRD Delta: O_D= -0.1967934E+01 O_OD= -0.7831969E+00 O_TOT= -0.2751131E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 50 WF centre and spread 1 ( 5.618217, 18.426968, 3.316557 ) 108.72154656 WF centre and spread 2 ( 3.701101, 17.003735, 3.320609 ) 31.11700285 WF centre and spread 3 ( 2.688039, 16.500115, 3.309475 ) 43.61866479 WF centre and spread 4 ( 1.139181, 18.319466, 3.296589 ) 116.11971485 WF centre and spread 5 ( 1.410103,-19.307057, 3.307604 ) 37.44063378 WF centre and spread 6 ( 3.415400,-19.140793, 3.314898 ) 32.78832141 WF centre and spread 7 ( 4.245587, 16.492417, 3.308592 ) 36.16213700 WF centre and spread 8 ( 5.510188, 17.862009, 3.330301 ) 147.33043512 WF centre and spread 9 ( 0.597427, 16.676572, 3.257024 ) 91.41847173 WF centre and spread 10 ( 0.523229, 16.296932, 3.329788 ) 69.68816684 WF centre and spread 11 ( 0.615696,-18.461891, 3.318092 ) 35.55229671 WF centre and spread 12 ( 4.154394,-17.462135, 3.283032 ) 120.19172029 WF centre and spread 13 ( 2.154701, 19.641584, 3.295243 ) 107.80277807 WF centre and spread 14 ( 3.913077,-18.841515, 3.323346 ) 42.60597310 WF centre and spread 15 ( 2.208307, 15.635074, 3.309330 ) 49.18997611 WF centre and spread 16 ( 1.060577, 14.978227, 3.309307 ) 43.65274022 WF centre and spread 17 ( 0.595170,-17.142116, 3.309977 ) 70.06886769 WF centre and spread 18 ( 3.809603,-17.891782, 3.305545 ) 85.15586322 Sum of centres and spreads ( 47.359998, 59.585810, 59.545308 ) 1268.62531033 50 -0.157E+01 65.8561372920 1268.6252403632 2.96 <-- CONV O_D= 25.6420311 O_OD= 643.2282324 O_TOT= 1268.6252404 <-- SPRD Delta: O_D= -0.1078527E+01 O_OD= -0.4932324E+00 O_TOT= -0.1571760E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 60 WF centre and spread 1 ( 5.611551, 18.426236, 3.317841 ) 110.23443827 WF centre and spread 2 ( 3.701335, 17.006724, 3.320434 ) 30.21931105 WF centre and spread 3 ( 2.671066, 16.522943, 3.309387 ) 42.18328132 WF centre and spread 4 ( 1.175153, 18.302803, 3.296034 ) 117.33489062 WF centre and spread 5 ( 1.411992,-19.297829, 3.307661 ) 36.12078497 WF centre and spread 6 ( 3.403294,-19.140942, 3.314891 ) 32.03541875 WF centre and spread 7 ( 4.228548, 16.495281, 3.308985 ) 34.69342343 WF centre and spread 8 ( 5.544861, 17.830583, 3.330692 ) 145.81652416 WF centre and spread 9 ( 0.616617, 16.654042, 3.257882 ) 88.72351045 WF centre and spread 10 ( 0.524089, 16.277984, 3.329030 ) 69.73117231 WF centre and spread 11 ( 0.612182,-18.461349, 3.317687 ) 34.83720601 WF centre and spread 12 ( 4.129202,-17.460766, 3.282542 ) 118.63133580 WF centre and spread 13 ( 2.182316, 19.609414, 3.296349 ) 106.09898418 WF centre and spread 14 ( 3.915440,-18.829824, 3.322748 ) 41.13247327 WF centre and spread 15 ( 2.196106, 15.665212, 3.308872 ) 47.92574991 WF centre and spread 16 ( 1.042192, 14.959994, 3.309601 ) 42.41816650 WF centre and spread 17 ( 0.583495,-17.128307, 3.310003 ) 69.92455185 WF centre and spread 18 ( 3.807576,-17.925070, 3.305914 ) 84.62979764 Sum of centres and spreads ( 47.357015, 59.507129, 59.546553 ) 1252.69102051 60 -0.113E+01 58.6946028199 1252.6909505795 3.59 <-- CONV O_D= 24.6686112 O_OD= 628.2673626 O_TOT= 1252.6909506 <-- SPRD Delta: O_D= -0.7811496E+00 O_OD= -0.3467607E+00 O_TOT= -0.1127910E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 70 WF centre and spread 1 ( 5.600175, 18.433860, 3.319182 ) 111.61508801 WF centre and spread 2 ( 3.701016, 17.009689, 3.320276 ) 29.34736264 WF centre and spread 3 ( 2.650294, 16.549775, 3.309265 ) 40.73870241 WF centre and spread 4 ( 1.216657, 18.300791, 3.290024 ) 118.60484906 WF centre and spread 5 ( 1.412616,-19.288717, 3.307778 ) 34.71698155 WF centre and spread 6 ( 3.390414,-19.142491, 3.314862 ) 31.27820938 WF centre and spread 7 ( 4.210564, 16.497935, 3.309412 ) 33.14982889 WF centre and spread 8 ( 5.526458, 17.774307, 3.331182 ) 144.69172945 WF centre and spread 9 ( 0.639999, 16.630645, 3.259224 ) 86.17988897 WF centre and spread 10 ( 0.526372, 16.253602, 3.328047 ) 69.88220013 WF centre and spread 11 ( 0.608317,-18.461858, 3.317213 ) 34.09127368 WF centre and spread 12 ( 4.140141,-17.474441, 3.282064 ) 117.30293283 WF centre and spread 13 ( 2.208033, 19.574142, 3.297605 ) 104.38175056 WF centre and spread 14 ( 3.915806,-18.818396, 3.322101 ) 39.61184355 WF centre and spread 15 ( 2.182872, 15.696180, 3.308331 ) 46.69328810 WF centre and spread 16 ( 1.023839, 14.939082, 3.309910 ) 41.34961329 WF centre and spread 17 ( 0.571065,-17.115582, 3.310066 ) 69.70117686 WF centre and spread 18 ( 3.791446,-17.956728, 3.306256 ) 83.98837806 Sum of centres and spreads ( 47.316084, 59.401794, 59.542800 ) 1237.32509745 70 -0.794E+00 54.4960579051 1237.3250277478 4.17 <-- CONV O_D= 24.1605989 O_OD= 613.4094520 O_TOT= 1237.3250277 <-- SPRD Delta: O_D= -0.1789993E+00 O_OD= -0.6154074E+00 O_TOT= -0.7944067E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 80 WF centre and spread 1 ( 5.591288, 18.445515, 3.319943 ) 112.22096427 WF centre and spread 2 ( 3.700575, 17.011213, 3.320194 ) 28.83377638 WF centre and spread 3 ( 2.636800, 16.566785, 3.309191 ) 39.88356073 WF centre and spread 4 ( 1.246611, 18.481187, 3.273191 ) 120.96465655 WF centre and spread 5 ( 1.412259,-19.283574, 3.307888 ) 33.87382525 WF centre and spread 6 ( 3.382342,-19.144425, 3.314830 ) 30.79936106 WF centre and spread 7 ( 4.200459, 16.499483, 3.309677 ) 32.26725884 WF centre and spread 8 ( 5.568803, 17.756655, 3.331461 ) 143.80030528 WF centre and spread 9 ( 0.655609, 16.619278, 3.260244 ) 84.77256584 WF centre and spread 10 ( 0.528873, 16.237657, 3.327408 ) 69.97674046 WF centre and spread 11 ( 0.605701,-18.462716, 3.316909 ) 33.66855225 WF centre and spread 12 ( 4.121991,-17.486136, 3.281900 ) 116.69875875 WF centre and spread 13 ( 2.225343, 19.553437, 3.298386 ) 103.34804223 WF centre and spread 14 ( 3.914582,-18.812509, 3.321703 ) 38.75461440 WF centre and spread 15 ( 2.177283, 15.713908, 3.308014 ) 46.03618889 WF centre and spread 16 ( 1.012864, 14.925453, 3.310064 ) 40.77996711 WF centre and spread 17 ( 0.564667,-17.109188, 3.310073 ) 69.52226045 WF centre and spread 18 ( 3.809336,-17.973961, 3.306434 ) 83.79561641 Sum of centres and spreads ( 47.355386, 59.538062, 59.527511 ) 1229.99701515 80 0.731E+00 57.7578234701 1229.9969453556 4.76 <-- CONV O_D= 25.2825927 O_OD= 604.9593758 O_TOT= 1229.9969454 <-- SPRD Delta: O_D= 0.1253158E+01 O_OD= -0.5221259E+00 O_TOT= 0.7310322E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 90 WF centre and spread 1 ( 5.574281, 18.485321, 3.321128 ) 113.05365258 WF centre and spread 2 ( 3.701444, 17.012342, 3.320187 ) 28.22386215 WF centre and spread 3 ( 2.612121, 16.597316, 3.309111 ) 38.66364631 WF centre and spread 4 ( 1.265216, 17.779009, 3.299717 ) 130.04834250 WF centre and spread 5 ( 1.408275,-19.275277, 3.308101 ) 32.59169312 WF centre and spread 6 ( 3.367505,-19.147315, 3.314826 ) 30.50919889 WF centre and spread 7 ( 4.183562, 16.502810, 3.310110 ) 30.86823157 WF centre and spread 8 ( 5.559315, 17.449643, 3.332140 ) 160.25091820 WF centre and spread 9 ( 0.683316, 16.601630, 3.262355 ) 82.49636039 WF centre and spread 10 ( 0.526432, 16.207533, 3.326243 ) 69.85003920 WF centre and spread 11 ( 0.598138,-18.468071, 3.316364 ) 32.94948227 WF centre and spread 12 ( 3.941341,-17.572234, 3.281604 ) 116.97036180 WF centre and spread 13 ( 2.257793, 19.518125, 3.299791 ) 102.10807753 WF centre and spread 14 ( 3.910052,-18.802208, 3.321001 ) 37.48908192 WF centre and spread 15 ( 2.162208, 15.744139, 3.307418 ) 44.98606461 WF centre and spread 16 ( 0.989005, 14.900235, 3.310264 ) 39.93480571 WF centre and spread 17 ( 0.551313,-17.100102, 3.310049 ) 69.31498019 WF centre and spread 18 ( 3.629574,-18.000362, 3.306678 ) 84.79861182 Sum of centres and spreads ( 46.920893, 58.432534, 59.557087 ) 1245.10741075 90 0.209E+02 46.6642523961 1245.1073423206 5.36 <-- CONV O_D= 51.6651196 O_OD= 593.6872458 O_TOT= 1245.1073423 <-- SPRD Delta: O_D= 0.2764800E+02 O_OD= -0.6744463E+01 O_TOT= 0.2090353E+02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 100 WF centre and spread 1 ( 5.566612, 18.506009, 3.321242 ) 113.15348215 WF centre and spread 2 ( 3.703080, 17.012702, 3.320223 ) 28.09386933 WF centre and spread 3 ( 2.602437, 16.608532, 3.308984 ) 38.26889692 WF centre and spread 4 ( 1.297756, 18.224685, 3.288083 ) 120.26857005 WF centre and spread 5 ( 1.408919,-19.271443, 3.308073 ) 32.16876106 WF centre and spread 6 ( 3.368689,-19.146250, 3.314801 ) 30.17097831 WF centre and spread 7 ( 4.178550, 16.502473, 3.310252 ) 30.44190282 WF centre and spread 8 ( 5.555449, 17.772262, 3.332326 ) 142.15929982 WF centre and spread 9 ( 0.694844, 16.597188, 3.262970 ) 82.11889141 WF centre and spread 10 ( 0.528548, 16.195268, 3.325849 ) 69.77244754 WF centre and spread 11 ( 0.601276,-18.466327, 3.316129 ) 32.79405112 WF centre and spread 12 ( 4.017248,-17.519976, 3.281443 ) 116.50728459 WF centre and spread 13 ( 2.270169, 19.508721, 3.300289 ) 101.77249438 WF centre and spread 14 ( 3.913765,-18.796369, 3.320733 ) 37.09168732 WF centre and spread 15 ( 2.162478, 15.753567, 3.307200 ) 44.58665231 WF centre and spread 16 ( 0.985369, 14.890942, 3.310293 ) 39.63238554 WF centre and spread 17 ( 0.547970,-17.095973, 3.310080 ) 69.01534979 WF centre and spread 18 ( 3.755879,-18.009341, 3.306754 ) 82.99133996 Sum of centres and spreads ( 47.159038, 59.266669, 59.545723 ) 1211.00834441 100 -0.331E+00 50.1648525747 1211.0082753707 5.91 <-- CONV O_D= 23.3504568 O_OD= 587.9028417 O_TOT= 1211.0082754 <-- SPRD Delta: O_D= -0.3764402E-01 O_OD= -0.2936464E+00 O_TOT= -0.3312904E+00 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 110 WF centre and spread 1 ( 5.558406, 18.542981, 3.321561 ) 113.31875563 WF centre and spread 2 ( 3.702619, 17.013198, 3.320194 ) 27.65894843 WF centre and spread 3 ( 2.591452, 16.624046, 3.308939 ) 37.58046106 WF centre and spread 4 ( 1.327796, 18.257277, 3.274089 ) 120.68440115 WF centre and spread 5 ( 1.407727,-19.268097, 3.308193 ) 31.54186794 WF centre and spread 6 ( 3.363236,-19.149114, 3.314812 ) 29.77554101 WF centre and spread 7 ( 4.172001, 16.502250, 3.310425 ) 29.83641737 WF centre and spread 8 ( 5.564655, 17.416915, 3.332525 ) 146.63285561 WF centre and spread 9 ( 0.713457, 16.587679, 3.264073 ) 80.91403014 WF centre and spread 10 ( 0.526851, 16.181129, 3.325335 ) 69.42195047 WF centre and spread 11 ( 0.596408,-18.468327, 3.315840 ) 32.48202942 WF centre and spread 12 ( 4.022292,-17.656907, 3.281500 ) 116.16880787 WF centre and spread 13 ( 2.272715, 19.492570, 3.301010 ) 101.24712250 WF centre and spread 14 ( 3.909680,-18.792410, 3.320433 ) 36.43639450 WF centre and spread 15 ( 2.157706, 15.768408, 3.306926 ) 44.08661019 WF centre and spread 16 ( 0.977321, 14.878227, 3.310392 ) 39.24885210 WF centre and spread 17 ( 0.542013,-17.091595, 3.310067 ) 68.85051634 WF centre and spread 18 ( 3.746185,-18.021255, 3.306862 ) 82.86482887 Sum of centres and spreads ( 47.152520, 58.816974, 59.533174 ) 1208.75039060 110 -0.215E+01 44.3561393179 1208.7503216135 6.55 <-- CONV O_D= 27.5276091 O_OD= 581.4677357 O_TOT= 1208.7503216 <-- SPRD Delta: O_D= -0.1782822E+01 O_OD= -0.3705128E+00 O_TOT= -0.2153335E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 120 WF centre and spread 1 ( 5.557384, 18.581398, 3.321369 ) 113.48351478 WF centre and spread 2 ( 3.702516, 17.012777, 3.320206 ) 27.42799708 WF centre and spread 3 ( 2.581511, 16.635381, 3.308879 ) 37.07258172 WF centre and spread 4 ( 1.375291, 18.147219, 3.279175 ) 122.51013638 WF centre and spread 5 ( 1.408154,-19.265420, 3.308248 ) 31.05192356 WF centre and spread 6 ( 3.359127,-19.151027, 3.314832 ) 29.63119442 WF centre and spread 7 ( 4.166737, 16.502490, 3.310558 ) 29.39979073 WF centre and spread 8 ( 5.541593, 17.845830, 3.333107 ) 142.07570454 WF centre and spread 9 ( 0.724342, 16.579802, 3.264818 ) 80.27340237 WF centre and spread 10 ( 0.519986, 16.167822, 3.324790 ) 68.97147222 WF centre and spread 11 ( 0.594704,-18.471442, 3.315639 ) 32.15930231 WF centre and spread 12 ( 4.014999,-17.571314, 3.281394 ) 116.17354047 WF centre and spread 13 ( 2.297077, 19.479682, 3.301594 ) 101.12994104 WF centre and spread 14 ( 3.909194,-18.789306, 3.320155 ) 36.00546596 WF centre and spread 15 ( 2.156641, 15.777588, 3.306745 ) 43.69257884 WF centre and spread 16 ( 0.969720, 14.866329, 3.310382 ) 38.86016644 WF centre and spread 17 ( 0.537622,-17.089751, 3.309991 ) 68.69337013 WF centre and spread 18 ( 3.789472,-18.030208, 3.306925 ) 82.68764735 Sum of centres and spreads ( 47.206071, 59.227847, 59.538806 ) 1201.29973036 120 -0.114E+02 803.1722414689 1201.2996613337 7.09 <-- CONV O_D= 24.5642367 O_OD= 576.9804478 O_TOT= 1201.2996613 <-- SPRD Delta: O_D= -0.1191253E+02 O_OD= 0.5408941E+00 O_TOT= -0.1137164E+02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 130 WF centre and spread 1 ( 5.548918, 18.627042, 3.320691 ) 113.57860114 WF centre and spread 2 ( 3.701806, 17.012632, 3.320209 ) 27.19170958 WF centre and spread 3 ( 2.571864, 16.646699, 3.308851 ) 36.65741404 WF centre and spread 4 ( 1.358043, 18.265447, 3.276747 ) 120.85694733 WF centre and spread 5 ( 1.405967,-19.263249, 3.308387 ) 30.58024647 WF centre and spread 6 ( 3.354518,-19.153384, 3.314831 ) 29.37000556 WF centre and spread 7 ( 4.162359, 16.502755, 3.310655 ) 28.99568859 WF centre and spread 8 ( 5.579327, 17.752347, 3.333256 ) 141.03049552 WF centre and spread 9 ( 0.736691, 16.573549, 3.265632 ) 79.59917714 WF centre and spread 10 ( 0.524230, 16.161755, 3.324502 ) 68.54432504 WF centre and spread 11 ( 0.591171,-18.474228, 3.315420 ) 31.84865643 WF centre and spread 12 ( 3.969309,-17.556779, 3.281522 ) 116.22612210 WF centre and spread 13 ( 2.299555, 19.469068, 3.302144 ) 100.98906767 WF centre and spread 14 ( 3.906240,-18.787323, 3.319909 ) 35.56183775 WF centre and spread 15 ( 2.152183, 15.788880, 3.306537 ) 43.29994825 WF centre and spread 16 ( 0.964342, 14.856631, 3.310418 ) 38.64664633 WF centre and spread 17 ( 0.531621,-17.086325, 3.309961 ) 68.49238585 WF centre and spread 18 ( 3.763438,-18.037998, 3.306991 ) 82.55739920 Sum of centres and spreads ( 47.121582, 59.297519, 59.536664 ) 1194.02667398 130 -0.546E+00 62.1834561934 1194.0266051355 7.69 <-- CONV O_D= 22.3846666 O_OD= 571.8869617 O_TOT= 1194.0266051 <-- SPRD Delta: O_D= -0.3942713E+00 O_OD= -0.1518977E+00 O_TOT= -0.5461690E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 140 WF centre and spread 1 ( 5.548183, 18.646791, 3.319197 ) 113.62742927 WF centre and spread 2 ( 3.701359, 17.012564, 3.320195 ) 27.08211313 WF centre and spread 3 ( 2.568172, 16.651600, 3.308836 ) 36.47292190 WF centre and spread 4 ( 1.371703, 18.265991, 3.272717 ) 120.98932536 WF centre and spread 5 ( 1.405409,-19.262390, 3.308438 ) 30.35928900 WF centre and spread 6 ( 3.352267,-19.154552, 3.314810 ) 29.25683098 WF centre and spread 7 ( 4.160576, 16.502943, 3.310696 ) 28.82641607 WF centre and spread 8 ( 5.549451, 17.752128, 3.333381 ) 140.89559157 WF centre and spread 9 ( 0.741487, 16.571431, 3.265969 ) 79.33811724 WF centre and spread 10 ( 0.522595, 16.158822, 3.324348 ) 68.33065750 WF centre and spread 11 ( 0.590138,-18.475318, 3.315330 ) 31.71738004 WF centre and spread 12 ( 3.985798,-17.600675, 3.281591 ) 116.11347669 WF centre and spread 13 ( 2.316754, 19.464552, 3.302387 ) 100.98298024 WF centre and spread 14 ( 3.905412,-18.786464, 3.319822 ) 35.37881657 WF centre and spread 15 ( 2.151392, 15.793168, 3.306470 ) 43.14289298 WF centre and spread 16 ( 0.961451, 14.852464, 3.310429 ) 38.51944439 WF centre and spread 17 ( 0.529697,-17.085157, 3.309927 ) 68.42778218 WF centre and spread 18 ( 3.783231,-18.041204, 3.307017 ) 82.51716346 Sum of centres and spreads ( 47.145075, 59.266694, 59.531564 ) 1191.97862857 140 -0.279E-01 27.9094689266 1191.9785597327 8.26 <-- CONV O_D= 22.2650634 O_OD= 569.9585195 O_TOT= 1191.9785597 <-- SPRD Delta: O_D= -0.8586799E-02 O_OD= -0.1926724E-01 O_TOT= -0.2785404E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 150 WF centre and spread 1 ( 5.551495, 18.664283, 3.314993 ) 113.83762097 WF centre and spread 2 ( 3.701839, 17.012156, 3.320223 ) 27.16333204 WF centre and spread 3 ( 2.563731, 16.656063, 3.308788 ) 36.56881697 WF centre and spread 4 ( 1.375041, 18.184789, 3.273789 ) 121.35764403 WF centre and spread 5 ( 1.404171,-19.261303, 3.308465 ) 30.22769464 WF centre and spread 6 ( 3.350316,-19.154659, 3.314781 ) 29.30134411 WF centre and spread 7 ( 4.157868, 16.502432, 3.310695 ) 28.77549036 WF centre and spread 8 ( 5.518921, 17.761195, 3.333354 ) 140.64670435 WF centre and spread 9 ( 0.743201, 16.567628, 3.266202 ) 79.87195625 WF centre and spread 10 ( 0.523894, 16.156887, 3.324288 ) 68.26588541 WF centre and spread 11 ( 0.591749,-18.475327, 3.315239 ) 31.70127171 WF centre and spread 12 ( 3.996163,-17.615491, 3.281516 ) 116.74923165 WF centre and spread 13 ( 2.321774, 19.461859, 3.302575 ) 101.16526783 WF centre and spread 14 ( 3.907380,-18.784325, 3.319762 ) 35.40012236 WF centre and spread 15 ( 2.150552, 15.797081, 3.306392 ) 43.01477963 WF centre and spread 16 ( 0.957519, 14.848091, 3.310408 ) 38.50890537 WF centre and spread 17 ( 0.525097,-17.082386, 3.309988 ) 68.45142058 WF centre and spread 18 ( 3.775141,-18.043968, 3.307036 ) 82.47470538 Sum of centres and spreads ( 47.115852, 59.195006, 59.528495 ) 1193.48219364 150 -0.114E+01 172.3843626725 1193.4821249203 8.86 <-- CONV O_D= 22.5979254 O_OD= 571.1292226 O_TOT= 1193.4821249 <-- SPRD Delta: O_D= -0.1142261E+01 O_OD= 0.2346164E-02 O_TOT= -0.1139915E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 160 WF centre and spread 1 ( 5.543674, 18.697745, 3.310962 ) 113.79803763 WF centre and spread 2 ( 3.700825, 17.011926, 3.320212 ) 26.83975638 WF centre and spread 3 ( 2.556246, 16.665939, 3.308773 ) 36.01145135 WF centre and spread 4 ( 1.391840, 18.295470, 3.271791 ) 121.18623522 WF centre and spread 5 ( 1.403848,-19.259778, 3.308556 ) 29.82316432 WF centre and spread 6 ( 3.347302,-19.157366, 3.314798 ) 29.05830504 WF centre and spread 7 ( 4.155013, 16.502545, 3.310783 ) 28.38520180 WF centre and spread 8 ( 5.454831, 17.540942, 3.333666 ) 147.20743902 WF centre and spread 9 ( 0.752495, 16.560051, 3.266906 ) 78.83443048 WF centre and spread 10 ( 0.520812, 16.151438, 3.323945 ) 67.71287992 WF centre and spread 11 ( 0.588062,-18.478380, 3.315068 ) 31.34581194 WF centre and spread 12 ( 3.938298,-17.630338, 3.281649 ) 116.54291054 WF centre and spread 13 ( 2.263426, 19.452405, 3.303079 ) 101.28918898 WF centre and spread 14 ( 3.903337,-18.782945, 3.319568 ) 34.90620184 WF centre and spread 15 ( 2.147497, 15.805530, 3.306260 ) 42.71291748 WF centre and spread 16 ( 0.952063, 14.839221, 3.310439 ) 38.21859266 WF centre and spread 17 ( 0.522222,-17.081175, 3.309894 ) 68.20411458 WF centre and spread 18 ( 3.780893,-18.050473, 3.307086 ) 82.38410714 Sum of centres and spreads ( 46.922684, 59.082757, 59.523433 ) 1194.46074633 160 0.482E+01 46.3099983384 1194.4606782319 9.45 <-- CONV O_D= 29.3765390 O_OD= 565.3291624 O_TOT= 1194.4606782 <-- SPRD Delta: O_D= 0.6944223E+01 O_OD= -0.2122800E+01 O_TOT= 0.4821423E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 170 WF centre and spread 1 ( 5.540935, 18.705873, 3.311628 ) 113.82620176 WF centre and spread 2 ( 3.700469, 17.011888, 3.320212 ) 26.77911431 WF centre and spread 3 ( 2.552369, 16.670979, 3.308762 ) 35.85607609 WF centre and spread 4 ( 1.399942, 18.274529, 3.272111 ) 121.19302197 WF centre and spread 5 ( 1.403086,-19.258638, 3.308607 ) 29.65105043 WF centre and spread 6 ( 3.345214,-19.158430, 3.314790 ) 28.97222792 WF centre and spread 7 ( 4.154076, 16.502654, 3.310843 ) 28.23975159 WF centre and spread 8 ( 5.565952, 17.792627, 3.333661 ) 140.25910041 WF centre and spread 9 ( 0.758724, 16.558432, 3.267233 ) 78.52458319 WF centre and spread 10 ( 0.519513, 16.147843, 3.323806 ) 67.53004631 WF centre and spread 11 ( 0.587522,-18.478187, 3.314955 ) 31.33283954 WF centre and spread 12 ( 3.973271,-17.626379, 3.281733 ) 116.49303781 WF centre and spread 13 ( 2.321210, 19.448676, 3.303309 ) 101.10808616 WF centre and spread 14 ( 3.902560,-18.782046, 3.319460 ) 34.76412665 WF centre and spread 15 ( 2.146178, 15.810099, 3.306203 ) 42.56751659 WF centre and spread 16 ( 0.950640, 14.834959, 3.310441 ) 38.13473006 WF centre and spread 17 ( 0.520518,-17.080009, 3.309847 ) 68.12642397 WF centre and spread 18 ( 3.777646,-18.053408, 3.307111 ) 82.34263243 Sum of centres and spreads ( 47.119826, 59.321462, 59.524714 ) 1185.70056718 170 -0.217E+00 48.8888206801 1185.7004984160 10.07 <-- CONV O_D= 21.9645581 O_OD= 563.9809634 O_TOT= 1185.7004984 <-- SPRD Delta: O_D= -0.1646893E+00 O_OD= -0.5259418E-01 O_TOT= -0.2172835E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 180 WF centre and spread 1 ( 5.538955, 18.730688, 3.316904 ) 113.74438341 WF centre and spread 2 ( 3.700186, 17.011602, 3.320215 ) 26.67210463 WF centre and spread 3 ( 2.548362, 16.676228, 3.308752 ) 35.64883942 WF centre and spread 4 ( 1.412867, 18.186477, 3.271778 ) 121.49021256 WF centre and spread 5 ( 1.402076,-19.257794, 3.308669 ) 29.43161047 WF centre and spread 6 ( 3.342636,-19.159814, 3.314785 ) 28.86233571 WF centre and spread 7 ( 4.152694, 16.502681, 3.310877 ) 28.07484838 WF centre and spread 8 ( 5.570198, 17.793620, 3.333793 ) 140.13531903 WF centre and spread 9 ( 0.764748, 16.556565, 3.267608 ) 78.20887700 WF centre and spread 10 ( 0.518492, 16.146437, 3.323639 ) 67.20117439 WF centre and spread 11 ( 0.585243,-18.480177, 3.314863 ) 31.16752274 WF centre and spread 12 ( 3.950929,-17.623906, 3.281818 ) 116.57114414 WF centre and spread 13 ( 2.323606, 19.444107, 3.303593 ) 101.14070611 WF centre and spread 14 ( 3.901566,-18.781171, 3.319354 ) 34.58237414 WF centre and spread 15 ( 2.144730, 15.814729, 3.306140 ) 42.42410697 WF centre and spread 16 ( 0.948321, 14.829976, 3.310451 ) 38.02198930 WF centre and spread 17 ( 0.518496,-17.078881, 3.309809 ) 68.05721260 WF centre and spread 18 ( 3.777320,-18.056754, 3.307138 ) 82.29578438 Sum of centres and spreads ( 47.101426, 59.254612, 59.530185 ) 1183.73054537 180 -0.242E+00 37.2090364503 1183.7304766762 10.67 <-- CONV O_D= 22.2329967 O_OD= 561.7425032 O_TOT= 1183.7304767 <-- SPRD Delta: O_D= 0.2786436E+00 O_OD= -0.5207040E+00 O_TOT= -0.2420604E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 190 WF centre and spread 1 ( 5.526940, 18.735319, 3.318398 ) 113.79520008 WF centre and spread 2 ( 3.700358, 17.011345, 3.320228 ) 26.65417506 WF centre and spread 3 ( 2.544187, 16.681143, 3.308735 ) 35.51313370 WF centre and spread 4 ( 1.407721, 18.238667, 3.271341 ) 121.07105203 WF centre and spread 5 ( 1.400747,-19.256905, 3.308712 ) 29.30844094 WF centre and spread 6 ( 3.341616,-19.160633, 3.314786 ) 28.88478687 WF centre and spread 7 ( 4.151556, 16.503069, 3.310910 ) 27.92648270 WF centre and spread 8 ( 5.576636, 17.759278, 3.333909 ) 140.15190203 WF centre and spread 9 ( 0.770440, 16.555615, 3.267930 ) 77.93923326 WF centre and spread 10 ( 0.517017, 16.145664, 3.323489 ) 66.93490174 WF centre and spread 11 ( 0.583875,-18.481887, 3.314772 ) 31.05169175 WF centre and spread 12 ( 3.957207,-17.642392, 3.281935 ) 116.59136881 WF centre and spread 13 ( 2.328923, 19.440323, 3.303836 ) 101.25335941 WF centre and spread 14 ( 3.901244,-18.779893, 3.319250 ) 34.46715966 WF centre and spread 15 ( 2.143566, 15.819119, 3.306078 ) 42.29666404 WF centre and spread 16 ( 0.946399, 14.825577, 3.310454 ) 37.93227113 WF centre and spread 17 ( 0.516478,-17.077716, 3.309757 ) 67.99565888 WF centre and spread 18 ( 3.778519,-18.059552, 3.307151 ) 82.26737720 Sum of centres and spreads ( 47.093429, 59.256140, 59.531671 ) 1182.03485930 190 -0.546E-01 46.0642590481 1182.0347906241 11.25 <-- CONV O_D= 21.8535724 O_OD= 560.4262413 O_TOT= 1182.0347906 <-- SPRD Delta: O_D= -0.2670955E-01 O_OD= -0.2792107E-01 O_TOT= -0.5463061E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 200 WF centre and spread 1 ( 5.534618, 18.737740, 3.310538 ) 113.82249858 WF centre and spread 2 ( 3.700021, 17.011276, 3.320225 ) 26.58508187 WF centre and spread 3 ( 2.542713, 16.683255, 3.308732 ) 35.42935114 WF centre and spread 4 ( 1.420026, 18.232916, 3.271062 ) 121.17984519 WF centre and spread 5 ( 1.400921,-19.256436, 3.308730 ) 29.20630931 WF centre and spread 6 ( 3.340534,-19.161231, 3.314782 ) 28.79275081 WF centre and spread 7 ( 4.151109, 16.502895, 3.310933 ) 27.86335969 WF centre and spread 8 ( 5.552813, 17.806519, 3.333925 ) 140.09448214 WF centre and spread 9 ( 0.772071, 16.554924, 3.268069 ) 77.85186757 WF centre and spread 10 ( 0.516269, 16.143033, 3.323426 ) 66.84379002 WF centre and spread 11 ( 0.583635,-18.481639, 3.314731 ) 31.03584290 WF centre and spread 12 ( 3.964052,-17.741356, 3.281971 ) 116.90842745 WF centre and spread 13 ( 2.327712, 19.438816, 3.303937 ) 101.25369005 WF centre and spread 14 ( 3.900708,-18.779652, 3.319218 ) 34.37446412 WF centre and spread 15 ( 2.143278, 15.820669, 3.306064 ) 42.23146711 WF centre and spread 16 ( 0.945255, 14.823684, 3.310450 ) 37.88650072 WF centre and spread 17 ( 0.515611,-17.077331, 3.309731 ) 67.97047215 WF centre and spread 18 ( 3.779046,-18.060718, 3.307160 ) 82.24713440 Sum of centres and spreads ( 47.090392, 59.197365, 59.523683 ) 1181.57733524 200 -0.229E-01 42.4171218977 1181.5772666110 11.84 <-- CONV O_D= 22.1237825 O_OD= 559.6985073 O_TOT= 1181.5772666 <-- SPRD Delta: O_D= 0.8226482E-02 O_OD= -0.3111661E-01 O_TOT= -0.2289013E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 210 WF centre and spread 1 ( 5.530975, 18.716972, 3.313156 ) 113.89248229 WF centre and spread 2 ( 3.699787, 17.010859, 3.320235 ) 26.49853832 WF centre and spread 3 ( 2.538183, 16.689021, 3.308716 ) 35.22574008 WF centre and spread 4 ( 1.431355, 18.208105, 3.270503 ) 121.28634466 WF centre and spread 5 ( 1.399694,-19.255484, 3.308797 ) 28.99304597 WF centre and spread 6 ( 3.337869,-19.162740, 3.314785 ) 28.71898384 WF centre and spread 7 ( 4.149523, 16.502728, 3.310957 ) 27.68840990 WF centre and spread 8 ( 5.558671, 17.780546, 3.334033 ) 139.88925007 WF centre and spread 9 ( 0.778688, 16.552127, 3.268469 ) 77.58006652 WF centre and spread 10 ( 0.514710, 16.141343, 3.323284 ) 66.49687171 WF centre and spread 11 ( 0.581384,-18.483596, 3.314626 ) 30.87392337 WF centre and spread 12 ( 3.951735,-17.665204, 3.282052 ) 116.78615653 WF centre and spread 13 ( 2.334818, 19.434138, 3.304244 ) 101.36965786 WF centre and spread 14 ( 3.899928,-18.778579, 3.319096 ) 34.19423814 WF centre and spread 15 ( 2.141630, 15.826079, 3.305993 ) 42.07406893 WF centre and spread 16 ( 0.942492, 14.818021, 3.310461 ) 37.78075554 WF centre and spread 17 ( 0.512979,-17.075988, 3.309685 ) 67.88650610 WF centre and spread 18 ( 3.779763,-18.064348, 3.307187 ) 82.20160692 Sum of centres and spreads ( 47.084184, 59.194000, 59.526278 ) 1179.43664674 210 -0.107E+00 76.9931205789 1179.4365781427 12.47 <-- CONV O_D= 21.9879955 O_OD= 557.6936058 O_TOT= 1179.4365781 <-- SPRD Delta: O_D= -0.7662091E-01 O_OD= -0.2990942E-01 O_TOT= -0.1065303E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 220 WF centre and spread 1 ( 5.532337, 18.763072, 3.309859 ) 113.81726787 WF centre and spread 2 ( 3.699160, 17.010596, 3.320236 ) 26.39217326 WF centre and spread 3 ( 2.534840, 16.693270, 3.308709 ) 35.07473670 WF centre and spread 4 ( 1.438804, 18.251191, 3.270046 ) 121.21115002 WF centre and spread 5 ( 1.399467,-19.254671, 3.308851 ) 28.80015858 WF centre and spread 6 ( 3.336214,-19.163991, 3.314787 ) 28.58953415 WF centre and spread 7 ( 4.148472, 16.502933, 3.310988 ) 27.55532675 WF centre and spread 8 ( 5.554880, 17.759719, 3.334084 ) 139.75831332 WF centre and spread 9 ( 0.782198, 16.550686, 3.268739 ) 77.40469256 WF centre and spread 10 ( 0.514131, 16.139707, 3.323169 ) 66.27995134 WF centre and spread 11 ( 0.580210,-18.484661, 3.314549 ) 30.76805457 WF centre and spread 12 ( 3.913478,-17.635424, 3.282151 ) 116.91620206 WF centre and spread 13 ( 2.335737, 19.430896, 3.304463 ) 101.45459912 WF centre and spread 14 ( 3.898674,-18.778263, 3.319011 ) 34.01426198 WF centre and spread 15 ( 2.140393, 15.829923, 3.305958 ) 41.94538162 WF centre and spread 16 ( 0.940417, 14.814179, 3.310463 ) 37.69833289 WF centre and spread 17 ( 0.511096,-17.074869, 3.309637 ) 67.82955857 WF centre and spread 18 ( 3.780505,-18.066768, 3.307205 ) 82.16692311 Sum of centres and spreads ( 47.041011, 59.287524, 59.522905 ) 1177.67661845 220 -0.560E-01 53.4246102749 1177.6765499933 13.08 <-- CONV O_D= 21.7841815 O_OD= 556.1373916 O_TOT= 1177.6765500 <-- SPRD Delta: O_D= -0.1339349E-01 O_OD= -0.4265627E-01 O_TOT= -0.5604976E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 230 WF centre and spread 1 ( 5.531694, 18.788834, 3.305424 ) 113.87912708 WF centre and spread 2 ( 3.699275, 17.010278, 3.320255 ) 26.33333596 WF centre and spread 3 ( 2.531019, 16.697979, 3.308693 ) 34.98448955 WF centre and spread 4 ( 1.442861, 18.269736, 3.269766 ) 121.20018761 WF centre and spread 5 ( 1.398701,-19.253827, 3.308898 ) 28.63387256 WF centre and spread 6 ( 3.335225,-19.165012, 3.314794 ) 28.53994641 WF centre and spread 7 ( 4.147396, 16.503054, 3.311011 ) 27.43403659 WF centre and spread 8 ( 5.605625, 17.767362, 3.334022 ) 139.77750236 WF centre and spread 9 ( 0.786955, 16.548414, 3.269030 ) 77.27755680 WF centre and spread 10 ( 0.512538, 16.138968, 3.323047 ) 66.02085286 WF centre and spread 11 ( 0.579446,-18.486056, 3.314463 ) 30.65101876 WF centre and spread 12 ( 3.949699,-17.665427, 3.282296 ) 116.98398876 WF centre and spread 13 ( 2.338527, 19.427766, 3.304689 ) 101.59926990 WF centre and spread 14 ( 3.898058,-18.777320, 3.318912 ) 33.87655142 WF centre and spread 15 ( 2.139154, 15.834207, 3.305907 ) 41.82918964 WF centre and spread 16 ( 0.939339, 14.809528, 3.310458 ) 37.63780757 WF centre and spread 17 ( 0.506938,-17.072912, 3.309632 ) 67.80549843 WF centre and spread 18 ( 3.781205,-18.069342, 3.307218 ) 82.15018084 Sum of centres and spreads ( 47.123652, 59.306233, 59.518514 ) 1176.61441306 230 -0.354E+00 52.4188175653 1176.6143442765 13.68 <-- CONV O_D= 21.8808355 O_OD= 554.9785319 O_TOT= 1176.6143443 <-- SPRD Delta: O_D= 0.6545735E-01 O_OD= -0.4195537E+00 O_TOT= -0.3540963E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 240 WF centre and spread 1 ( 5.526260, 18.771167, 3.316400 ) 113.82591202 WF centre and spread 2 ( 3.698681, 17.010017, 3.320252 ) 26.26658300 WF centre and spread 3 ( 2.528417, 16.701286, 3.308685 ) 34.84147359 WF centre and spread 4 ( 1.450197, 18.246243, 3.269343 ) 121.20344894 WF centre and spread 5 ( 1.397977,-19.253231, 3.308939 ) 28.49921227 WF centre and spread 6 ( 3.333275,-19.165954, 3.314790 ) 28.46433978 WF centre and spread 7 ( 4.146548, 16.503117, 3.311032 ) 27.32719445 WF centre and spread 8 ( 5.531471, 17.778760, 3.334138 ) 139.56183700 WF centre and spread 9 ( 0.790247, 16.547778, 3.269258 ) 77.10366521 WF centre and spread 10 ( 0.511241, 16.137944, 3.322960 ) 65.82694587 WF centre and spread 11 ( 0.578174,-18.486976, 3.314407 ) 30.56844779 WF centre and spread 12 ( 3.938365,-17.668547, 3.282328 ) 116.99625012 WF centre and spread 13 ( 2.339288, 19.425168, 3.304868 ) 101.69230773 WF centre and spread 14 ( 3.897273,-18.776900, 3.318853 ) 33.75698884 WF centre and spread 15 ( 2.138420, 15.837105, 3.305882 ) 41.73673481 WF centre and spread 16 ( 0.936409, 14.806606, 3.310464 ) 37.56249235 WF centre and spread 17 ( 0.507175,-17.072444, 3.309575 ) 67.71921456 WF centre and spread 18 ( 3.781702,-18.071230, 3.307231 ) 82.11594106 Sum of centres and spreads ( 47.031119, 59.269911, 59.529405 ) 1175.06898940 240 -0.484E-01 36.1097151932 1175.0689210070 14.27 <-- CONV O_D= 21.6526958 O_OD= 553.6612484 O_TOT= 1175.0689210 <-- SPRD Delta: O_D= -0.2572179E-01 O_OD= -0.2270227E-01 O_TOT= -0.4842406E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 250 WF centre and spread 1 ( 5.529896, 18.789983, 3.314974 ) 113.80872901 WF centre and spread 2 ( 3.698620, 17.009989, 3.320252 ) 26.25876603 WF centre and spread 3 ( 2.528184, 16.701595, 3.308685 ) 34.82772595 WF centre and spread 4 ( 1.450937, 18.342155, 3.269309 ) 121.71031104 WF centre and spread 5 ( 1.397986,-19.253196, 3.308943 ) 28.48453416 WF centre and spread 6 ( 3.333139,-19.166063, 3.314790 ) 28.45465481 WF centre and spread 7 ( 4.146476, 16.503136, 3.311033 ) 27.31799082 WF centre and spread 8 ( 5.540224, 17.767710, 3.334148 ) 139.51357987 WF centre and spread 9 ( 0.790508, 16.547551, 3.269278 ) 77.08565476 WF centre and spread 10 ( 0.511355, 16.137931, 3.322953 ) 65.81021779 WF centre and spread 11 ( 0.578017,-18.487112, 3.314401 ) 30.55835609 WF centre and spread 12 ( 3.943324,-17.670372, 3.282342 ) 116.99700148 WF centre and spread 13 ( 2.340672, 19.424945, 3.304884 ) 101.69659261 WF centre and spread 14 ( 3.897199,-18.776898, 3.318847 ) 33.74173460 WF centre and spread 15 ( 2.138342, 15.837413, 3.305880 ) 41.72494928 WF centre and spread 16 ( 0.936428, 14.806317, 3.310463 ) 37.55748070 WF centre and spread 17 ( 0.506902,-17.072396, 3.309570 ) 67.71077938 WF centre and spread 18 ( 3.781760,-18.071405, 3.307232 ) 82.11407917 Sum of centres and spreads ( 47.049969, 59.371281, 59.527984 ) 1175.37313753 250 0.488E+00 47.9026499303 1175.3730690643 14.85 <-- CONV O_D= 22.0821087 O_OD= 553.5359835 O_TOT= 1175.3730691 <-- SPRD Delta: O_D= 0.4966161E+00 O_OD= -0.8461629E-02 O_TOT= 0.4881545E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 260 WF centre and spread 1 ( 5.631962, 18.834280, 3.322452 ) 114.46515213 WF centre and spread 2 ( 3.697930, 17.008761, 3.320292 ) 26.22366437 WF centre and spread 3 ( 2.520047, 16.711384, 3.308643 ) 34.53208361 WF centre and spread 4 ( 1.467215, 18.239744, 3.268681 ) 121.26574964 WF centre and spread 5 ( 1.397235,-19.250927, 3.309026 ) 28.27911122 WF centre and spread 6 ( 3.329647,-19.168494, 3.314815 ) 28.41278195 WF centre and spread 7 ( 4.144407, 16.501317, 3.311059 ) 27.09712463 WF centre and spread 8 ( 5.578284, 17.833701, 3.334328 ) 139.30623733 WF centre and spread 9 ( 0.801684, 16.540901, 3.269931 ) 76.98344248 WF centre and spread 10 ( 0.509119, 16.129920, 3.322812 ) 65.36780783 WF centre and spread 11 ( 0.574820,-18.487354, 3.314230 ) 30.53084468 WF centre and spread 12 ( 3.917896,-17.768899, 3.282513 ) 117.61789359 WF centre and spread 13 ( 2.355683, 19.418026, 3.305356 ) 102.02684875 WF centre and spread 14 ( 3.897849,-18.774031, 3.318692 ) 33.49361919 WF centre and spread 15 ( 2.136840, 15.845294, 3.305837 ) 41.52716244 WF centre and spread 16 ( 0.932394, 14.796539, 3.310407 ) 37.47038893 WF centre and spread 17 ( 0.504053,-17.070766, 3.309373 ) 67.56727031 WF centre and spread 18 ( 3.782714,-18.077085, 3.307262 ) 82.04449655 Sum of centres and spreads ( 47.179779, 59.262308, 59.535709 ) 1174.21167964 260 -0.147E+01 44.8065163581 1174.2116106210 15.47 <-- CONV O_D= 22.3714802 O_OD= 552.0851535 O_TOT= 1174.2116106 <-- SPRD Delta: O_D= 0.2515280E+00 O_OD= -0.1725128E+01 O_TOT= -0.1473600E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 270 WF centre and spread 1 ( 5.507546, 18.832234, 3.319736 ) 113.79426012 WF centre and spread 2 ( 3.697596, 17.008260, 3.320314 ) 26.18760465 WF centre and spread 3 ( 2.515293, 16.717011, 3.308627 ) 34.37344654 WF centre and spread 4 ( 1.464965, 18.203839, 3.268396 ) 121.15580564 WF centre and spread 5 ( 1.395085,-19.249821, 3.309091 ) 28.10256922 WF centre and spread 6 ( 3.327139,-19.169730, 3.314820 ) 28.40943979 WF centre and spread 7 ( 4.143602, 16.501578, 3.311080 ) 26.90709516 WF centre and spread 8 ( 5.552741, 17.837518, 3.334472 ) 139.23094989 WF centre and spread 9 ( 0.808713, 16.539793, 3.270208 ) 76.56098553 WF centre and spread 10 ( 0.506743, 16.130497, 3.322673 ) 64.89619455 WF centre and spread 11 ( 0.572405,-18.489414, 3.314138 ) 30.35143912 WF centre and spread 12 ( 3.940133,-17.672064, 3.282509 ) 117.53005021 WF centre and spread 13 ( 2.351406, 19.414348, 3.305668 ) 102.26240589 WF centre and spread 14 ( 3.897025,-18.772675, 3.318540 ) 33.34982784 WF centre and spread 15 ( 2.135820, 15.850639, 3.305807 ) 41.30680161 WF centre and spread 16 ( 0.929066, 14.790906, 3.310459 ) 37.31702117 WF centre and spread 17 ( 0.501682,-17.069738, 3.309300 ) 67.49657715 WF centre and spread 18 ( 3.784024,-18.080350, 3.307277 ) 82.01428009 Sum of centres and spreads ( 47.030982, 59.322828, 59.533114 ) 1171.24675415 270 -0.249E+00 62.3537711388 1171.2466857666 16.06 <-- CONV O_D= 21.4976086 O_OD= 549.9941003 O_TOT= 1171.2466858 <-- SPRD Delta: O_D= -0.1936335E+00 O_OD= -0.5575951E-01 O_TOT= -0.2493930E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 280 WF centre and spread 1 ( 5.514611, 18.948476, 3.317461 ) 114.10306375 WF centre and spread 2 ( 3.694919, 17.006689, 3.320348 ) 25.84937392 WF centre and spread 3 ( 2.502718, 16.732768, 3.308584 ) 33.89115263 WF centre and spread 4 ( 1.485841, 18.438649, 3.266797 ) 123.19952729 WF centre and spread 5 ( 1.393765,-19.247059, 3.309292 ) 27.49042294 WF centre and spread 6 ( 3.322401,-19.175365, 3.314881 ) 28.04469450 WF centre and spread 7 ( 4.140898, 16.501556, 3.311131 ) 26.45060474 WF centre and spread 8 ( 5.552994, 17.683063, 3.334402 ) 139.01293847 WF centre and spread 9 ( 0.824109, 16.531096, 3.271183 ) 76.07886137 WF centre and spread 10 ( 0.501563, 16.126199, 3.322428 ) 64.02454324 WF centre and spread 11 ( 0.566846,-18.493302, 3.313862 ) 30.01692244 WF centre and spread 12 ( 3.892949,-17.713603, 3.282988 ) 117.86527775 WF centre and spread 13 ( 2.331994, 19.403743, 3.306476 ) 102.97873235 WF centre and spread 14 ( 3.892851,-18.771797, 3.318237 ) 32.65892060 WF centre and spread 15 ( 2.131473, 15.866208, 3.305741 ) 40.83559549 WF centre and spread 16 ( 0.920929, 14.776210, 3.310468 ) 37.06034124 WF centre and spread 17 ( 0.494063,-17.065023, 3.309058 ) 67.29870555 WF centre and spread 18 ( 3.787048,-18.089046, 3.307329 ) 81.92122981 Sum of centres and spreads ( 46.951971, 59.459461, 59.530667 ) 1168.78090807 280 -0.542E+00 72.7901801985 1168.7808398837 16.64 <-- CONV O_D= 23.3686165 O_OD= 545.6572466 O_TOT= 1168.7808399 <-- SPRD Delta: O_D= -0.4314493E+00 O_OD= -0.1101332E+00 O_TOT= -0.5415825E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 290 WF centre and spread 1 ( 5.520081, 18.919972, 3.307613 ) 114.28633944 WF centre and spread 2 ( 3.692810, 17.004637, 3.320382 ) 25.81267316 WF centre and spread 3 ( 2.493929, 16.742502, 3.308539 ) 33.61665157 WF centre and spread 4 ( 1.509196, 18.276575, 3.266256 ) 121.26092596 WF centre and spread 5 ( 1.392741,-19.245367, 3.309406 ) 27.14691602 WF centre and spread 6 ( 3.316321,-19.177870, 3.314853 ) 27.98891470 WF centre and spread 7 ( 4.137473, 16.500458, 3.311095 ) 26.33522943 WF centre and spread 8 ( 5.631561, 17.856234, 3.334962 ) 138.39023759 WF centre and spread 9 ( 0.827741, 16.524113, 3.271696 ) 76.85749246 WF centre and spread 10 ( 0.498081, 16.126446, 3.322165 ) 63.28557806 WF centre and spread 11 ( 0.564815,-18.495838, 3.313695 ) 29.72301737 WF centre and spread 12 ( 3.893436,-17.760086, 3.283154 ) 118.60493017 WF centre and spread 13 ( 2.374312, 19.398530, 3.306983 ) 103.49032870 WF centre and spread 14 ( 3.895110,-18.768789, 3.318119 ) 32.59330989 WF centre and spread 15 ( 2.130992, 15.874184, 3.305752 ) 40.51825412 WF centre and spread 16 ( 0.914799, 14.765307, 3.310389 ) 36.93680105 WF centre and spread 17 ( 0.488596,-17.063360, 3.308837 ) 67.13202136 WF centre and spread 18 ( 3.791258,-18.094396, 3.307351 ) 81.85021095 Sum of centres and spreads ( 47.073252, 59.383253, 59.521244 ) 1165.82983199 290 -0.117E+01 47.9411353193 1165.8297633548 17.24 <-- CONV O_D= 21.4050268 O_OD= 544.6697597 O_TOT= 1165.8297634 <-- SPRD Delta: O_D= 0.2625337E-01 O_OD= -0.1193834E+01 O_TOT= -0.1167581E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 300 WF centre and spread 1 ( 5.526475, 18.939432, 3.313577 ) 113.83089389 WF centre and spread 2 ( 3.692113, 17.004113, 3.320399 ) 25.66705853 WF centre and spread 3 ( 2.490146, 16.748058, 3.308535 ) 33.41088107 WF centre and spread 4 ( 1.525888, 18.232507, 3.265755 ) 121.02576933 WF centre and spread 5 ( 1.391624,-19.244463, 3.309476 ) 26.91906910 WF centre and spread 6 ( 3.313472,-19.179507, 3.314854 ) 27.83209287 WF centre and spread 7 ( 4.137644, 16.500478, 3.311119 ) 26.05199244 WF centre and spread 8 ( 5.559628, 17.844948, 3.334993 ) 138.23584666 WF centre and spread 9 ( 0.836279, 16.520349, 3.272040 ) 75.87101307 WF centre and spread 10 ( 0.498210, 16.124006, 3.322106 ) 62.99796085 WF centre and spread 11 ( 0.561955,-18.496482, 3.313601 ) 29.59823909 WF centre and spread 12 ( 3.905169,-17.792791, 3.283216 ) 118.41760170 WF centre and spread 13 ( 2.373012, 19.396229, 3.307255 ) 103.68886992 WF centre and spread 14 ( 3.892426,-18.767885, 3.318020 ) 32.25324393 WF centre and spread 15 ( 2.129408, 15.879301, 3.305744 ) 40.35352086 WF centre and spread 16 ( 0.912990, 14.760425, 3.310386 ) 36.83145941 WF centre and spread 17 ( 0.486710,-17.062376, 3.308729 ) 67.03712420 WF centre and spread 18 ( 3.790211,-18.097157, 3.307368 ) 81.81403912 Sum of centres and spreads ( 47.023359, 59.309184, 59.527172 ) 1161.83667601 300 -0.147E-01 27.6022328494 1161.8366076406 17.83 <-- CONV O_D= 21.1184868 O_OD= 540.9631440 O_TOT= 1161.8366076 <-- SPRD Delta: O_D= -0.4565181E-02 O_OD= -0.1018481E-01 O_TOT= -0.1474999E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 310 WF centre and spread 1 ( 5.505524, 18.948980, 3.322311 ) 114.76217376 WF centre and spread 2 ( 3.702505, 17.003562, 3.320928 ) 26.95072115 WF centre and spread 3 ( 2.482128, 16.754630, 3.308407 ) 33.74919843 WF centre and spread 4 ( 1.361596, 18.169396, 3.267055 ) 122.05787639 WF centre and spread 5 ( 1.389290,-19.242285, 3.309242 ) 27.68353014 WF centre and spread 6 ( 3.323977,-19.175616, 3.315220 ) 29.61049652 WF centre and spread 7 ( 4.138207, 16.500683, 3.311152 ) 25.89680382 WF centre and spread 8 ( 5.629979, 17.898134, 3.335127 ) 139.49008764 WF centre and spread 9 ( 0.859128, 16.526966, 3.272891 ) 75.65335318 WF centre and spread 10 ( 0.495522, 16.125034, 3.321951 ) 62.50510918 WF centre and spread 11 ( 0.560577,-18.496799, 3.313343 ) 29.99889775 WF centre and spread 12 ( 3.875192,-17.772658, 3.282599 ) 119.61084916 WF centre and spread 13 ( 2.379844, 19.394623, 3.307392 ) 104.70945180 WF centre and spread 14 ( 3.897346,-18.758842, 3.317697 ) 33.21717665 WF centre and spread 15 ( 2.129274, 15.886822, 3.305460 ) 40.56919721 WF centre and spread 16 ( 0.909790, 14.751663, 3.310067 ) 37.06594094 WF centre and spread 17 ( 0.484819,-17.061220, 3.308480 ) 66.95767312 WF centre and spread 18 ( 3.791186,-18.100878, 3.307219 ) 81.97499440 Sum of centres and spreads ( 46.915883, 59.352195, 59.536541 ) 1172.46353126 310 -0.168E+01 110.3536049783 1172.4634628677 18.49 <-- CONV O_D= 23.3659231 O_OD= 549.3425629 O_TOT= 1172.4634629 <-- SPRD Delta: O_D= -0.2285106E-01 O_OD= -0.1660256E+01 O_TOT= -0.1683107E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 320 WF centre and spread 1 ( 5.519872, 18.990190, 3.318349 ) 113.95058877 WF centre and spread 2 ( 3.700414, 17.002190, 3.320901 ) 25.92932693 WF centre and spread 3 ( 2.477549, 16.764258, 3.308426 ) 33.12966730 WF centre and spread 4 ( 1.495843, 18.134250, 3.267515 ) 119.57824432 WF centre and spread 5 ( 1.391585,-19.240951, 3.309347 ) 26.70492102 WF centre and spread 6 ( 3.319423,-19.179226, 3.315126 ) 28.27425142 WF centre and spread 7 ( 4.138016, 16.501418, 3.311182 ) 25.53666491 WF centre and spread 8 ( 5.549054, 17.896810, 3.335205 ) 138.58575595 WF centre and spread 9 ( 0.868048, 16.519424, 3.273339 ) 74.84640963 WF centre and spread 10 ( 0.489379, 16.124196, 3.321799 ) 61.78492990 WF centre and spread 11 ( 0.556569,-18.499946, 3.313205 ) 29.44918562 WF centre and spread 12 ( 3.858599,-17.740416, 3.282686 ) 119.43579982 WF centre and spread 13 ( 2.379292, 19.390750, 3.307893 ) 104.87655284 WF centre and spread 14 ( 3.893883,-18.759389, 3.317516 ) 32.14097394 WF centre and spread 15 ( 2.127386, 15.895519, 3.305561 ) 39.93834978 WF centre and spread 16 ( 0.904953, 14.742058, 3.310062 ) 36.58595087 WF centre and spread 17 ( 0.480377,-17.058733, 3.308311 ) 66.82578972 WF centre and spread 18 ( 3.792499,-18.105731, 3.307270 ) 81.78316613 Sum of centres and spreads ( 46.942741, 59.376673, 59.533694 ) 1159.35652885 320 -0.939E+00 67.7428792815 1159.3564606958 19.08 <-- CONV O_D= 21.2014674 O_OD= 538.4000164 O_TOT= 1159.3564607 <-- SPRD Delta: O_D= -0.2053155E+00 O_OD= -0.7337419E+00 O_TOT= -0.9390573E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 330 WF centre and spread 1 ( 5.502846, 19.028681, 3.293145 ) 113.89200007 WF centre and spread 2 ( 3.697125, 17.000941, 3.320894 ) 25.53159922 WF centre and spread 3 ( 2.469915, 16.773882, 3.308441 ) 32.74907324 WF centre and spread 4 ( 1.513999, 18.104809, 3.263741 ) 119.79967919 WF centre and spread 5 ( 1.390507,-19.239721, 3.309548 ) 26.19433409 WF centre and spread 6 ( 3.313632,-19.182456, 3.315115 ) 27.79755361 WF centre and spread 7 ( 4.137468, 16.502054, 3.311200 ) 25.24430942 WF centre and spread 8 ( 5.528485, 17.897557, 3.335256 ) 138.41959073 WF centre and spread 9 ( 0.877459, 16.524827, 3.273930 ) 74.31227660 WF centre and spread 10 ( 0.487964, 16.123333, 3.321636 ) 61.16299904 WF centre and spread 11 ( 0.551789,-18.503387, 3.313044 ) 29.07190560 WF centre and spread 12 ( 3.872314,-17.826670, 3.283025 ) 119.15211205 WF centre and spread 13 ( 2.399664, 19.386684, 3.308424 ) 105.32274703 WF centre and spread 14 ( 3.890653,-18.759899, 3.317343 ) 31.52109597 WF centre and spread 15 ( 2.125170, 15.904447, 3.305579 ) 39.58246654 WF centre and spread 16 ( 0.901416, 14.733064, 3.310082 ) 36.36067826 WF centre and spread 17 ( 0.475175,-17.056315, 3.308175 ) 66.68984531 WF centre and spread 18 ( 3.797303,-18.110216, 3.307313 ) 81.71060976 Sum of centres and spreads ( 46.932886, 59.301614, 59.505887 ) 1154.51487572 330 -0.204E+00 67.9344807155 1154.5148076696 19.68 <-- CONV O_D= 21.1270214 O_OD= 533.6328094 O_TOT= 1154.5148077 <-- SPRD Delta: O_D= 0.1407284E+00 O_OD= -0.3447468E+00 O_TOT= -0.2040184E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 340 WF centre and spread 1 ( 5.515238, 19.050784, 3.309044 ) 113.77962416 WF centre and spread 2 ( 3.695133, 17.000133, 3.320891 ) 25.33739202 WF centre and spread 3 ( 2.464437, 16.780639, 3.308439 ) 32.51822507 WF centre and spread 4 ( 1.533733, 18.105748, 3.263286 ) 119.81359253 WF centre and spread 5 ( 1.389869,-19.238821, 3.309671 ) 25.90913638 WF centre and spread 6 ( 3.310397,-19.184731, 3.315106 ) 27.58474356 WF centre and spread 7 ( 4.137254, 16.502518, 3.311211 ) 25.06334333 WF centre and spread 8 ( 5.575866, 17.863035, 3.335312 ) 138.00994089 WF centre and spread 9 ( 0.883519, 16.523576, 3.274337 ) 74.03949651 WF centre and spread 10 ( 0.484876, 16.125004, 3.321493 ) 60.72024621 WF centre and spread 11 ( 0.548712,-18.505613, 3.312934 ) 28.87415380 WF centre and spread 12 ( 3.853222,-17.946680, 3.283317 ) 119.24620531 WF centre and spread 13 ( 2.369533, 19.383938, 3.308786 ) 105.72763612 WF centre and spread 14 ( 3.889268,-18.759934, 3.317218 ) 31.20577404 WF centre and spread 15 ( 2.123520, 15.910757, 3.305600 ) 39.36780417 WF centre and spread 16 ( 0.898965, 14.726802, 3.310072 ) 36.22573313 WF centre and spread 17 ( 0.472053,-17.054632, 3.308057 ) 66.58916232 WF centre and spread 18 ( 3.799592,-18.113233, 3.307332 ) 81.67141452 Sum of centres and spreads ( 46.945185, 59.169289, 59.522106 ) 1151.68362407 340 -0.382E+00 47.8985473894 1151.6835558816 20.26 <-- CONV O_D= 20.8503558 O_OD= 531.0782232 O_TOT= 1151.6835559 <-- SPRD Delta: O_D= 0.6668478E-01 O_OD= -0.4490730E+00 O_TOT= -0.3823882E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 350 WF centre and spread 1 ( 5.528238, 19.086019, 3.308322 ) 113.72239567 WF centre and spread 2 ( 3.693411, 16.999416, 3.320893 ) 25.18775374 WF centre and spread 3 ( 2.459640, 16.786339, 3.308437 ) 32.32475589 WF centre and spread 4 ( 1.549355, 18.128091, 3.264395 ) 119.76930176 WF centre and spread 5 ( 1.389109,-19.238044, 3.309786 ) 25.67348802 WF centre and spread 6 ( 3.307434,-19.186841, 3.315107 ) 27.42934514 WF centre and spread 7 ( 4.136863, 16.502723, 3.311215 ) 24.92592868 WF centre and spread 8 ( 5.557724, 17.830368, 3.335338 ) 137.82018130 WF centre and spread 9 ( 0.889349, 16.499196, 3.274692 ) 73.88136782 WF centre and spread 10 ( 0.481279, 16.125042, 3.321373 ) 60.41893499 WF centre and spread 11 ( 0.545974,-18.507585, 3.312851 ) 28.74023727 WF centre and spread 12 ( 3.851851,-17.879503, 3.283515 ) 118.89561635 WF centre and spread 13 ( 2.395046, 19.381568, 3.309094 ) 106.09214014 WF centre and spread 14 ( 3.888190,-18.759976, 3.317101 ) 30.97969579 WF centre and spread 15 ( 2.122150, 15.915990, 3.305627 ) 39.16234943 WF centre and spread 16 ( 0.896507, 14.721133, 3.310057 ) 36.10370764 WF centre and spread 17 ( 0.469133,-17.053090, 3.307952 ) 66.51336235 WF centre and spread 18 ( 3.798766,-18.115916, 3.307354 ) 81.64066174 Sum of centres and spreads ( 46.960018, 59.234930, 59.523109 ) 1149.28122371 350 -0.142E+00 47.9554917552 1149.2811555110 20.86 <-- CONV O_D= 20.4582186 O_OD= 529.0679600 O_TOT= 1149.2811555 <-- SPRD Delta: O_D= -0.9588250E-01 O_OD= -0.4625037E-01 O_TOT= -0.1421329E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 360 WF centre and spread 1 ( 5.528163, 19.096747, 3.306815 ) 113.67986685 WF centre and spread 2 ( 3.692140, 16.998886, 3.320898 ) 25.08942907 WF centre and spread 3 ( 2.456409, 16.790128, 3.308436 ) 32.19227010 WF centre and spread 4 ( 1.558870, 18.204172, 3.263914 ) 119.91365345 WF centre and spread 5 ( 1.388547,-19.237576, 3.309864 ) 25.50097736 WF centre and spread 6 ( 3.305186,-19.188265, 3.315107 ) 27.31297497 WF centre and spread 7 ( 4.136561, 16.503144, 3.311216 ) 24.81313043 WF centre and spread 8 ( 5.551970, 17.818099, 3.335399 ) 137.71669913 WF centre and spread 9 ( 0.892428, 16.510858, 3.274925 ) 73.70390116 WF centre and spread 10 ( 0.480714, 16.126605, 3.321288 ) 60.16272599 WF centre and spread 11 ( 0.544090,-18.509314, 3.312790 ) 28.60054300 WF centre and spread 12 ( 3.847079,-17.894076, 3.283679 ) 118.92500680 WF centre and spread 13 ( 2.393168, 19.380141, 3.309290 ) 106.32594378 WF centre and spread 14 ( 3.887270,-18.760177, 3.317028 ) 30.78523018 WF centre and spread 15 ( 2.121313, 15.919621, 3.305646 ) 39.03345094 WF centre and spread 16 ( 0.894949, 14.717467, 3.310048 ) 36.03326482 WF centre and spread 17 ( 0.467221,-17.052192, 3.307875 ) 66.45776057 WF centre and spread 18 ( 3.799577,-18.117621, 3.307365 ) 81.61944724 Sum of centres and spreads ( 46.945654, 59.306648, 59.521582 ) 1147.86627583 360 0.123E+00 50.9449357694 1147.8662076880 21.44 <-- CONV O_D= 20.5411691 O_OD= 527.5700618 O_TOT= 1147.8662077 <-- SPRD Delta: O_D= 0.1295139E+00 O_OD= -0.6284035E-02 O_TOT= 0.1232298E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 370 WF centre and spread 1 ( 5.528836, 19.109701, 3.307294 ) 113.66666998 WF centre and spread 2 ( 3.691496, 16.998485, 3.320904 ) 25.04009634 WF centre and spread 3 ( 2.454221, 16.792683, 3.308432 ) 32.12092795 WF centre and spread 4 ( 1.563842, 18.158521, 3.263546 ) 119.70130084 WF centre and spread 5 ( 1.388093,-19.237278, 3.309913 ) 25.40281015 WF centre and spread 6 ( 3.303733,-19.189113, 3.315104 ) 27.28325978 WF centre and spread 7 ( 4.136381, 16.503143, 3.311215 ) 24.78167685 WF centre and spread 8 ( 5.556126, 17.836103, 3.335423 ) 137.62225647 WF centre and spread 9 ( 0.895362, 16.507102, 3.275081 ) 73.67103427 WF centre and spread 10 ( 0.479195, 16.127704, 3.321212 ) 60.07015597 WF centre and spread 11 ( 0.542986,-18.510275, 3.312759 ) 28.59828008 WF centre and spread 12 ( 3.845856,-17.884063, 3.283772 ) 118.69796716 WF centre and spread 13 ( 2.394563, 19.379023, 3.309425 ) 106.53265667 WF centre and spread 14 ( 3.886785,-18.759618, 3.316968 ) 30.80490163 WF centre and spread 15 ( 2.120598, 15.921760, 3.305656 ) 38.94462066 WF centre and spread 16 ( 0.893883, 14.714753, 3.310037 ) 35.97419816 WF centre and spread 17 ( 0.465562,-17.051520, 3.307828 ) 66.42808764 WF centre and spread 18 ( 3.801166,-18.118808, 3.307369 ) 81.60798004 Sum of centres and spreads ( 46.948684, 59.298303, 59.521938 ) 1146.94888064 370 -0.887E-01 43.5300877493 1146.9488124792 22.03 <-- CONV O_D= 20.3523987 O_OD= 526.8414369 O_TOT= 1146.9488125 <-- SPRD Delta: O_D= -0.1384517E-01 O_OD= -0.7489261E-01 O_TOT= -0.8873778E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 380 WF centre and spread 1 ( 5.529169, 19.109673, 3.307310 ) 113.65608963 WF centre and spread 2 ( 3.691365, 16.998426, 3.320905 ) 25.03186965 WF centre and spread 3 ( 2.453934, 16.793036, 3.308432 ) 32.10744864 WF centre and spread 4 ( 1.564758, 18.148174, 3.263486 ) 119.69911888 WF centre and spread 5 ( 1.388036,-19.237237, 3.309920 ) 25.38787748 WF centre and spread 6 ( 3.303513,-19.189238, 3.315104 ) 27.27229262 WF centre and spread 7 ( 4.136348, 16.503158, 3.311215 ) 24.77294641 WF centre and spread 8 ( 5.554454, 17.841335, 3.335435 ) 137.60346637 WF centre and spread 9 ( 0.895591, 16.509919, 3.275103 ) 73.65465836 WF centre and spread 10 ( 0.479174, 16.127863, 3.321206 ) 60.04021282 WF centre and spread 11 ( 0.542795,-18.510435, 3.312752 ) 28.57671286 WF centre and spread 12 ( 3.844815,-17.908429, 3.283791 ) 118.67875180 WF centre and spread 13 ( 2.393901, 19.378877, 3.309442 ) 106.54906291 WF centre and spread 14 ( 3.886910,-18.759714, 3.316964 ) 30.77124720 WF centre and spread 15 ( 2.120518, 15.922023, 3.305658 ) 38.93190057 WF centre and spread 16 ( 0.893714, 14.714410, 3.310035 ) 35.96742894 WF centre and spread 17 ( 0.465423,-17.051461, 3.307820 ) 66.42181501 WF centre and spread 18 ( 3.801231,-18.118955, 3.307370 ) 81.60562057 Sum of centres and spreads ( 46.945648, 59.271425, 59.521948 ) 1146.72852073 380 -0.572E-02 23.1154260168 1146.7284525782 22.63 <-- CONV O_D= 20.2950883 O_OD= 526.6783874 O_TOT= 1146.7284526 <-- SPRD Delta: O_D= 0.5804723E-03 O_OD= -0.6301975E-02 O_TOT= -0.5721503E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 390 WF centre and spread 1 ( 5.526311, 19.145877, 3.307206 ) 113.88730133 WF centre and spread 2 ( 3.691578, 16.998371, 3.320911 ) 25.05979149 WF centre and spread 3 ( 2.452310, 16.794306, 3.308419 ) 32.09582585 WF centre and spread 4 ( 1.555094, 18.182230, 3.263922 ) 119.60603510 WF centre and spread 5 ( 1.388017,-19.236859, 3.309918 ) 25.41272023 WF centre and spread 6 ( 3.304190,-19.189507, 3.315111 ) 27.33936483 WF centre and spread 7 ( 4.136607, 16.503131, 3.311224 ) 24.73901005 WF centre and spread 8 ( 5.550912, 17.906038, 3.335481 ) 137.76367618 WF centre and spread 9 ( 0.897228, 16.485066, 3.275163 ) 73.62875135 WF centre and spread 10 ( 0.479690, 16.126014, 3.321167 ) 59.96836163 WF centre and spread 11 ( 0.542913,-18.510284, 3.312725 ) 28.56767729 WF centre and spread 12 ( 3.843978,-17.995481, 3.283854 ) 119.08309662 WF centre and spread 13 ( 2.393263, 19.378212, 3.309502 ) 106.68137465 WF centre and spread 14 ( 3.887491,-18.759292, 3.316934 ) 30.72221011 WF centre and spread 15 ( 2.120542, 15.922831, 3.305661 ) 38.89241369 WF centre and spread 16 ( 0.893053, 14.712980, 3.310022 ) 35.94319903 WF centre and spread 17 ( 0.465175,-17.051247, 3.307773 ) 66.41163438 WF centre and spread 18 ( 3.801714,-18.119375, 3.307365 ) 81.61306205 Sum of centres and spreads ( 46.930067, 59.293012, 59.522359 ) 1147.41550586 390 0.259E+00 84.5012407679 1147.4154377514 23.24 <-- CONV O_D= 20.8043453 O_OD= 526.8561156 O_TOT= 1147.4154378 <-- SPRD Delta: O_D= 0.2783725E+00 O_OD= -0.1899233E-01 O_TOT= 0.2593801E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 400 WF centre and spread 1 ( 5.529552, 19.110200, 3.313908 ) 113.83464267 WF centre and spread 2 ( 3.690442, 16.997543, 3.320937 ) 25.01598793 WF centre and spread 3 ( 2.447995, 16.799002, 3.308407 ) 31.96646083 WF centre and spread 4 ( 1.548067, 18.203733, 3.263702 ) 119.61102304 WF centre and spread 5 ( 1.386886,-19.236171, 3.310011 ) 25.30362324 WF centre and spread 6 ( 3.302469,-19.191326, 3.315131 ) 27.32241939 WF centre and spread 7 ( 4.135981, 16.502855, 3.311206 ) 24.64652243 WF centre and spread 8 ( 5.563262, 17.861602, 3.335503 ) 137.54604343 WF centre and spread 9 ( 0.902233, 16.492026, 3.275477 ) 73.59018935 WF centre and spread 10 ( 0.477106, 16.127301, 3.321114 ) 59.68262943 WF centre and spread 11 ( 0.540200,-18.512002, 3.312655 ) 28.45047482 WF centre and spread 12 ( 3.794021,-17.816985, 3.284011 ) 119.24803447 WF centre and spread 13 ( 2.398007, 19.376396, 3.309739 ) 107.06912596 WF centre and spread 14 ( 3.888357,-18.759205, 3.316843 ) 30.53209996 WF centre and spread 15 ( 2.119703, 15.927269, 3.305688 ) 38.71809378 WF centre and spread 16 ( 0.890941, 14.707914, 3.309987 ) 35.85760694 WF centre and spread 17 ( 0.462847,-17.049997, 3.307677 ) 66.35239295 WF centre and spread 18 ( 3.803181,-18.121577, 3.307373 ) 81.59715522 Sum of centres and spreads ( 46.881251, 59.418577, 59.529370 ) 1146.34452585 400 -0.494E+00 57.6877730706 1146.3444578388 23.82 <-- CONV O_D= 20.8532285 O_OD= 525.7362525 O_TOT= 1146.3444578 <-- SPRD Delta: O_D= -0.4785782E+00 O_OD= -0.1511995E-01 O_TOT= -0.4936982E+00 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 410 WF centre and spread 1 ( 5.531499, 19.111285, 3.302369 ) 113.69907109 WF centre and spread 2 ( 3.689436, 16.996980, 3.320949 ) 24.90687667 WF centre and spread 3 ( 2.445397, 16.802579, 3.308408 ) 31.82637960 WF centre and spread 4 ( 1.581369, 18.137766, 3.262978 ) 119.52981174 WF centre and spread 5 ( 1.386272,-19.235612, 3.310092 ) 25.09399421 WF centre and spread 6 ( 3.299134,-19.192600, 3.315112 ) 27.15553675 WF centre and spread 7 ( 4.135780, 16.503084, 3.311204 ) 24.54268858 WF centre and spread 8 ( 5.541353, 17.845338, 3.335542 ) 137.46692398 WF centre and spread 9 ( 0.906414, 16.488999, 3.275712 ) 73.38162694 WF centre and spread 10 ( 0.476000, 16.128419, 3.321044 ) 59.45815121 WF centre and spread 11 ( 0.538301,-18.513172, 3.312599 ) 28.37752056 WF centre and spread 12 ( 3.848910,-17.876677, 3.284112 ) 118.85976534 WF centre and spread 13 ( 2.394097, 19.375670, 3.309917 ) 107.25527694 WF centre and spread 14 ( 3.887039,-18.758674, 3.316766 ) 30.42801422 WF centre and spread 15 ( 2.119403, 15.930622, 3.305710 ) 38.58782976 WF centre and spread 16 ( 0.889585, 14.704196, 3.309972 ) 35.78671789 WF centre and spread 17 ( 0.460746,-17.049086, 3.307613 ) 66.29882020 WF centre and spread 18 ( 3.804014,-18.123271, 3.307387 ) 81.56593493 Sum of centres and spreads ( 46.934748, 59.275847, 59.517489 ) 1144.22094061 410 -0.166E+00 48.0282409288 1144.2208724995 24.45 <-- CONV O_D= 20.4905079 O_OD= 523.9753877 O_TOT= 1144.2208725 <-- SPRD Delta: O_D= -0.4525714E-01 O_OD= -0.1205800E+00 O_TOT= -0.1658371E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 420 WF centre and spread 1 ( 5.542849, 19.224094, 3.305964 ) 115.10648165 WF centre and spread 2 ( 3.687344, 16.996024, 3.320975 ) 24.93522005 WF centre and spread 3 ( 2.441259, 16.806368, 3.308367 ) 31.98106330 WF centre and spread 4 ( 1.592472, 18.471766, 3.262421 ) 125.81694321 WF centre and spread 5 ( 1.387345,-19.235055, 3.310156 ) 24.94779789 WF centre and spread 6 ( 3.296344,-19.194121, 3.315119 ) 27.08822107 WF centre and spread 7 ( 4.132336, 16.501662, 3.311137 ) 24.86840722 WF centre and spread 8 ( 5.576055, 17.837470, 3.335337 ) 138.32942540 WF centre and spread 9 ( 0.900164, 16.530101, 3.275859 ) 75.95784072 WF centre and spread 10 ( 0.475407, 16.133159, 3.321102 ) 59.41336827 WF centre and spread 11 ( 0.542143,-18.512096, 3.312544 ) 28.59286126 WF centre and spread 12 ( 3.874358,-18.010376, 3.284220 ) 119.59283725 WF centre and spread 13 ( 2.387185, 19.375264, 3.310049 ) 107.78190228 WF centre and spread 14 ( 3.888757,-18.758079, 3.316748 ) 30.75632787 WF centre and spread 15 ( 2.118578, 15.935003, 3.305743 ) 38.48397485 WF centre and spread 16 ( 0.885459, 14.700280, 3.309958 ) 35.87856823 WF centre and spread 17 ( 0.455789,-17.045614, 3.307656 ) 66.43132658 WF centre and spread 18 ( 3.805100,-18.124978, 3.307398 ) 81.54792446 Sum of centres and spreads ( 46.988943, 59.630873, 59.520753 ) 1157.51049156 420 0.215E+01 101.0512779805 1157.5104232014 25.05 <-- CONV O_D= 26.3111051 O_OD= 531.4443412 O_TOT= 1157.5104232 <-- SPRD Delta: O_D= 0.5882978E+01 O_OD= -0.3737920E+01 O_TOT= 0.2145058E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 430 WF centre and spread 1 ( 5.548471, 19.193134, 3.317647 ) 114.27235561 WF centre and spread 2 ( 3.686882, 16.995318, 3.320990 ) 24.85534307 WF centre and spread 3 ( 2.438124, 16.809772, 3.308356 ) 31.75688549 WF centre and spread 4 ( 1.586156, 18.275607, 3.262903 ) 120.06293927 WF centre and spread 5 ( 1.386742,-19.234615, 3.310194 ) 24.92091979 WF centre and spread 6 ( 3.296581,-19.195748, 3.315153 ) 27.16590090 WF centre and spread 7 ( 4.133142, 16.501234, 3.311140 ) 24.58615417 WF centre and spread 8 ( 5.612799, 17.868352, 3.335448 ) 137.02576765 WF centre and spread 9 ( 0.907880, 16.496833, 3.276053 ) 74.60233036 WF centre and spread 10 ( 0.472837, 16.134591, 3.320978 ) 59.11159930 WF centre and spread 11 ( 0.539036,-18.513349, 3.312510 ) 28.39853568 WF centre and spread 12 ( 3.865048,-18.022795, 3.284376 ) 119.16990151 WF centre and spread 13 ( 2.397472, 19.372746, 3.310215 ) 108.06877541 WF centre and spread 14 ( 3.887185,-18.756562, 3.316666 ) 30.50824331 WF centre and spread 15 ( 2.118031, 15.937771, 3.305779 ) 38.35459280 WF centre and spread 16 ( 0.884411, 14.696030, 3.309927 ) 35.73509760 WF centre and spread 17 ( 0.455116,-17.045658, 3.307535 ) 66.23649841 WF centre and spread 18 ( 3.806251,-18.126727, 3.307393 ) 81.55183724 Sum of centres and spreads ( 47.022164, 59.385936, 59.533264 ) 1146.38367755 430 -0.814E+00 66.5650841818 1146.3836090291 25.64 <-- CONV O_D= 20.8754232 O_OD= 525.7532089 O_TOT= 1146.3836090 <-- SPRD Delta: O_D= 0.9435644E-01 O_OD= -0.9080491E+00 O_TOT= -0.8136926E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 440 WF centre and spread 1 ( 5.542870, 19.210886, 3.308546 ) 113.64099755 WF centre and spread 2 ( 3.685129, 16.994129, 3.321027 ) 24.70530136 WF centre and spread 3 ( 2.433044, 16.816361, 3.308361 ) 31.46923526 WF centre and spread 4 ( 1.612235, 18.169228, 3.262056 ) 119.40266752 WF centre and spread 5 ( 1.385061,-19.233689, 3.310338 ) 24.63309395 WF centre and spread 6 ( 3.291899,-19.197809, 3.315134 ) 26.97878379 WF centre and spread 7 ( 4.133417, 16.501323, 3.311137 ) 24.34858078 WF centre and spread 8 ( 5.553122, 17.907750, 3.335635 ) 136.87939957 WF centre and spread 9 ( 0.917241, 16.482497, 3.276474 ) 73.64709213 WF centre and spread 10 ( 0.471893, 16.135584, 3.320833 ) 58.69748302 WF centre and spread 11 ( 0.534706,-18.515437, 3.312400 ) 28.15816724 WF centre and spread 12 ( 3.833154,-17.973503, 3.284544 ) 118.94243534 WF centre and spread 13 ( 2.404455, 19.370963, 3.310494 ) 108.36031332 WF centre and spread 14 ( 3.887327,-18.756076, 3.316543 ) 30.10600934 WF centre and spread 15 ( 2.117149, 15.942957, 3.305838 ) 38.08734965 WF centre and spread 16 ( 0.881608, 14.689099, 3.309872 ) 35.54989728 WF centre and spread 17 ( 0.452312,-17.044602, 3.307383 ) 66.08188969 WF centre and spread 18 ( 3.807964,-18.129600, 3.307409 ) 81.50233056 Sum of centres and spreads ( 46.944586, 59.370061, 59.524023 ) 1141.19102737 440 -0.198E+00 101.6905958997 1141.1909592070 26.25 <-- CONV O_D= 20.3591204 O_OD= 521.0768620 O_TOT= 1141.1909592 <-- SPRD Delta: O_D= -0.1673655E+00 O_OD= -0.3020997E-01 O_TOT= -0.1975755E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 450 WF centre and spread 1 ( 5.535736, 19.222983, 3.306485 ) 113.62507013 WF centre and spread 2 ( 3.684436, 16.993762, 3.321045 ) 24.65457079 WF centre and spread 3 ( 2.430736, 16.818713, 3.308363 ) 31.38565372 WF centre and spread 4 ( 1.606469, 18.132108, 3.261755 ) 119.36616580 WF centre and spread 5 ( 1.384518,-19.233389, 3.310393 ) 24.53254055 WF centre and spread 6 ( 3.290257,-19.198611, 3.315144 ) 26.92355775 WF centre and spread 7 ( 4.133310, 16.501755, 3.311136 ) 24.24793582 WF centre and spread 8 ( 5.549802, 17.905188, 3.335673 ) 136.75466505 WF centre and spread 9 ( 0.920276, 16.465810, 3.276628 ) 73.40624713 WF centre and spread 10 ( 0.469784, 16.136851, 3.320778 ) 58.51055448 WF centre and spread 11 ( 0.533329,-18.516356, 3.312363 ) 28.08800730 WF centre and spread 12 ( 3.809997,-17.979713, 3.284576 ) 118.57969582 WF centre and spread 13 ( 2.411071, 19.370077, 3.310594 ) 108.50002823 WF centre and spread 14 ( 3.885312,-18.755678, 3.316477 ) 30.04299098 WF centre and spread 15 ( 2.116816, 15.945706, 3.305859 ) 38.00509536 WF centre and spread 16 ( 0.880795, 14.686661, 3.309862 ) 35.49912697 WF centre and spread 17 ( 0.450998,-17.044242, 3.307333 ) 66.04819143 WF centre and spread 18 ( 3.808766,-18.130735, 3.307415 ) 81.48948917 Sum of centres and spreads ( 46.902406, 59.320893, 59.521878 ) 1139.65958647 450 -0.535E-01 53.2994842641 1139.6595184339 26.84 <-- CONV O_D= 19.9725829 O_OD= 519.9319587 O_TOT= 1139.6595184 <-- SPRD Delta: O_D= 0.2215281E-01 O_OD= -0.7563440E-01 O_TOT= -0.5348159E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 460 WF centre and spread 1 ( 5.541119, 19.236568, 3.306553 ) 113.60466107 WF centre and spread 2 ( 3.683815, 16.993371, 3.321059 ) 24.60875708 WF centre and spread 3 ( 2.428616, 16.821002, 3.308360 ) 31.30524497 WF centre and spread 4 ( 1.608997, 18.175612, 3.261569 ) 119.21598401 WF centre and spread 5 ( 1.384104,-19.233162, 3.310438 ) 24.43889335 WF centre and spread 6 ( 3.289164,-19.199469, 3.315147 ) 26.87081486 WF centre and spread 7 ( 4.133299, 16.502188, 3.311132 ) 24.15677612 WF centre and spread 8 ( 5.554746, 17.905098, 3.335723 ) 136.73559784 WF centre and spread 9 ( 0.922759, 16.483289, 3.276772 ) 73.18929466 WF centre and spread 10 ( 0.468859, 16.138587, 3.320731 ) 58.31559097 WF centre and spread 11 ( 0.532120,-18.517545, 3.312323 ) 27.96761206 WF centre and spread 12 ( 3.815934,-18.000103, 3.284661 ) 118.65513214 WF centre and spread 13 ( 2.404904, 19.369176, 3.310689 ) 108.62651831 WF centre and spread 14 ( 3.884734,-18.755718, 3.316427 ) 29.89775201 WF centre and spread 15 ( 2.116520, 15.948241, 3.305883 ) 37.92756634 WF centre and spread 16 ( 0.879932, 14.684310, 3.309847 ) 35.45822695 WF centre and spread 17 ( 0.449911,-17.043848, 3.307280 ) 66.01583734 WF centre and spread 18 ( 3.809464,-18.131771, 3.307417 ) 81.48074346 Sum of centres and spreads ( 46.908997, 59.375825, 59.522011 ) 1138.47100354 460 -0.382E-01 35.9494015898 1138.4709354665 27.44 <-- CONV O_D= 19.8403616 O_OD= 518.8755970 O_TOT= 1138.4709355 <-- SPRD Delta: O_D= -0.8071832E-02 O_OD= -0.3011287E-01 O_TOT= -0.3818471E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 470 WF centre and spread 1 ( 5.541374, 19.238557, 3.306600 ) 113.63605819 WF centre and spread 2 ( 3.683709, 16.993148, 3.321067 ) 24.61397935 WF centre and spread 3 ( 2.427557, 16.821911, 3.308355 ) 31.28839671 WF centre and spread 4 ( 1.603337, 18.176679, 3.261817 ) 119.17251307 WF centre and spread 5 ( 1.383906,-19.233012, 3.310452 ) 24.43429410 WF centre and spread 6 ( 3.289056,-19.199745, 3.315149 ) 26.91300827 WF centre and spread 7 ( 4.133440, 16.501946, 3.311135 ) 24.17455385 WF centre and spread 8 ( 5.553164, 18.026152, 3.335744 ) 137.24150605 WF centre and spread 9 ( 0.924666, 16.477050, 3.276831 ) 73.20806635 WF centre and spread 10 ( 0.467969, 16.137712, 3.320686 ) 58.33454781 WF centre and spread 11 ( 0.531787,-18.517673, 3.312315 ) 28.01662125 WF centre and spread 12 ( 3.819047,-17.959308, 3.284692 ) 118.50751247 WF centre and spread 13 ( 2.409157, 19.368356, 3.310731 ) 108.73028761 WF centre and spread 14 ( 3.885327,-18.755395, 3.316401 ) 29.94775162 WF centre and spread 15 ( 2.116280, 15.948569, 3.305892 ) 37.89092891 WF centre and spread 16 ( 0.879385, 14.682994, 3.309828 ) 35.42779900 WF centre and spread 17 ( 0.449331,-17.043748, 3.307249 ) 66.00738746 WF centre and spread 18 ( 3.809793,-18.132219, 3.307416 ) 81.48224919 Sum of centres and spreads ( 46.908285, 59.531974, 59.522356 ) 1139.02746125 470 0.136E+00 76.7176226643 1139.0273931632 28.02 <-- CONV O_D= 20.3658234 O_OD= 518.9065929 O_TOT= 1139.0273932 <-- SPRD Delta: O_D= 0.1754154E+00 O_OD= -0.3932255E-01 O_TOT= 0.1360928E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 480 WF centre and spread 1 ( 5.546127, 19.249842, 3.311224 ) 113.56058155 WF centre and spread 2 ( 3.683142, 16.992921, 3.321077 ) 24.56463499 WF centre and spread 3 ( 2.426242, 16.823609, 3.308356 ) 31.22641768 WF centre and spread 4 ( 1.615985, 18.166225, 3.261326 ) 119.18564225 WF centre and spread 5 ( 1.383727,-19.232737, 3.310489 ) 24.35185174 WF centre and spread 6 ( 3.287786,-19.200409, 3.315150 ) 26.83339418 WF centre and spread 7 ( 4.133455, 16.502120, 3.311132 ) 24.10888017 WF centre and spread 8 ( 5.552660, 17.903877, 3.335726 ) 136.75324535 WF centre and spread 9 ( 0.926639, 16.460597, 3.276945 ) 73.09106139 WF centre and spread 10 ( 0.468105, 16.138287, 3.320683 ) 58.21814151 WF centre and spread 11 ( 0.530889,-18.517922, 3.312284 ) 27.96724316 WF centre and spread 12 ( 3.814786,-17.992420, 3.284738 ) 118.50730529 WF centre and spread 13 ( 2.409669, 19.367920, 3.310792 ) 108.79965350 WF centre and spread 14 ( 3.884398,-18.755336, 3.316365 ) 29.85635852 WF centre and spread 15 ( 2.116090, 15.950587, 3.305909 ) 37.83515552 WF centre and spread 16 ( 0.878945, 14.681489, 3.309824 ) 35.40358072 WF centre and spread 17 ( 0.448609,-17.043292, 3.307219 ) 65.98227077 WF centre and spread 18 ( 3.810307,-18.132972, 3.307422 ) 81.46979242 Sum of centres and spreads ( 46.917561, 59.362387, 59.526661 ) 1137.71521073 480 -0.197E-01 32.9843839935 1137.7151426314 28.61 <-- CONV O_D= 19.8129607 O_OD= 518.1472050 O_TOT= 1137.7151426 <-- SPRD Delta: O_D= -0.2466136E-02 O_OD= -0.1723565E-01 O_TOT= -0.1970179E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 490 WF centre and spread 1 ( 5.542259, 19.260043, 3.313303 ) 113.57435390 WF centre and spread 2 ( 3.682842, 16.992549, 3.321091 ) 24.55658213 WF centre and spread 3 ( 2.424563, 16.825179, 3.308350 ) 31.17862445 WF centre and spread 4 ( 1.614267, 18.157722, 3.261473 ) 119.10671048 WF centre and spread 5 ( 1.383310,-19.232640, 3.310519 ) 24.32881843 WF centre and spread 6 ( 3.287247,-19.201108, 3.315155 ) 26.85105153 WF centre and spread 7 ( 4.133487, 16.502047, 3.311125 ) 24.07889852 WF centre and spread 8 ( 5.554742, 17.904346, 3.335737 ) 136.76419497 WF centre and spread 9 ( 0.929438, 16.498312, 3.277058 ) 73.05716836 WF centre and spread 10 ( 0.467319, 16.138786, 3.320659 ) 58.12322083 WF centre and spread 11 ( 0.529908,-18.518615, 3.312261 ) 27.93697341 WF centre and spread 12 ( 3.814686,-17.922133, 3.284763 ) 118.69519491 WF centre and spread 13 ( 2.409681, 19.367179, 3.310860 ) 108.93294760 WF centre and spread 14 ( 3.884637,-18.755072, 3.316320 ) 29.81709098 WF centre and spread 15 ( 2.115836, 15.952194, 3.305924 ) 37.78118443 WF centre and spread 16 ( 0.878230, 14.679395, 3.309809 ) 35.37061094 WF centre and spread 17 ( 0.447717,-17.043030, 3.307187 ) 65.96749371 WF centre and spread 18 ( 3.810901,-18.133807, 3.307424 ) 81.46914430 Sum of centres and spreads ( 46.911070, 59.471348, 59.529015 ) 1137.59026388 490 -0.709E+00 185.7863843024 1137.5901958013 29.19 <-- CONV O_D= 19.9663068 O_OD= 517.8689122 O_TOT= 1137.5901958 <-- SPRD Delta: O_D= -0.9070958E+00 O_OD= 0.1985002E+00 O_TOT= -0.7085956E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 500 WF centre and spread 1 ( 5.541789, 19.252410, 3.312612 ) 113.53113825 WF centre and spread 2 ( 3.682473, 16.992428, 3.321099 ) 24.51903896 WF centre and spread 3 ( 2.423532, 16.826543, 3.308352 ) 31.12717886 WF centre and spread 4 ( 1.620747, 18.156352, 3.261149 ) 119.09615294 WF centre and spread 5 ( 1.383072,-19.232463, 3.310549 ) 24.26645078 WF centre and spread 6 ( 3.286317,-19.201593, 3.315160 ) 26.79457963 WF centre and spread 7 ( 4.133411, 16.502065, 3.311118 ) 24.04189491 WF centre and spread 8 ( 5.554782, 17.901899, 3.335750 ) 136.74309996 WF centre and spread 9 ( 0.930518, 16.467637, 3.277146 ) 72.92518589 WF centre and spread 10 ( 0.466753, 16.139307, 3.320646 ) 58.03311353 WF centre and spread 11 ( 0.528978,-18.519166, 3.312245 ) 27.89138266 WF centre and spread 12 ( 3.809503,-17.979993, 3.284804 ) 118.54664903 WF centre and spread 13 ( 2.410384, 19.366745, 3.310905 ) 108.98925040 WF centre and spread 14 ( 3.884114,-18.755045, 3.316298 ) 29.75441896 WF centre and spread 15 ( 2.115739, 15.953443, 3.305939 ) 37.73809089 WF centre and spread 16 ( 0.877724, 14.678143, 3.309804 ) 35.34442002 WF centre and spread 17 ( 0.447083,-17.042734, 3.307160 ) 65.95066879 WF centre and spread 18 ( 3.811273,-18.134298, 3.307428 ) 81.45997736 Sum of centres and spreads ( 46.908190, 59.371679, 59.528162 ) 1136.75269183 500 -0.176E-01 26.8455735004 1136.7526237602 29.85 <-- CONV O_D= 19.7706973 O_OD= 517.2269496 O_TOT= 1136.7526238 <-- SPRD Delta: O_D= -0.3603500E-02 O_OD= -0.1398291E-01 O_TOT= -0.1758641E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 510 WF centre and spread 1 ( 5.543408, 19.263575, 3.309606 ) 113.52799552 WF centre and spread 2 ( 3.682363, 16.992373, 3.321100 ) 24.51064644 WF centre and spread 3 ( 2.423296, 16.826800, 3.308352 ) 31.11697197 WF centre and spread 4 ( 1.621558, 18.162335, 3.261068 ) 119.08993347 WF centre and spread 5 ( 1.383027,-19.232441, 3.310555 ) 24.25261843 WF centre and spread 6 ( 3.286136,-19.201705, 3.315160 ) 26.78312598 WF centre and spread 7 ( 4.133394, 16.502116, 3.311117 ) 24.03098708 WF centre and spread 8 ( 5.554702, 17.901467, 3.335755 ) 136.73677424 WF centre and spread 9 ( 0.930798, 16.472905, 3.277164 ) 72.90104135 WF centre and spread 10 ( 0.466648, 16.139536, 3.320641 ) 58.01000635 WF centre and spread 11 ( 0.528820,-18.519297, 3.312240 ) 27.87789485 WF centre and spread 12 ( 3.810585,-17.993925, 3.284814 ) 118.54023611 WF centre and spread 13 ( 2.411875, 19.366635, 3.310913 ) 109.00083735 WF centre and spread 14 ( 3.883957,-18.755057, 3.316293 ) 29.73807317 WF centre and spread 15 ( 2.115730, 15.953742, 3.305942 ) 37.72480254 WF centre and spread 16 ( 0.877587, 14.677885, 3.309802 ) 35.33684772 WF centre and spread 17 ( 0.446930,-17.042690, 3.307154 ) 65.94658694 WF centre and spread 18 ( 3.811352,-18.134418, 3.307428 ) 81.45818302 Sum of centres and spreads ( 46.912167, 59.379836, 59.525107 ) 1136.58356254 510 -0.682E-02 19.8955392750 1136.5834944586 30.53 <-- CONV O_D= 19.7517221 O_OD= 517.0767955 O_TOT= 1136.5834945 <-- SPRD Delta: O_D= 0.3634394E-04 O_OD= -0.6857704E-02 O_TOT= -0.6821360E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 520 WF centre and spread 1 ( 5.506707, 19.224156, 3.321597 ) 113.80806160 WF centre and spread 2 ( 3.681714, 16.991497, 3.321129 ) 24.49615537 WF centre and spread 3 ( 2.419078, 16.830808, 3.308338 ) 31.01878362 WF centre and spread 4 ( 1.637032, 18.173044, 3.261111 ) 119.11149057 WF centre and spread 5 ( 1.382623,-19.231395, 3.310618 ) 24.16468579 WF centre and spread 6 ( 3.284942,-19.203327, 3.315160 ) 26.78867944 WF centre and spread 7 ( 4.133916, 16.502221, 3.311127 ) 23.92184332 WF centre and spread 8 ( 5.545502, 18.019131, 3.335875 ) 137.19486936 WF centre and spread 9 ( 0.937156, 16.514685, 3.277399 ) 72.91854393 WF centre and spread 10 ( 0.463166, 16.136682, 3.320490 ) 57.88450897 WF centre and spread 11 ( 0.527330,-18.519681, 3.312185 ) 28.00379602 WF centre and spread 12 ( 3.840857,-18.186767, 3.284956 ) 119.20789409 WF centre and spread 13 ( 2.414546, 19.365330, 3.311056 ) 109.36478970 WF centre and spread 14 ( 3.882412,-18.752390, 3.316174 ) 29.89462162 WF centre and spread 15 ( 2.116005, 15.957905, 3.305987 ) 37.76810716 WF centre and spread 16 ( 0.877889, 14.672923, 3.309752 ) 35.38829464 WF centre and spread 17 ( 0.445859,-17.041701, 3.307023 ) 65.94166025 WF centre and spread 18 ( 3.812926,-18.136118, 3.307424 ) 81.45582086 Sum of centres and spreads ( 46.909658, 59.317003, 59.537401 ) 1138.33260630 520 -0.135E+01 128.5519756057 1138.3325383132 31.11 <-- CONV O_D= 21.1097739 O_OD= 517.4677875 O_TOT= 1138.3325383 <-- SPRD Delta: O_D= -0.1543485E+01 O_OD= 0.1983001E+00 O_TOT= -0.1345185E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 530 WF centre and spread 1 ( 5.587165, 19.313296, 3.316146 ) 113.59438697 WF centre and spread 2 ( 3.680595, 16.990976, 3.321165 ) 24.41818216 WF centre and spread 3 ( 2.415251, 16.835203, 3.308332 ) 30.88657623 WF centre and spread 4 ( 1.631126, 18.126982, 3.260245 ) 118.98425045 WF centre and spread 5 ( 1.381880,-19.230755, 3.310707 ) 23.98763677 WF centre and spread 6 ( 3.282483,-19.204387, 3.315175 ) 26.67344303 WF centre and spread 7 ( 4.133751, 16.502414, 3.311116 ) 23.83724250 WF centre and spread 8 ( 5.539218, 17.955798, 3.335836 ) 136.83711898 WF centre and spread 9 ( 0.941309, 16.434797, 3.277667 ) 72.60370374 WF centre and spread 10 ( 0.463975, 16.139911, 3.320480 ) 57.58869184 WF centre and spread 11 ( 0.525168,-18.520936, 3.312116 ) 27.79111313 WF centre and spread 12 ( 3.814727,-18.088885, 3.285099 ) 118.65578149 WF centre and spread 13 ( 2.417103, 19.362681, 3.311166 ) 109.55148931 WF centre and spread 14 ( 3.883616,-18.753573, 3.316100 ) 29.50024327 WF centre and spread 15 ( 2.115373, 15.961577, 3.306069 ) 37.43566181 WF centre and spread 16 ( 0.874485, 14.668799, 3.309703 ) 35.18397216 WF centre and spread 17 ( 0.443422,-17.040522, 3.306920 ) 65.85363031 WF centre and spread 18 ( 3.814289,-18.137818, 3.307433 ) 81.42822983 Sum of centres and spreads ( 46.944937, 59.315557, 59.531472 ) 1134.81135400 530 -0.413E+00 54.9221485572 1134.8112857809 31.71 <-- CONV O_D= 20.2040982 O_OD= 514.8522107 O_TOT= 1134.8112858 <-- SPRD Delta: O_D= 0.1418138E+00 O_OD= -0.5545193E+00 O_TOT= -0.4127055E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 540 WF centre and spread 1 ( 5.534114, 19.299799, 3.306474 ) 113.48789260 WF centre and spread 2 ( 3.680045, 16.990695, 3.321174 ) 24.38537169 WF centre and spread 3 ( 2.414302, 16.836224, 3.308332 ) 30.84863260 WF centre and spread 4 ( 1.634567, 18.141082, 3.260553 ) 118.90470980 WF centre and spread 5 ( 1.381648,-19.230700, 3.310734 ) 23.94464820 WF centre and spread 6 ( 3.281756,-19.205012, 3.315183 ) 26.64057198 WF centre and spread 7 ( 4.133675, 16.502442, 3.311107 ) 23.80461643 WF centre and spread 8 ( 5.547739, 17.941210, 3.335830 ) 136.76008616 WF centre and spread 9 ( 0.942561, 16.467994, 3.277729 ) 72.48757504 WF centre and spread 10 ( 0.463166, 16.140962, 3.320483 ) 57.49520247 WF centre and spread 11 ( 0.524428,-18.521372, 3.312102 ) 27.74819674 WF centre and spread 12 ( 3.805360,-18.059502, 3.285111 ) 118.39196625 WF centre and spread 13 ( 2.417990, 19.362216, 3.311191 ) 109.61669525 WF centre and spread 14 ( 3.882996,-18.753490, 3.316070 ) 29.46197971 WF centre and spread 15 ( 2.115214, 15.962867, 3.306083 ) 37.38295818 WF centre and spread 16 ( 0.873883, 14.667597, 3.309712 ) 35.15443867 WF centre and spread 17 ( 0.442700,-17.040347, 3.306908 ) 65.83899396 WF centre and spread 18 ( 3.814307,-18.138404, 3.307436 ) 81.42158498 Sum of centres and spreads ( 46.890448, 59.364261, 59.522212 ) 1133.77612070 540 -0.374E-01 48.4071401364 1133.7760527111 32.29 <-- CONV O_D= 19.6788413 O_OD= 514.3422345 O_TOT= 1133.7760527 <-- SPRD Delta: O_D= -0.3110741E-02 O_OD= -0.3425650E-01 O_TOT= -0.3736724E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 550 WF centre and spread 1 ( 5.538476, 19.318394, 3.305953 ) 113.58084025 WF centre and spread 2 ( 3.679897, 16.990213, 3.321191 ) 24.38099076 WF centre and spread 3 ( 2.412033, 16.838903, 3.308315 ) 30.79390765 WF centre and spread 4 ( 1.644042, 18.184083, 3.261143 ) 118.86145932 WF centre and spread 5 ( 1.381332,-19.230516, 3.310758 ) 23.88831337 WF centre and spread 6 ( 3.281756,-19.205879, 3.315179 ) 26.69134839 WF centre and spread 7 ( 4.133818, 16.502500, 3.311099 ) 23.76621030 WF centre and spread 8 ( 5.541592, 17.909857, 3.335855 ) 136.71134452 WF centre and spread 9 ( 0.946639, 16.464976, 3.277854 ) 72.41038456 WF centre and spread 10 ( 0.462208, 16.144641, 3.320439 ) 57.35082893 WF centre and spread 11 ( 0.523438,-18.522337, 3.312064 ) 27.72233461 WF centre and spread 12 ( 3.784679,-18.046144, 3.285242 ) 118.30110656 WF centre and spread 13 ( 2.420560, 19.360021, 3.311244 ) 109.83303218 WF centre and spread 14 ( 3.883540,-18.752732, 3.315999 ) 29.45250014 WF centre and spread 15 ( 2.114524, 15.965641, 3.306113 ) 37.29440713 WF centre and spread 16 ( 0.872727, 14.664698, 3.309683 ) 35.11262224 WF centre and spread 17 ( 0.441215,-17.039757, 3.306839 ) 65.80810463 WF centre and spread 18 ( 3.815326,-18.139553, 3.307428 ) 81.42666826 Sum of centres and spreads ( 46.877804, 59.407008, 59.522399 ) 1133.38640380 550 -0.134E+00 39.8730234701 1133.3863358627 32.88 <-- CONV O_D= 19.6316246 O_OD= 513.9997344 O_TOT= 1133.3863359 <-- SPRD Delta: O_D= -0.4370289E-01 O_OD= -0.8999604E-01 O_TOT= -0.1336989E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 560 WF centre and spread 1 ( 5.565657, 19.337949, 3.307195 ) 113.47834159 WF centre and spread 2 ( 3.678608, 16.989542, 3.321223 ) 24.28938090 WF centre and spread 3 ( 2.409209, 16.841850, 3.308321 ) 30.67935110 WF centre and spread 4 ( 1.641813, 18.170132, 3.260153 ) 118.73470379 WF centre and spread 5 ( 1.380675,-19.230211, 3.310840 ) 23.73674925 WF centre and spread 6 ( 3.279231,-19.206931, 3.315199 ) 26.55927537 WF centre and spread 7 ( 4.133550, 16.502857, 3.311087 ) 23.68070833 WF centre and spread 8 ( 5.551932, 17.881461, 3.335874 ) 136.60292709 WF centre and spread 9 ( 0.949889, 16.464214, 3.278086 ) 72.23080530 WF centre and spread 10 ( 0.460691, 16.148437, 3.320390 ) 57.11583823 WF centre and spread 11 ( 0.521457,-18.523745, 3.312017 ) 27.58806466 WF centre and spread 12 ( 3.800883,-18.065077, 3.285304 ) 118.36769449 WF centre and spread 13 ( 2.423811, 19.358032, 3.311289 ) 109.94744650 WF centre and spread 14 ( 3.882144,-18.752990, 3.315934 ) 29.27265415 WF centre and spread 15 ( 2.114108, 15.968904, 3.306151 ) 37.19148558 WF centre and spread 16 ( 0.871536, 14.661547, 3.309656 ) 35.05063591 WF centre and spread 17 ( 0.439629,-17.039192, 3.306785 ) 65.76488578 WF centre and spread 18 ( 3.816183,-18.140982, 3.307437 ) 81.40094166 Sum of centres and spreads ( 46.921006, 59.365796, 59.522941 ) 1131.69188965 560 -0.161E+00 31.0891935560 1131.6918215104 33.46 <-- CONV O_D= 19.5284246 O_OD= 512.4084201 O_TOT= 1131.6918215 <-- SPRD Delta: O_D= 0.3473219E-01 O_OD= -0.1960027E+00 O_TOT= -0.1612705E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 570 WF centre and spread 1 ( 5.546815, 19.340180, 3.306261 ) 113.49454637 WF centre and spread 2 ( 3.678481, 16.989361, 3.321229 ) 24.30040059 WF centre and spread 3 ( 2.408294, 16.842695, 3.308317 ) 30.66287610 WF centre and spread 4 ( 1.637772, 18.153701, 3.260489 ) 118.67407260 WF centre and spread 5 ( 1.380457,-19.230149, 3.310856 ) 23.72353057 WF centre and spread 6 ( 3.278967,-19.207323, 3.315199 ) 26.58791559 WF centre and spread 7 ( 4.133522, 16.502833, 3.311082 ) 23.67924303 WF centre and spread 8 ( 5.556770, 17.883874, 3.335900 ) 136.61802306 WF centre and spread 9 ( 0.950901, 16.490109, 3.278141 ) 72.24705875 WF centre and spread 10 ( 0.460310, 16.149593, 3.320364 ) 57.09382167 WF centre and spread 11 ( 0.521027,-18.524001, 3.312005 ) 27.61395720 WF centre and spread 12 ( 3.800407,-18.103031, 3.285339 ) 118.27277055 WF centre and spread 13 ( 2.423058, 19.357636, 3.311302 ) 110.04798812 WF centre and spread 14 ( 3.882154,-18.752405, 3.315908 ) 29.32242962 WF centre and spread 15 ( 2.113889, 15.969764, 3.306160 ) 37.16301475 WF centre and spread 16 ( 0.871032, 14.660415, 3.309650 ) 35.03582829 WF centre and spread 17 ( 0.439013,-17.038870, 3.306758 ) 65.75409182 WF centre and spread 18 ( 3.816521,-18.141302, 3.307437 ) 81.40266038 Sum of centres and spreads ( 46.899390, 59.343079, 59.522398 ) 1131.69422907 570 -0.324E+00 51.1565163648 1131.6941610075 34.06 <-- CONV O_D= 19.4912573 O_OD= 512.4479269 O_TOT= 1131.6941610 <-- SPRD Delta: O_D= -0.2062917E+00 O_OD= -0.1176717E+00 O_TOT= -0.3239634E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 580 WF centre and spread 1 ( 5.547925, 19.347197, 3.306278 ) 113.48258028 WF centre and spread 2 ( 3.678101, 16.989235, 3.321236 ) 24.26881307 WF centre and spread 3 ( 2.407159, 16.843801, 3.308317 ) 30.62192194 WF centre and spread 4 ( 1.644509, 18.149013, 3.260140 ) 118.68445689 WF centre and spread 5 ( 1.380439,-19.229908, 3.310876 ) 23.67893178 WF centre and spread 6 ( 3.278239,-19.207679, 3.315201 ) 26.54042958 WF centre and spread 7 ( 4.133642, 16.502854, 3.311084 ) 23.64841535 WF centre and spread 8 ( 5.551580, 17.889958, 3.335906 ) 136.76610606 WF centre and spread 9 ( 0.952033, 16.464522, 3.278207 ) 72.16584784 WF centre and spread 10 ( 0.458660, 16.148074, 3.320337 ) 57.02836023 WF centre and spread 11 ( 0.520787,-18.524048, 3.311985 ) 27.57909478 WF centre and spread 12 ( 3.789901,-18.054066, 3.285365 ) 118.31904665 WF centre and spread 13 ( 2.423403, 19.356809, 3.311317 ) 110.08448369 WF centre and spread 14 ( 3.882008,-18.752579, 3.315884 ) 29.23404947 WF centre and spread 15 ( 2.113870, 15.970800, 3.306176 ) 37.12699642 WF centre and spread 16 ( 0.870387, 14.659200, 3.309637 ) 35.00692275 WF centre and spread 17 ( 0.438593,-17.038726, 3.306737 ) 65.74503094 WF centre and spread 18 ( 3.816867,-18.141762, 3.307440 ) 81.39450952 Sum of centres and spreads ( 46.888102, 59.372696, 59.522124 ) 1131.37599726 580 -0.787E-01 88.6551573253 1131.3759292401 34.64 <-- CONV O_D= 19.6089546 O_OD= 512.0119978 O_TOT= 1131.3759292 <-- SPRD Delta: O_D= -0.5925138E-01 O_OD= -0.1946397E-01 O_TOT= -0.7871534E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 590 WF centre and spread 1 ( 5.547868, 19.348400, 3.306285 ) 113.47110773 WF centre and spread 2 ( 3.677908, 16.989140, 3.321240 ) 24.25417016 WF centre and spread 3 ( 2.406736, 16.844239, 3.308317 ) 30.60450119 WF centre and spread 4 ( 1.646825, 18.152184, 3.259967 ) 118.68264719 WF centre and spread 5 ( 1.380386,-19.229859, 3.310886 ) 23.66043491 WF centre and spread 6 ( 3.277896,-19.207876, 3.315204 ) 26.52013273 WF centre and spread 7 ( 4.133641, 16.502822, 3.311081 ) 23.63540544 WF centre and spread 8 ( 5.551606, 17.913392, 3.335903 ) 136.64584681 WF centre and spread 9 ( 0.952590, 16.463278, 3.278240 ) 72.14478251 WF centre and spread 10 ( 0.459287, 16.148048, 3.320339 ) 56.99413628 WF centre and spread 11 ( 0.520503,-18.524196, 3.311979 ) 27.55843344 WF centre and spread 12 ( 3.794141,-18.077956, 3.285375 ) 118.33882475 WF centre and spread 13 ( 2.422932, 19.356447, 3.311320 ) 110.09684714 WF centre and spread 14 ( 3.881862,-18.752652, 3.315876 ) 29.20009148 WF centre and spread 15 ( 2.113857, 15.971244, 3.306181 ) 37.11142059 WF centre and spread 16 ( 0.870184, 14.658713, 3.309635 ) 34.99864479 WF centre and spread 17 ( 0.438402,-17.038667, 3.306731 ) 65.73896793 WF centre and spread 18 ( 3.816955,-18.141980, 3.307441 ) 81.39165426 Sum of centres and spreads ( 46.893578, 59.374722, 59.522000 ) 1131.04804932 590 -0.136E-01 32.1786227796 1131.0479812906 35.24 <-- CONV O_D= 19.5014796 O_OD= 511.7915248 O_TOT= 1131.0479813 <-- SPRD Delta: O_D= -0.3659656E-02 O_OD= -0.9890637E-02 O_TOT= -0.1355029E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 600 WF centre and spread 1 ( 5.548063, 19.349303, 3.306291 ) 113.46502015 WF centre and spread 2 ( 3.677832, 16.989107, 3.321242 ) 24.24906694 WF centre and spread 3 ( 2.406589, 16.844406, 3.308317 ) 30.59810221 WF centre and spread 4 ( 1.647586, 18.149667, 3.259899 ) 118.68169738 WF centre and spread 5 ( 1.380364,-19.229843, 3.310890 ) 23.65190304 WF centre and spread 6 ( 3.277772,-19.207940, 3.315204 ) 26.51263816 WF centre and spread 7 ( 4.133635, 16.502849, 3.311080 ) 23.63015398 WF centre and spread 8 ( 5.552123, 17.912782, 3.335905 ) 136.62924966 WF centre and spread 9 ( 0.952743, 16.462807, 3.278251 ) 72.13425936 WF centre and spread 10 ( 0.459386, 16.148302, 3.320337 ) 56.98045939 WF centre and spread 11 ( 0.520404,-18.524279, 3.311976 ) 27.54869451 WF centre and spread 12 ( 3.794135,-18.047154, 3.285380 ) 118.39984459 WF centre and spread 13 ( 2.423948, 19.356317, 3.311321 ) 110.10202787 WF centre and spread 14 ( 3.881827,-18.752692, 3.315872 ) 29.18618711 WF centre and spread 15 ( 2.113826, 15.971431, 3.306183 ) 37.10506556 WF centre and spread 16 ( 0.870122, 14.658548, 3.309634 ) 34.99574245 WF centre and spread 17 ( 0.438326,-17.038637, 3.306728 ) 65.73607504 WF centre and spread 18 ( 3.817009,-18.142056, 3.307442 ) 81.39047133 Sum of centres and spreads ( 46.895688, 59.402918, 59.521954 ) 1130.99665874 600 0.422E-01 50.1995321281 1130.9965907036 35.82 <-- CONV O_D= 19.5417804 O_OD= 511.6998335 O_TOT= 1130.9965907 <-- SPRD Delta: O_D= 0.5020696E-01 O_OD= -0.8037488E-02 O_TOT= 0.4216947E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 610 WF centre and spread 1 ( 5.549938, 19.383314, 3.318514 ) 113.50621810 WF centre and spread 2 ( 3.678089, 16.988659, 3.321262 ) 24.28675253 WF centre and spread 3 ( 2.404774, 16.846256, 3.308298 ) 30.57993824 WF centre and spread 4 ( 1.655182, 18.135151, 3.260707 ) 118.69679950 WF centre and spread 5 ( 1.379930,-19.229492, 3.310912 ) 23.64775037 WF centre and spread 6 ( 3.277917,-19.208441, 3.315196 ) 26.59535539 WF centre and spread 7 ( 4.133697, 16.502638, 3.311068 ) 23.61797378 WF centre and spread 8 ( 5.547704, 17.870402, 3.335893 ) 136.61511099 WF centre and spread 9 ( 0.957064, 16.459599, 3.278380 ) 72.16196776 WF centre and spread 10 ( 0.459398, 16.150797, 3.320320 ) 56.91623726 WF centre and spread 11 ( 0.519512,-18.524674, 3.311948 ) 27.59790928 WF centre and spread 12 ( 3.805954,-18.082400, 3.285448 ) 118.35915689 WF centre and spread 13 ( 2.425054, 19.354501, 3.311325 ) 110.28257566 WF centre and spread 14 ( 3.882724,-18.751597, 3.315820 ) 29.23967870 WF centre and spread 15 ( 2.113753, 15.973495, 3.306199 ) 37.06624470 WF centre and spread 16 ( 0.869637, 14.656181, 3.309602 ) 34.99103589 WF centre and spread 17 ( 0.437363,-17.037994, 3.306689 ) 65.72618986 WF centre and spread 18 ( 3.817861,-18.142949, 3.307435 ) 81.40243607 Sum of centres and spreads ( 46.915551, 59.343445, 59.535017 ) 1131.28933095 610 -0.827E-01 62.9894396696 1131.2892628745 36.44 <-- CONV O_D= 19.5062809 O_OD= 512.0280052 O_TOT= 1131.2892629 <-- SPRD Delta: O_D= -0.3111008E-01 O_OD= -0.5156570E-01 O_TOT= -0.8267578E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 620 WF centre and spread 1 ( 5.553112, 19.385080, 3.305935 ) 113.47235503 WF centre and spread 2 ( 3.677133, 16.988232, 3.321282 ) 24.22168972 WF centre and spread 3 ( 2.403044, 16.847955, 3.308304 ) 30.50427651 WF centre and spread 4 ( 1.649972, 18.139356, 3.260161 ) 118.57057655 WF centre and spread 5 ( 1.379609,-19.229318, 3.310962 ) 23.56115397 WF centre and spread 6 ( 3.276508,-19.209137, 3.315215 ) 26.50687159 WF centre and spread 7 ( 4.133407, 16.502810, 3.311059 ) 23.56371569 WF centre and spread 8 ( 5.556519, 17.874656, 3.335926 ) 136.52136490 WF centre and spread 9 ( 0.958667, 16.459428, 3.278513 ) 72.06149072 WF centre and spread 10 ( 0.458067, 16.153683, 3.320295 ) 56.75103359 WF centre and spread 11 ( 0.518244,-18.525572, 3.311924 ) 27.49434439 WF centre and spread 12 ( 3.787961,-18.082397, 3.285477 ) 118.31471538 WF centre and spread 13 ( 2.425249, 19.352908, 3.311322 ) 110.34145331 WF centre and spread 14 ( 3.881906,-18.751932, 3.315784 ) 29.10650094 WF centre and spread 15 ( 2.113624, 15.975320, 3.306230 ) 36.96646522 WF centre and spread 16 ( 0.868514, 14.654279, 3.309585 ) 34.93236523 WF centre and spread 17 ( 0.436306,-17.037858, 3.306649 ) 65.69218288 WF centre and spread 18 ( 3.818334,-18.143813, 3.307441 ) 81.38394418 Sum of centres and spreads ( 46.896177, 59.353681, 59.522065 ) 1129.96649978 620 -0.313E-01 29.5547297721 1129.9664317272 37.03 <-- CONV O_D= 19.3557947 O_OD= 510.8556601 O_TOT= 1129.9664317 <-- SPRD Delta: O_D= -0.4072733E-02 O_OD= -0.2719034E-01 O_TOT= -0.3126308E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 630 WF centre and spread 1 ( 5.549255, 19.374178, 3.305857 ) 113.43132137 WF centre and spread 2 ( 3.676583, 16.987994, 3.321291 ) 24.18934679 WF centre and spread 3 ( 2.402107, 16.849038, 3.308305 ) 30.46888909 WF centre and spread 4 ( 1.654248, 18.145748, 3.259763 ) 118.57712036 WF centre and spread 5 ( 1.379569,-19.229163, 3.310988 ) 23.51664972 WF centre and spread 6 ( 3.275661,-19.209561, 3.315220 ) 26.47607013 WF centre and spread 7 ( 4.133436, 16.502676, 3.311058 ) 23.56687659 WF centre and spread 8 ( 5.544248, 17.863350, 3.335927 ) 136.55030585 WF centre and spread 9 ( 0.959923, 16.462383, 3.278586 ) 72.06657151 WF centre and spread 10 ( 0.457728, 16.154659, 3.320277 ) 56.71779018 WF centre and spread 11 ( 0.517838,-18.525516, 3.311910 ) 27.51224135 WF centre and spread 12 ( 3.811535,-18.042636, 3.285511 ) 118.31195619 WF centre and spread 13 ( 2.427820, 19.351894, 3.311319 ) 110.40024968 WF centre and spread 14 ( 3.881898,-18.751885, 3.315759 ) 29.09942297 WF centre and spread 15 ( 2.113333, 15.976193, 3.306245 ) 36.92985224 WF centre and spread 16 ( 0.868056, 14.653109, 3.309577 ) 34.90992169 WF centre and spread 17 ( 0.435682,-17.037648, 3.306627 ) 65.67623902 WF centre and spread 18 ( 3.818609,-18.144304, 3.307444 ) 81.37595598 Sum of centres and spreads ( 46.907530, 59.380511, 59.521663 ) 1129.77678072 630 -0.490E-01 48.8237869051 1129.7767126563 37.63 <-- CONV O_D= 19.4471040 O_OD= 510.5746318 O_TOT= 1129.7767127 <-- SPRD Delta: O_D= 0.5062402E-01 O_OD= -0.9958261E-01 O_TOT= -0.4895858E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 640 WF centre and spread 1 ( 5.535728, 19.384605, 3.306167 ) 115.30973209 WF centre and spread 2 ( 3.680724, 16.988398, 3.321346 ) 25.38769908 WF centre and spread 3 ( 2.399704, 16.849915, 3.308217 ) 30.87730863 WF centre and spread 4 ( 1.556209, 18.091938, 3.261751 ) 121.61298052 WF centre and spread 5 ( 1.377685,-19.228733, 3.310914 ) 24.17920401 WF centre and spread 6 ( 3.278651,-19.207247, 3.315168 ) 28.00309753 WF centre and spread 7 ( 4.131813, 16.501853, 3.311028 ) 23.73090136 WF centre and spread 8 ( 5.496474, 17.884520, 3.336010 ) 137.72573829 WF centre and spread 9 ( 0.963926, 16.448665, 3.278613 ) 73.71165556 WF centre and spread 10 ( 0.458060, 16.156642, 3.320295 ) 56.69473299 WF centre and spread 11 ( 0.520860,-18.523842, 3.311843 ) 28.00514518 WF centre and spread 12 ( 3.776376,-18.091411, 3.285429 ) 119.50978702 WF centre and spread 13 ( 2.431853, 19.351498, 3.311250 ) 110.88512923 WF centre and spread 14 ( 3.889787,-18.747215, 3.315718 ) 30.39185107 WF centre and spread 15 ( 2.114335, 15.978122, 3.306179 ) 37.23731037 WF centre and spread 16 ( 0.866304, 14.651521, 3.309448 ) 35.48061384 WF centre and spread 17 ( 0.433881,-17.036894, 3.306602 ) 65.72289425 WF centre and spread 18 ( 3.819834,-18.144167, 3.307379 ) 81.64859593 Sum of centres and spreads ( 46.732205, 59.308169, 59.523357 ) 1146.11437692 640 -0.964E+00 112.2411286569 1146.1143093170 38.24 <-- CONV O_D= 20.2066665 O_OD= 526.1526659 O_TOT= 1146.1143093 <-- SPRD Delta: O_D= -0.9597148E-02 O_OD= -0.9541192E+00 O_TOT= -0.9637164E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 650 WF centre and spread 1 ( 5.521970, 19.413879, 3.315464 ) 114.15203824 WF centre and spread 2 ( 3.678899, 16.987424, 3.321383 ) 24.55720624 WF centre and spread 3 ( 2.396521, 16.854257, 3.308240 ) 30.51309436 WF centre and spread 4 ( 1.618577, 18.062296, 3.261309 ) 118.76423151 WF centre and spread 5 ( 1.378603,-19.228121, 3.310991 ) 23.63567698 WF centre and spread 6 ( 3.275696,-19.209044, 3.315204 ) 27.00818380 WF centre and spread 7 ( 4.132484, 16.501302, 3.311003 ) 23.58320774 WF centre and spread 8 ( 5.559294, 18.016717, 3.336116 ) 136.82983007 WF centre and spread 9 ( 0.968823, 16.436803, 3.278879 ) 72.58611229 WF centre and spread 10 ( 0.452999, 16.156174, 3.320194 ) 56.63321728 WF centre and spread 11 ( 0.519030,-18.524119, 3.311848 ) 27.94135873 WF centre and spread 12 ( 3.783935,-18.320519, 3.285395 ) 119.03264897 WF centre and spread 13 ( 2.433475, 19.349416, 3.311159 ) 110.97709396 WF centre and spread 14 ( 3.883498,-18.743213, 3.315615 ) 30.03840227 WF centre and spread 15 ( 2.114337, 15.981998, 3.306261 ) 36.92844197 WF centre and spread 16 ( 0.864004, 14.646519, 3.309428 ) 35.03172746 WF centre and spread 17 ( 0.432342,-17.036279, 3.306482 ) 65.66165852 WF centre and spread 18 ( 3.820096,-18.145903, 3.307401 ) 81.43680382 Sum of centres and spreads ( 46.834585, 59.199587, 59.532373 ) 1135.31093420 650 -0.882E+00 122.6198827855 1135.3108663101 38.88 <-- CONV O_D= 20.4385892 O_OD= 515.1173002 O_TOT= 1135.3108663 <-- SPRD Delta: O_D= -0.6117085E+00 O_OD= -0.2704091E+00 O_TOT= -0.8821175E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 660 WF centre and spread 1 ( 5.571876, 19.416317, 3.318329 ) 113.55657799 WF centre and spread 2 ( 3.675878, 16.985921, 3.321427 ) 24.24302929 WF centre and spread 3 ( 2.392016, 16.859252, 3.308248 ) 30.26122504 WF centre and spread 4 ( 1.651666, 18.041206, 3.260552 ) 118.51153293 WF centre and spread 5 ( 1.378488,-19.227542, 3.311113 ) 23.32290776 WF centre and spread 6 ( 3.272984,-19.211266, 3.315241 ) 26.58256352 WF centre and spread 7 ( 4.132186, 16.501260, 3.310985 ) 23.46653890 WF centre and spread 8 ( 5.525643, 17.947845, 3.336111 ) 136.39109921 WF centre and spread 9 ( 0.973308, 16.443087, 3.279169 ) 72.15341153 WF centre and spread 10 ( 0.453387, 16.167182, 3.320162 ) 56.19522147 WF centre and spread 11 ( 0.515450,-18.526053, 3.311777 ) 27.50931069 WF centre and spread 12 ( 3.786590,-18.101401, 3.285564 ) 118.21683726 WF centre and spread 13 ( 2.437750, 19.342050, 3.310979 ) 111.07009810 WF centre and spread 14 ( 3.884408,-18.746212, 3.315527 ) 29.15087175 WF centre and spread 15 ( 2.113296, 15.985941, 3.306408 ) 36.65917970 WF centre and spread 16 ( 0.861403, 14.640748, 3.309349 ) 34.82792057 WF centre and spread 17 ( 0.431268,-17.035488, 3.306370 ) 65.57592515 WF centre and spread 18 ( 3.821953,-18.148304, 3.307420 ) 81.36703219 Sum of centres and spreads ( 46.879550, 59.334543, 59.534731 ) 1129.06128304 660 -0.317E+00 160.0198500727 1129.0612150376 39.47 <-- CONV O_D= 19.4296244 O_OD= 509.8766138 O_TOT= 1129.0612150 <-- SPRD Delta: O_D= -0.4360907E+00 O_OD= 0.1194107E+00 O_TOT= -0.3166800E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 670 WF centre and spread 1 ( 5.558081, 19.453006, 3.311629 ) 113.47891801 WF centre and spread 2 ( 3.673718, 16.984902, 3.321464 ) 24.08649822 WF centre and spread 3 ( 2.387978, 16.863379, 3.308252 ) 30.09983656 WF centre and spread 4 ( 1.661198, 18.053804, 3.259845 ) 118.28140684 WF centre and spread 5 ( 1.378050,-19.227223, 3.311215 ) 23.12815361 WF centre and spread 6 ( 3.270662,-19.212998, 3.315276 ) 26.39340456 WF centre and spread 7 ( 4.131937, 16.501789, 3.310963 ) 23.34393397 WF centre and spread 8 ( 5.538415, 17.932502, 3.336179 ) 136.20946252 WF centre and spread 9 ( 0.977699, 16.441289, 3.279418 ) 71.85971241 WF centre and spread 10 ( 0.451052, 16.180123, 3.320083 ) 55.85545853 WF centre and spread 11 ( 0.512518,-18.528258, 3.311725 ) 27.29968165 WF centre and spread 12 ( 3.776037,-18.120475, 3.285717 ) 118.15599270 WF centre and spread 13 ( 2.440433, 19.335948, 3.310664 ) 111.21548111 WF centre and spread 14 ( 3.882031,-18.746757, 3.315436 ) 28.84874442 WF centre and spread 15 ( 2.112671, 15.990671, 3.306506 ) 36.44918016 WF centre and spread 16 ( 0.859485, 14.636176, 3.309322 ) 34.69589397 WF centre and spread 17 ( 0.428903,-17.035051, 3.306276 ) 65.51333103 WF centre and spread 18 ( 3.823352,-18.150264, 3.307430 ) 81.33848846 Sum of centres and spreads ( 46.864221, 59.352564, 59.527400 ) 1126.25357874 670 0.710E-02 39.4967245469 1126.2535107786 40.07 <-- CONV O_D= 19.0880478 O_OD= 507.4104861 O_TOT= 1126.2535108 <-- SPRD Delta: O_D= 0.3245199E-01 O_OD= -0.2534707E-01 O_TOT= 0.7104916E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 680 WF centre and spread 1 ( 5.557073, 19.458417, 3.306618 ) 113.48709576 WF centre and spread 2 ( 3.673342, 16.984863, 3.321472 ) 24.05676462 WF centre and spread 3 ( 2.386678, 16.864946, 3.308255 ) 30.05025524 WF centre and spread 4 ( 1.665463, 18.073407, 3.259573 ) 118.19662498 WF centre and spread 5 ( 1.377915,-19.227059, 3.311248 ) 23.07191245 WF centre and spread 6 ( 3.269910,-19.213535, 3.315285 ) 26.35127560 WF centre and spread 7 ( 4.131900, 16.501806, 3.310953 ) 23.33178632 WF centre and spread 8 ( 5.558710, 17.893781, 3.336191 ) 136.20758464 WF centre and spread 9 ( 0.978389, 16.409701, 3.279501 ) 71.88294798 WF centre and spread 10 ( 0.450557, 16.185048, 3.320045 ) 55.79448628 WF centre and spread 11 ( 0.511688,-18.528867, 3.311709 ) 27.27999833 WF centre and spread 12 ( 3.784124,-18.157526, 3.285780 ) 118.02646601 WF centre and spread 13 ( 2.440827, 19.334149, 3.310516 ) 111.29256781 WF centre and spread 14 ( 3.881591,-18.746621, 3.315404 ) 28.81727828 WF centre and spread 15 ( 2.112358, 15.992023, 3.306528 ) 36.39529391 WF centre and spread 16 ( 0.858997, 14.634623, 3.309314 ) 34.66030375 WF centre and spread 17 ( 0.427746,-17.034614, 3.306247 ) 65.50052444 WF centre and spread 18 ( 3.823726,-18.150699, 3.307437 ) 81.33406112 Sum of centres and spreads ( 46.890992, 59.273845, 59.522077 ) 1125.73722752 680 -0.164E-01 44.4408797486 1125.7371594452 41.39 <-- CONV O_D= 19.0074130 O_OD= 506.9747696 O_TOT= 1125.7371594 <-- SPRD Delta: O_D= 0.1375000E-01 O_OD= -0.3018123E-01 O_TOT= -0.1643123E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 690 WF centre and spread 1 ( 5.560270, 19.473329, 3.305073 ) 113.82085247 WF centre and spread 2 ( 3.672577, 16.984502, 3.321485 ) 23.99676162 WF centre and spread 3 ( 2.384784, 16.866600, 3.308256 ) 30.00648943 WF centre and spread 4 ( 1.673455, 18.094241, 3.259047 ) 118.19971888 WF centre and spread 5 ( 1.377934,-19.226823, 3.311289 ) 22.99483140 WF centre and spread 6 ( 3.268090,-19.214331, 3.315299 ) 26.29486835 WF centre and spread 7 ( 4.131776, 16.502293, 3.310947 ) 23.23132621 WF centre and spread 8 ( 5.555203, 17.961250, 3.336172 ) 136.14066112 WF centre and spread 9 ( 0.982185, 16.435405, 3.279633 ) 71.64500890 WF centre and spread 10 ( 0.448651, 16.192742, 3.320001 ) 55.72699007 WF centre and spread 11 ( 0.511001,-18.528631, 3.311701 ) 27.47703899 WF centre and spread 12 ( 3.725445,-18.335541, 3.285774 ) 119.51803781 WF centre and spread 13 ( 2.441071, 19.332748, 3.310260 ) 111.41945572 WF centre and spread 14 ( 3.874837,-18.743799, 3.315335 ) 29.22251917 WF centre and spread 15 ( 2.112510, 15.995544, 3.306543 ) 36.39285516 WF centre and spread 16 ( 0.858557, 14.633043, 3.309323 ) 34.65822701 WF centre and spread 17 ( 0.426620,-17.034387, 3.306214 ) 65.48697657 WF centre and spread 18 ( 3.824266,-18.151560, 3.307439 ) 81.32090214 Sum of centres and spreads ( 46.829234, 59.236629, 59.519789 ) 1127.55352102 690 -0.193E+00 55.7376422863 1127.5534531488 42.44 <-- CONV O_D= 20.2759720 O_OD= 507.5225043 O_TOT= 1127.5534531 <-- SPRD Delta: O_D= -0.9860924E-01 O_OD= -0.9462324E-01 O_TOT= -0.1932325E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 700 WF centre and spread 1 ( 5.563684, 19.481926, 3.315521 ) 113.76792786 WF centre and spread 2 ( 3.671354, 16.983545, 3.321506 ) 23.93757739 WF centre and spread 3 ( 2.381558, 16.869504, 3.308244 ) 29.92338062 WF centre and spread 4 ( 1.667067, 18.246098, 3.259539 ) 118.99886488 WF centre and spread 5 ( 1.377701,-19.226575, 3.311338 ) 22.95572040 WF centre and spread 6 ( 3.268738,-19.216001, 3.315329 ) 26.31598953 WF centre and spread 7 ( 4.132013, 16.501793, 3.310937 ) 23.24986040 WF centre and spread 8 ( 5.531135, 17.928792, 3.336196 ) 136.11842108 WF centre and spread 9 ( 0.985812, 16.429040, 3.279794 ) 71.75075565 WF centre and spread 10 ( 0.447481, 16.212728, 3.319903 ) 55.58107283 WF centre and spread 11 ( 0.510027,-18.530274, 3.311668 ) 27.35754599 WF centre and spread 12 ( 3.791207,-18.335923, 3.286026 ) 118.20297090 WF centre and spread 13 ( 2.446829, 19.325697, 3.309694 ) 111.62650459 WF centre and spread 14 ( 3.878744,-18.745072, 3.315275 ) 28.89730735 WF centre and spread 15 ( 2.111923, 15.997365, 3.306604 ) 36.26378514 WF centre and spread 16 ( 0.856551, 14.628965, 3.309261 ) 34.57897136 WF centre and spread 17 ( 0.425147,-17.034239, 3.306140 ) 65.47765779 WF centre and spread 18 ( 3.825287,-18.153003, 3.307434 ) 81.32752313 Sum of centres and spreads ( 46.872259, 59.364367, 59.530410 ) 1126.33183688 700 -0.263E+00 43.8357629243 1126.3317688857 43.42 <-- CONV O_D= 20.0072538 O_OD= 506.5695382 O_TOT= 1126.3317689 <-- SPRD Delta: O_D= -0.1000564E+00 O_OD= -0.1633884E+00 O_TOT= -0.2634449E+00 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 710 WF centre and spread 1 ( 5.565705, 19.520859, 3.307595 ) 113.59121053 WF centre and spread 2 ( 3.670415, 16.982756, 3.321537 ) 23.91843425 WF centre and spread 3 ( 2.378671, 16.872369, 3.308240 ) 29.82144885 WF centre and spread 4 ( 1.679473, 18.157438, 3.259345 ) 118.02311437 WF centre and spread 5 ( 1.376817,-19.226208, 3.311408 ) 22.84244495 WF centre and spread 6 ( 3.266109,-19.216748, 3.315313 ) 26.24558914 WF centre and spread 7 ( 4.131674, 16.501901, 3.310929 ) 23.16557536 WF centre and spread 8 ( 5.552051, 17.917546, 3.336188 ) 136.11140015 WF centre and spread 9 ( 0.990747, 16.416562, 3.279987 ) 71.53194111 WF centre and spread 10 ( 0.445466, 16.258235, 3.319838 ) 55.39251558 WF centre and spread 11 ( 0.508275,-18.531043, 3.311602 ) 27.21004226 WF centre and spread 12 ( 3.777047,-18.203290, 3.286139 ) 117.81046570 WF centre and spread 13 ( 2.447740, 19.319960, 3.308894 ) 111.60061280 WF centre and spread 14 ( 3.879946,-18.745856, 3.315211 ) 28.57680712 WF centre and spread 15 ( 2.111683, 15.999942, 3.306655 ) 36.12521640 WF centre and spread 16 ( 0.854313, 14.625040, 3.309189 ) 34.49509001 WF centre and spread 17 ( 0.423662,-17.033993, 3.306106 ) 65.43029634 WF centre and spread 18 ( 3.826387,-18.154303, 3.307437 ) 81.30797232 Sum of centres and spreads ( 46.886183, 59.461168, 59.521613 ) 1123.20017725 710 -0.232E+00 52.6225169405 1123.2001091904 44.57 <-- CONV O_D= 18.5633384 O_OD= 504.8817939 O_TOT= 1123.2001092 <-- SPRD Delta: O_D= -0.1436149E+00 O_OD= -0.8824103E-01 O_TOT= -0.2318559E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 720 WF centre and spread 1 ( 5.567775, 19.512971, 3.305616 ) 113.46200914 WF centre and spread 2 ( 3.669341, 16.982207, 3.321560 ) 23.85356055 WF centre and spread 3 ( 2.376604, 16.874466, 3.308245 ) 29.74295870 WF centre and spread 4 ( 1.686699, 18.125112, 3.258488 ) 117.94237467 WF centre and spread 5 ( 1.376382,-19.226022, 3.311468 ) 22.72522003 WF centre and spread 6 ( 3.264217,-19.217500, 3.315322 ) 26.14508025 WF centre and spread 7 ( 4.131677, 16.502157, 3.310916 ) 23.12829181 WF centre and spread 8 ( 5.562345, 17.904897, 3.336209 ) 136.02032459 WF centre and spread 9 ( 0.992470, 16.427310, 3.280144 ) 71.41964548 WF centre and spread 10 ( 0.446255, 16.226558, 3.319829 ) 55.18744045 WF centre and spread 11 ( 0.506738,-18.531973, 3.311566 ) 27.10335939 WF centre and spread 12 ( 3.757554,-18.203817, 3.286175 ) 117.95759525 WF centre and spread 13 ( 2.448389, 19.316066, 3.308093 ) 111.67315848 WF centre and spread 14 ( 3.879067,-18.745942, 3.315162 ) 28.46330181 WF centre and spread 15 ( 2.111407, 16.002616, 3.306688 ) 36.04650628 WF centre and spread 16 ( 0.853749, 14.622839, 3.309173 ) 34.45049774 WF centre and spread 17 ( 0.422504,-17.033427, 3.306077 ) 65.39925675 WF centre and spread 18 ( 3.827114,-18.155298, 3.307443 ) 81.28977331 Sum of centres and spreads ( 46.880285, 59.383221, 59.518174 ) 1122.01035469 720 -0.170E+00 47.3613113509 1122.0102866390 45.42 <-- CONV O_D= 18.5778779 O_OD= 503.6774319 O_TOT= 1122.0102866 <-- SPRD Delta: O_D= 0.1790119E-01 O_OD= -0.1880955E+00 O_TOT= -0.1701943E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 730 WF centre and spread 1 ( 5.565030, 19.519743, 3.304949 ) 113.52357721 WF centre and spread 2 ( 3.669171, 16.981838, 3.321574 ) 23.87663667 WF centre and spread 3 ( 2.375428, 16.875434, 3.308240 ) 29.73093627 WF centre and spread 4 ( 1.674564, 18.077459, 3.259094 ) 117.95654122 WF centre and spread 5 ( 1.376004,-19.225951, 3.311491 ) 22.72945646 WF centre and spread 6 ( 3.263620,-19.217762, 3.315322 ) 26.21454435 WF centre and spread 7 ( 4.131579, 16.501965, 3.310910 ) 23.13070472 WF centre and spread 8 ( 5.557229, 17.880889, 3.336215 ) 136.06408642 WF centre and spread 9 ( 0.995372, 16.479585, 3.280238 ) 71.68390561 WF centre and spread 10 ( 0.445102, 16.239476, 3.319798 ) 55.21513281 WF centre and spread 11 ( 0.506098,-18.531929, 3.311555 ) 27.21322579 WF centre and spread 12 ( 3.761774,-18.290583, 3.286204 ) 117.78871883 WF centre and spread 13 ( 2.448025, 19.313776, 3.307553 ) 111.74394367 WF centre and spread 14 ( 3.878792,-18.744969, 3.315131 ) 28.59982748 WF centre and spread 15 ( 2.111249, 16.003618, 3.306697 ) 36.02030286 WF centre and spread 16 ( 0.853152, 14.621340, 3.309151 ) 34.43662654 WF centre and spread 17 ( 0.421698,-17.033397, 3.306054 ) 65.38641173 WF centre and spread 18 ( 3.827596,-18.155796, 3.307439 ) 81.29311340 Sum of centres and spreads ( 46.861483, 59.294737, 59.517613 ) 1122.60769205 730 0.303E+00 143.2099872936 1122.6076240388 46.05 <-- CONV O_D= 18.8479671 O_OD= 504.0046801 O_TOT= 1122.6076240 <-- SPRD Delta: O_D= 0.7956954E-01 O_OD= 0.2231127E+00 O_TOT= 0.3026822E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 740 WF centre and spread 1 ( 5.565539, 19.542676, 3.304601 ) 113.52051690 WF centre and spread 2 ( 3.668835, 16.981863, 3.321580 ) 23.84421596 WF centre and spread 3 ( 2.373940, 16.877120, 3.308242 ) 29.66807013 WF centre and spread 4 ( 1.686163, 18.098490, 3.258782 ) 117.86383326 WF centre and spread 5 ( 1.375903,-19.225713, 3.311522 ) 22.66531043 WF centre and spread 6 ( 3.262889,-19.218346, 3.315327 ) 26.15468491 WF centre and spread 7 ( 4.131435, 16.502191, 3.310899 ) 23.06941186 WF centre and spread 8 ( 5.556119, 17.900837, 3.336240 ) 135.98149624 WF centre and spread 9 ( 0.995737, 16.401865, 3.280319 ) 71.37714646 WF centre and spread 10 ( 0.444584, 16.265403, 3.319761 ) 55.19215349 WF centre and spread 11 ( 0.505397,-18.532663, 3.311533 ) 27.11882863 WF centre and spread 12 ( 3.775253,-18.202115, 3.286257 ) 117.70096276 WF centre and spread 13 ( 2.451135, 19.311152, 3.306700 ) 111.78484976 WF centre and spread 14 ( 3.878991,-18.745232, 3.315097 ) 28.44218126 WF centre and spread 15 ( 2.111077, 16.005128, 3.306730 ) 35.96224076 WF centre and spread 16 ( 0.852079, 14.619437, 3.309133 ) 34.39941058 WF centre and spread 17 ( 0.420918,-17.032990, 3.306027 ) 65.37261970 WF centre and spread 18 ( 3.828081,-18.156203, 3.307449 ) 81.28951637 Sum of centres and spreads ( 46.884076, 59.392899, 59.516199 ) 1121.40744946 740 -0.658E-01 31.5459119088 1121.4073814001 46.66 <-- CONV O_D= 18.4411680 O_OD= 503.2112365 O_TOT= 1121.4073814 <-- SPRD Delta: O_D= 0.7549321E-03 O_OD= -0.6655057E-01 O_TOT= -0.6579564E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 750 WF centre and spread 1 ( 5.544764, 19.548128, 3.313869 ) 113.49867409 WF centre and spread 2 ( 3.668362, 16.981678, 3.321585 ) 23.82279969 WF centre and spread 3 ( 2.373042, 16.877664, 3.308237 ) 29.65828646 WF centre and spread 4 ( 1.690029, 18.106137, 3.258518 ) 117.90776219 WF centre and spread 5 ( 1.375908,-19.225517, 3.311535 ) 22.62457429 WF centre and spread 6 ( 3.262438,-19.218656, 3.315332 ) 26.11829564 WF centre and spread 7 ( 4.132170, 16.501980, 3.310900 ) 23.12138401 WF centre and spread 8 ( 5.553460, 17.946344, 3.336263 ) 136.12562708 WF centre and spread 9 ( 0.994493, 16.412814, 3.280364 ) 71.43959661 WF centre and spread 10 ( 0.448581, 16.199160, 3.319835 ) 55.04737546 WF centre and spread 11 ( 0.505194,-18.532389, 3.311526 ) 27.11652551 WF centre and spread 12 ( 3.765973,-18.203794, 3.286191 ) 117.75832561 WF centre and spread 13 ( 2.451753, 19.309994, 3.306285 ) 111.93494931 WF centre and spread 14 ( 3.878944,-18.744779, 3.315079 ) 28.50054530 WF centre and spread 15 ( 2.111263, 16.006380, 3.306728 ) 35.95823764 WF centre and spread 16 ( 0.852939, 14.619091, 3.309144 ) 34.40670402 WF centre and spread 17 ( 0.420764,-17.032157, 3.306015 ) 65.38232776 WF centre and spread 18 ( 3.828344,-18.156504, 3.307450 ) 81.28605839 Sum of centres and spreads ( 46.858422, 59.395574, 59.524855 ) 1121.70804903 750 -0.451E-01 57.1822284267 1121.7079810968 47.26 <-- CONV O_D= 18.6656717 O_OD= 503.2873325 O_TOT= 1121.7079811 <-- SPRD Delta: O_D= -0.4261215E-02 O_OD= -0.4083521E-01 O_TOT= -0.4509643E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 760 WF centre and spread 1 ( 5.572876, 19.536267, 3.307564 ) 113.43952434 WF centre and spread 2 ( 3.667879, 16.981414, 3.321594 ) 23.79443146 WF centre and spread 3 ( 2.372175, 16.878520, 3.308238 ) 29.62225912 WF centre and spread 4 ( 1.694129, 18.107232, 3.258064 ) 117.88983796 WF centre and spread 5 ( 1.375723,-19.225456, 3.311558 ) 22.58303161 WF centre and spread 6 ( 3.261762,-19.219074, 3.315338 ) 26.07246708 WF centre and spread 7 ( 4.131983, 16.502113, 3.310895 ) 23.07021018 WF centre and spread 8 ( 5.552630, 17.936969, 3.336245 ) 136.00872698 WF centre and spread 9 ( 0.995534, 16.420855, 3.280433 ) 71.36913959 WF centre and spread 10 ( 0.446346, 16.195435, 3.319839 ) 55.03097123 WF centre and spread 11 ( 0.504599,-18.532802, 3.311513 ) 27.05635984 WF centre and spread 12 ( 3.764208,-18.203110, 3.286205 ) 117.79967533 WF centre and spread 13 ( 2.451922, 19.308128, 3.305679 ) 111.92778121 WF centre and spread 14 ( 3.878493,-18.745030, 3.315062 ) 28.40515449 WF centre and spread 15 ( 2.111279, 16.007512, 3.306747 ) 35.91222654 WF centre and spread 16 ( 0.852429, 14.618102, 3.309127 ) 34.38013647 WF centre and spread 17 ( 0.420297,-17.032030, 3.306002 ) 65.36894644 WF centre and spread 18 ( 3.828647,-18.156953, 3.307452 ) 81.27916458 Sum of centres and spreads ( 46.882910, 59.378092, 59.517555 ) 1121.01004444 760 -0.292E-01 36.8737775348 1121.0099763909 47.86 <-- CONV O_D= 18.6032043 O_OD= 502.6517952 O_TOT= 1121.0099764 <-- SPRD Delta: O_D= -0.3242811E-02 O_OD= -0.2594998E-01 O_TOT= -0.2919279E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 770 WF centre and spread 1 ( 5.682303, 19.432333, 3.318186 ) 116.62223706 WF centre and spread 2 ( 3.665788, 16.979494, 3.321648 ) 23.75212690 WF centre and spread 3 ( 2.364620, 16.881565, 3.308219 ) 30.44156949 WF centre and spread 4 ( 1.735098, 18.227602, 3.257395 ) 120.19406259 WF centre and spread 5 ( 1.374292,-19.224103, 3.311769 ) 23.79918940 WF centre and spread 6 ( 3.260253,-19.222911, 3.315426 ) 26.73227575 WF centre and spread 7 ( 4.131617, 16.502405, 3.310821 ) 22.94486191 WF centre and spread 8 ( 5.588156, 17.369733, 3.335895 ) 146.72711775 WF centre and spread 9 ( 1.004580, 16.518143, 3.281202 ) 74.08257388 WF centre and spread 10 ( 0.437085, 16.222710, 3.319920 ) 56.01783340 WF centre and spread 11 ( 0.500852,-18.533767, 3.311428 ) 27.01141665 WF centre and spread 12 ( 3.867493,-18.826354, 3.285952 ) 140.62233427 WF centre and spread 13 ( 2.452828, 19.293138, 3.297414 ) 112.14955648 WF centre and spread 14 ( 3.876471,-18.746234, 3.314973 ) 28.30041807 WF centre and spread 15 ( 2.112078, 16.015101, 3.306868 ) 36.20089171 WF centre and spread 16 ( 0.850583, 14.610479, 3.309043 ) 34.59416611 WF centre and spread 17 ( 0.417160,-17.030128, 3.305922 ) 65.94416985 WF centre and spread 18 ( 3.829888,-18.161478, 3.307579 ) 81.74278650 Sum of centres and spreads ( 47.151143, 58.307729, 59.519661 ) 1167.87958777 770 -0.487E+01 319.4490955339 1167.8795187179 48.62 <-- CONV O_D= 39.4313342 O_OD= 528.6932077 O_TOT= 1167.8795187 <-- SPRD Delta: O_D= -0.4002537E+01 O_OD= -0.8678763E+00 O_TOT= -0.4870413E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 780 WF centre and spread 1 ( 5.622245, 19.679040, 3.215011 ) 114.78522112 WF centre and spread 2 ( 3.664395, 16.978848, 3.321693 ) 23.77561183 WF centre and spread 3 ( 2.360412, 16.886102, 3.308200 ) 29.35939692 WF centre and spread 4 ( 1.713098, 17.967129, 3.260781 ) 118.56129125 WF centre and spread 5 ( 1.374269,-19.223186, 3.311846 ) 22.48289893 WF centre and spread 6 ( 3.255375,-19.224301, 3.315481 ) 26.08399450 WF centre and spread 7 ( 4.133377, 16.500884, 3.310731 ) 22.80898566 WF centre and spread 8 ( 5.532341, 17.838847, 3.335655 ) 135.88551349 WF centre and spread 9 ( 1.016214, 16.447458, 3.281235 ) 71.25859607 WF centre and spread 10 ( 0.441111, 16.106304, 3.320160 ) 56.07626170 WF centre and spread 11 ( 0.497622,-18.531907, 3.311468 ) 27.33672218 WF centre and spread 12 ( 3.739269,-18.244803, 3.285658 ) 119.79419772 WF centre and spread 13 ( 2.484821, 19.289727, 3.299192 ) 112.45785562 WF centre and spread 14 ( 3.876456,-18.741955, 3.314815 ) 28.47635112 WF centre and spread 15 ( 2.112158, 16.019672, 3.307309 ) 35.61615574 WF centre and spread 16 ( 0.843903, 14.602911, 3.309042 ) 34.21027360 WF centre and spread 17 ( 0.415657,-17.027684, 3.305717 ) 65.33742282 WF centre and spread 18 ( 3.830250,-18.163548, 3.307592 ) 81.26843378 Sum of centres and spreads ( 46.912973, 59.159538, 59.421585 ) 1125.57518405 780 -0.372E+01 198.9940628673 1125.5751158940 48.77 <-- CONV O_D= 23.0503795 O_OD= 502.7697596 O_TOT= 1125.5751159 <-- SPRD Delta: O_D= -0.3733747E+01 O_OD= 0.1110672E-01 O_TOT= -0.3722640E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 790 WF centre and spread 1 ( 5.566941, 19.636763, 3.315069 ) 113.45218211 WF centre and spread 2 ( 3.662335, 16.977634, 3.321734 ) 23.69408960 WF centre and spread 3 ( 2.355516, 16.890966, 3.308187 ) 29.18251751 WF centre and spread 4 ( 1.721254, 18.097577, 3.258596 ) 117.61038220 WF centre and spread 5 ( 1.373565,-19.222672, 3.311943 ) 22.30266217 WF centre and spread 6 ( 3.253611,-19.225820, 3.315504 ) 25.98717066 WF centre and spread 7 ( 4.132845, 16.500116, 3.310703 ) 22.88242788 WF centre and spread 8 ( 5.550331, 17.845506, 3.335918 ) 135.67136727 WF centre and spread 9 ( 1.019307, 16.407167, 3.281497 ) 71.15161507 WF centre and spread 10 ( 0.439166, 16.181338, 3.320093 ) 54.53470048 WF centre and spread 11 ( 0.493989,-18.534310, 3.311404 ) 27.05163753 WF centre and spread 12 ( 3.766666,-18.114008, 3.285863 ) 117.97324321 WF centre and spread 13 ( 2.456268, 19.279304, 3.298944 ) 112.63625000 WF centre and spread 14 ( 3.878273,-18.742118, 3.314703 ) 28.10066347 WF centre and spread 15 ( 2.110940, 16.023984, 3.307355 ) 35.49441123 WF centre and spread 16 ( 0.842983, 14.597059, 3.308993 ) 34.15535239 WF centre and spread 17 ( 0.413182,-17.026847, 3.305633 ) 65.25893046 WF centre and spread 18 ( 3.832600,-18.165507, 3.307588 ) 81.25008533 Sum of centres and spreads ( 46.869771, 59.406131, 59.519725 ) 1118.38968858 790 -0.140E+00 33.6631099011 1118.3896205686 49.95 <-- CONV O_D= 18.6415541 O_OD= 499.9930896 O_TOT= 1118.3896206 <-- SPRD Delta: O_D= -0.2702515E-02 O_OD= -0.1374039E+00 O_TOT= -0.1401064E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 800 WF centre and spread 1 ( 5.607543, 19.635355, 3.304446 ) 113.46205799 WF centre and spread 2 ( 3.661293, 16.977022, 3.321758 ) 23.63316228 WF centre and spread 3 ( 2.353302, 16.892902, 3.308191 ) 29.09673434 WF centre and spread 4 ( 1.717742, 18.074117, 3.257403 ) 117.51806534 WF centre and spread 5 ( 1.373164,-19.222481, 3.311999 ) 22.20681246 WF centre and spread 6 ( 3.251982,-19.226460, 3.315520 ) 25.89848906 WF centre and spread 7 ( 4.132485, 16.500416, 3.310694 ) 22.80538911 WF centre and spread 8 ( 5.568528, 17.852359, 3.335974 ) 135.54519741 WF centre and spread 9 ( 1.021918, 16.397926, 3.281679 ) 71.00453837 WF centre and spread 10 ( 0.437501, 16.178804, 3.320045 ) 54.47819583 WF centre and spread 11 ( 0.492541,-18.535375, 3.311369 ) 26.95229277 WF centre and spread 12 ( 3.725801,-18.121516, 3.285917 ) 117.87884154 WF centre and spread 13 ( 2.463440, 19.276373, 3.298961 ) 112.60785337 WF centre and spread 14 ( 3.877293,-18.742497, 3.314666 ) 27.95346480 WF centre and spread 15 ( 2.110712, 16.026330, 3.307379 ) 35.39607596 WF centre and spread 16 ( 0.841555, 14.594628, 3.308945 ) 34.08899794 WF centre and spread 17 ( 0.412007,-17.026729, 3.305597 ) 65.22008308 WF centre and spread 18 ( 3.833368,-18.166443, 3.307593 ) 81.22961650 Sum of centres and spreads ( 46.882175, 59.364731, 59.508136 ) 1116.97586814 800 -0.524E-01 50.9102296563 1116.9757999949 51.04 <-- CONV O_D= 18.6286128 O_OD= 498.5922104 O_TOT= 1116.9758000 <-- SPRD Delta: O_D= 0.5724163E-02 O_OD= -0.5809047E-01 O_TOT= -0.5236631E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 810 WF centre and spread 1 ( 5.578898, 19.646263, 3.316353 ) 113.73375311 WF centre and spread 2 ( 3.659051, 16.975359, 3.321805 ) 23.50870606 WF centre and spread 3 ( 2.346334, 16.898547, 3.308169 ) 28.93113073 WF centre and spread 4 ( 1.739178, 18.240898, 3.257533 ) 119.10967157 WF centre and spread 5 ( 1.372648,-19.221886, 3.312098 ) 22.00076648 WF centre and spread 6 ( 3.250426,-19.228729, 3.315550 ) 25.73742512 WF centre and spread 7 ( 4.132636, 16.501350, 3.310666 ) 22.58195320 WF centre and spread 8 ( 5.529554, 17.622537, 3.336066 ) 141.44011151 WF centre and spread 9 ( 1.030383, 16.382685, 3.282006 ) 70.59280354 WF centre and spread 10 ( 0.439429, 16.234831, 3.319942 ) 54.10232432 WF centre and spread 11 ( 0.489238,-18.538286, 3.311256 ) 26.66769118 WF centre and spread 12 ( 3.814866,-18.454149, 3.286211 ) 123.35302136 WF centre and spread 13 ( 2.461034, 19.268427, 3.298937 ) 112.73136487 WF centre and spread 14 ( 3.874077,-18.742770, 3.314528 ) 27.50747792 WF centre and spread 15 ( 2.110359, 16.034420, 3.307469 ) 35.29840182 WF centre and spread 16 ( 0.839493, 14.587473, 3.308893 ) 34.04250349 WF centre and spread 17 ( 0.409209,-17.026171, 3.305501 ) 65.21436705 WF centre and spread 18 ( 3.835826,-18.169055, 3.307587 ) 81.23006790 Sum of centres and spreads ( 46.912638, 59.011742, 59.520572 ) 1127.78354121 810 -0.300E+01 155.8860185089 1127.7834730887 52.06 <-- CONV O_D= 30.6347362 O_OD= 497.3937600 O_TOT= 1127.7834731 <-- SPRD Delta: O_D= -0.3351329E+01 O_OD= 0.3536089E+00 O_TOT= -0.2997720E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 820 WF centre and spread 1 ( 5.531927, 19.687791, 3.303041 ) 114.04810895 WF centre and spread 2 ( 3.658596, 16.974753, 3.321828 ) 23.53368169 WF centre and spread 3 ( 2.344175, 16.900352, 3.308158 ) 28.91619896 WF centre and spread 4 ( 1.722352, 18.154231, 3.258169 ) 117.67397921 WF centre and spread 5 ( 1.372146,-19.221455, 3.312131 ) 21.96955633 WF centre and spread 6 ( 3.248903,-19.228755, 3.315547 ) 25.79773599 WF centre and spread 7 ( 4.132759, 16.500947, 3.310653 ) 22.61875931 WF centre and spread 8 ( 5.559992, 17.912465, 3.336015 ) 135.48432235 WF centre and spread 9 ( 1.034005, 16.386732, 3.282122 ) 70.72977720 WF centre and spread 10 ( 0.435173, 16.213891, 3.319927 ) 53.99047863 WF centre and spread 11 ( 0.489343,-18.537435, 3.311232 ) 26.87491551 WF centre and spread 12 ( 3.696223,-18.399470, 3.286237 ) 120.22945810 WF centre and spread 13 ( 2.462038, 19.267294, 3.299069 ) 112.84233942 WF centre and spread 14 ( 3.873235,-18.740384, 3.314471 ) 27.87449737 WF centre and spread 15 ( 2.110102, 16.037124, 3.307504 ) 35.20024701 WF centre and spread 16 ( 0.837510, 14.585161, 3.308886 ) 33.98727458 WF centre and spread 17 ( 0.407217,-17.025298, 3.305487 ) 65.18141527 WF centre and spread 18 ( 3.836517,-18.169866, 3.307582 ) 81.22309238 Sum of centres and spreads ( 46.752214, 59.298079, 59.508057 ) 1118.17583826 820 -0.458E+00 56.6159770838 1118.1757706044 52.66 <-- CONV O_D= 21.0383236 O_OD= 497.3824701 O_TOT= 1118.1757706 <-- SPRD Delta: O_D= -0.2952134E+00 O_OD= -0.1627142E+00 O_TOT= -0.4579276E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 830 WF centre and spread 1 ( 5.588008, 19.684371, 3.307019 ) 113.50979245 WF centre and spread 2 ( 3.656017, 16.973036, 3.321870 ) 23.44819684 WF centre and spread 3 ( 2.339560, 16.904721, 3.308160 ) 28.74182151 WF centre and spread 4 ( 1.741283, 18.032600, 3.257426 ) 117.58316928 WF centre and spread 5 ( 1.371194,-19.221181, 3.312241 ) 21.79787637 WF centre and spread 6 ( 3.245425,-19.230025, 3.315543 ) 25.71558538 WF centre and spread 7 ( 4.132367, 16.500592, 3.310643 ) 22.60204499 WF centre and spread 8 ( 5.529159, 17.871278, 3.336193 ) 135.32968415 WF centre and spread 9 ( 1.040675, 16.399098, 3.282472 ) 70.71809804 WF centre and spread 10 ( 0.433092, 16.204358, 3.319779 ) 54.02525609 WF centre and spread 11 ( 0.486655,-18.539139, 3.311147 ) 26.80647959 WF centre and spread 12 ( 3.732100,-18.176857, 3.286501 ) 117.53514815 WF centre and spread 13 ( 2.465969, 19.260595, 3.299396 ) 112.80741096 WF centre and spread 14 ( 3.876200,-18.741274, 3.314386 ) 27.61265526 WF centre and spread 15 ( 2.109042, 16.041066, 3.307548 ) 35.06213618 WF centre and spread 16 ( 0.834476, 14.579124, 3.308761 ) 33.88822451 WF centre and spread 17 ( 0.405159,-17.025079, 3.305421 ) 65.08065035 WF centre and spread 18 ( 3.838218,-18.171962, 3.307586 ) 81.18980472 Sum of centres and spreads ( 46.824598, 59.345321, 59.512091 ) 1113.45403479 830 -0.345E+00 83.3010120991 1113.4539668977 53.28 <-- CONV O_D= 18.6885875 O_OD= 495.0104025 O_TOT= 1113.4539669 <-- SPRD Delta: O_D= 0.1934661E-01 O_OD= -0.3645437E+00 O_TOT= -0.3451971E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 840 WF centre and spread 1 ( 5.591525, 19.715988, 3.302530 ) 113.52314076 WF centre and spread 2 ( 3.655324, 16.972614, 3.321886 ) 23.42334752 WF centre and spread 3 ( 2.337712, 16.906162, 3.308159 ) 28.68965752 WF centre and spread 4 ( 1.736757, 18.055371, 3.256633 ) 117.27292641 WF centre and spread 5 ( 1.370944,-19.221115, 3.312277 ) 21.74180909 WF centre and spread 6 ( 3.244521,-19.230517, 3.315552 ) 25.66745019 WF centre and spread 7 ( 4.132038, 16.500853, 3.310632 ) 22.54834849 WF centre and spread 8 ( 5.555647, 17.879702, 3.336262 ) 135.22003300 WF centre and spread 9 ( 1.042114, 16.377088, 3.282577 ) 70.55162201 WF centre and spread 10 ( 0.431885, 16.242786, 3.319739 ) 53.78773232 WF centre and spread 11 ( 0.485446,-18.539996, 3.311113 ) 26.71644265 WF centre and spread 12 ( 3.728020,-18.207296, 3.286562 ) 117.45997837 WF centre and spread 13 ( 2.466523, 19.259665, 3.299467 ) 112.82091279 WF centre and spread 14 ( 3.874804,-18.741146, 3.314350 ) 27.51636988 WF centre and spread 15 ( 2.108958, 16.043323, 3.307558 ) 35.00725187 WF centre and spread 16 ( 0.834065, 14.577190, 3.308739 ) 33.86168989 WF centre and spread 17 ( 0.404049,-17.024908, 3.305401 ) 65.05910620 WF centre and spread 18 ( 3.838872,-18.172591, 3.307589 ) 81.18542356 Sum of centres and spreads ( 46.839204, 59.393173, 59.507025 ) 1112.05324254 840 -0.289E-01 39.2825904236 1112.0531745352 53.89 <-- CONV O_D= 18.0519091 O_OD= 494.2462885 O_TOT= 1112.0531745 <-- SPRD Delta: O_D= -0.7818934E-02 O_OD= -0.2106726E-01 O_TOT= -0.2888619E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 850 WF centre and spread 1 ( 5.591830, 19.717322, 3.302223 ) 113.52006289 WF centre and spread 2 ( 3.655148, 16.972524, 3.321888 ) 23.41376643 WF centre and spread 3 ( 2.337409, 16.906404, 3.308160 ) 28.67808524 WF centre and spread 4 ( 1.738509, 18.063638, 3.256451 ) 117.26346856 WF centre and spread 5 ( 1.370905,-19.221110, 3.312283 ) 21.72868555 WF centre and spread 6 ( 3.244296,-19.230623, 3.315553 ) 25.65313810 WF centre and spread 7 ( 4.131985, 16.500928, 3.310631 ) 22.53082927 WF centre and spread 8 ( 5.561697, 17.881063, 3.336274 ) 135.20092532 WF centre and spread 9 ( 1.042447, 16.377442, 3.282596 ) 70.52076662 WF centre and spread 10 ( 0.431645, 16.252073, 3.319730 ) 53.77775380 WF centre and spread 11 ( 0.485254,-18.540166, 3.311107 ) 26.69736255 WF centre and spread 12 ( 3.731847,-18.229484, 3.286572 ) 117.43008607 WF centre and spread 13 ( 2.466648, 19.259356, 3.299493 ) 112.81103628 WF centre and spread 14 ( 3.874578,-18.741214, 3.314344 ) 27.49000041 WF centre and spread 15 ( 2.108953, 16.043700, 3.307561 ) 34.99845772 WF centre and spread 16 ( 0.833907, 14.576857, 3.308736 ) 33.85600486 WF centre and spread 17 ( 0.403953,-17.024929, 3.305399 ) 65.05470045 WF centre and spread 18 ( 3.838970,-18.172723, 3.307589 ) 81.18362452 Sum of centres and spreads ( 46.849982, 59.391060, 59.506590 ) 1111.80875463 850 -0.493E-02 23.5316021078 1111.8086865921 54.49 <-- CONV O_D= 17.9981305 O_OD= 494.0555792 O_TOT= 1111.8086866 <-- SPRD Delta: O_D= -0.8838040E-03 O_OD= -0.4047720E-02 O_TOT= -0.4931524E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 860 WF centre and spread 1 ( 5.590699, 19.727892, 3.302348 ) 113.32284366 WF centre and spread 2 ( 3.655474, 16.972123, 3.321907 ) 23.54209128 WF centre and spread 3 ( 2.336671, 16.907443, 3.308154 ) 28.66893246 WF centre and spread 4 ( 1.745161, 17.906590, 3.257751 ) 118.86945200 WF centre and spread 5 ( 1.369766,-19.220983, 3.312320 ) 21.70991754 WF centre and spread 6 ( 3.241582,-19.229866, 3.315492 ) 25.85196027 WF centre and spread 7 ( 4.132223, 16.500315, 3.310626 ) 22.66312693 WF centre and spread 8 ( 5.563287, 17.884682, 3.336314 ) 135.51992813 WF centre and spread 9 ( 1.046718, 16.379303, 3.282740 ) 70.79984368 WF centre and spread 10 ( 0.434331, 16.234643, 3.319732 ) 53.65029184 WF centre and spread 11 ( 0.484469,-18.539725, 3.311068 ) 26.85571608 WF centre and spread 12 ( 3.751027,-18.134923, 3.286517 ) 118.46341893 WF centre and spread 13 ( 2.470397, 19.258439, 3.299585 ) 112.84253930 WF centre and spread 14 ( 3.878309,-18.740201, 3.314316 ) 27.71301378 WF centre and spread 15 ( 2.108823, 16.044413, 3.307540 ) 35.04465008 WF centre and spread 16 ( 0.833576, 14.575192, 3.308684 ) 33.92511204 WF centre and spread 17 ( 0.403122,-17.024466, 3.305410 ) 65.05669672 WF centre and spread 18 ( 3.839513,-18.173180, 3.307587 ) 81.18578262 Sum of centres and spreads ( 46.885148, 59.327689, 59.508091 ) 1115.68531733 860 -0.217E+00 75.0941575175 1115.6852492097 55.11 <-- CONV O_D= 19.7126413 O_OD= 496.2176310 O_TOT= 1115.6852492 <-- SPRD Delta: O_D= -0.2578498E+00 O_OD= 0.4081029E-01 O_TOT= -0.2170395E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 870 WF centre and spread 1 ( 5.601972, 19.724989, 3.314491 ) 113.41867716 WF centre and spread 2 ( 3.654839, 16.971988, 3.321932 ) 23.49753840 WF centre and spread 3 ( 2.333582, 16.910094, 3.308154 ) 28.60831952 WF centre and spread 4 ( 1.725047, 17.894320, 3.257396 ) 118.37907779 WF centre and spread 5 ( 1.369642,-19.220650, 3.312364 ) 21.63332558 WF centre and spread 6 ( 3.241108,-19.230421, 3.315535 ) 25.73161848 WF centre and spread 7 ( 4.131227, 16.500733, 3.310611 ) 22.53882204 WF centre and spread 8 ( 5.556204, 17.910151, 3.336346 ) 135.24194975 WF centre and spread 9 ( 1.047212, 16.330142, 3.282882 ) 70.83836558 WF centre and spread 10 ( 0.428189, 16.249164, 3.319649 ) 53.69097833 WF centre and spread 11 ( 0.483144,-18.540836, 3.311032 ) 26.78819974 WF centre and spread 12 ( 3.787880,-18.194229, 3.286608 ) 117.74263222 WF centre and spread 13 ( 2.470095, 19.256297, 3.299781 ) 112.87054786 WF centre and spread 14 ( 3.874626,-18.739489, 3.314260 ) 27.60998321 WF centre and spread 15 ( 2.108719, 16.047719, 3.307569 ) 34.96914018 WF centre and spread 16 ( 0.832525, 14.572326, 3.308666 ) 33.86632607 WF centre and spread 17 ( 0.401571,-17.023840, 3.305376 ) 65.04295514 WF centre and spread 18 ( 3.840464,-18.173930, 3.307597 ) 81.18953504 Sum of centres and spreads ( 46.888046, 59.244526, 59.520250 ) 1113.65799210 870 -0.355E+00 457.3652763328 1113.6579238968 55.71 <-- CONV O_D= 19.3681601 O_OD= 494.5347870 O_TOT= 1113.6579239 <-- SPRD Delta: O_D= -0.6364298E+00 O_OD= 0.2812789E+00 O_TOT= -0.3551509E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 880 WF centre and spread 1 ( 5.591999, 19.732055, 3.305767 ) 113.52270468 WF centre and spread 2 ( 3.654223, 16.971594, 3.321936 ) 23.45492520 WF centre and spread 3 ( 2.331908, 16.911214, 3.308144 ) 28.57098917 WF centre and spread 4 ( 1.735851, 17.910765, 3.257457 ) 118.05073404 WF centre and spread 5 ( 1.369726,-19.220603, 3.312380 ) 21.58783870 WF centre and spread 6 ( 3.241088,-19.231097, 3.315535 ) 25.66698544 WF centre and spread 7 ( 4.131691, 16.500745, 3.310607 ) 22.53312739 WF centre and spread 8 ( 5.560879, 17.913581, 3.336370 ) 135.23229505 WF centre and spread 9 ( 1.048208, 16.341965, 3.282943 ) 70.57479185 WF centre and spread 10 ( 0.431181, 16.240047, 3.319650 ) 53.47588707 WF centre and spread 11 ( 0.482968,-18.541065, 3.311003 ) 26.68767123 WF centre and spread 12 ( 3.737326,-18.234775, 3.286675 ) 117.57196652 WF centre and spread 13 ( 2.470565, 19.255665, 3.299890 ) 112.95030386 WF centre and spread 14 ( 3.874459,-18.739258, 3.314228 ) 27.52078361 WF centre and spread 15 ( 2.108642, 16.049821, 3.307578 ) 34.89704840 WF centre and spread 16 ( 0.831985, 14.570823, 3.308653 ) 33.82790507 WF centre and spread 17 ( 0.400820,-17.023332, 3.305361 ) 65.02148843 WF centre and spread 18 ( 3.841027,-18.174448, 3.307595 ) 81.18516169 Sum of centres and spreads ( 46.844544, 59.233698, 59.511774 ) 1112.33260741 880 -0.172E+00 56.0355598299 1112.3325393662 56.32 <-- CONV O_D= 18.7932897 O_OD= 493.7842728 O_TOT= 1112.3325394 <-- SPRD Delta: O_D= -0.7541514E-01 O_OD= -0.9667181E-01 O_TOT= -0.1720869E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 890 WF centre and spread 1 ( 5.599978, 19.748903, 3.302239 ) 113.61733082 WF centre and spread 2 ( 3.653119, 16.970797, 3.321946 ) 23.40298863 WF centre and spread 3 ( 2.329619, 16.912789, 3.308136 ) 28.51621968 WF centre and spread 4 ( 1.736991, 17.958965, 3.257545 ) 117.45785636 WF centre and spread 5 ( 1.369588,-19.220646, 3.312412 ) 21.53660487 WF centre and spread 6 ( 3.240845,-19.231953, 3.315546 ) 25.64265757 WF centre and spread 7 ( 4.131629, 16.500926, 3.310607 ) 22.46387024 WF centre and spread 8 ( 5.575944, 17.883660, 3.336419 ) 135.16904590 WF centre and spread 9 ( 1.051152, 16.365969, 3.283054 ) 70.43670307 WF centre and spread 10 ( 0.429728, 16.236664, 3.319583 ) 53.57549742 WF centre and spread 11 ( 0.482112,-18.541963, 3.310977 ) 26.71431196 WF centre and spread 12 ( 3.725299,-18.276697, 3.286798 ) 117.31439287 WF centre and spread 13 ( 2.471439, 19.253490, 3.300075 ) 112.97552704 WF centre and spread 14 ( 3.873739,-18.738972, 3.314182 ) 27.50701218 WF centre and spread 15 ( 2.108326, 16.052070, 3.307599 ) 34.83547718 WF centre and spread 16 ( 0.830883, 14.568260, 3.308616 ) 33.77773020 WF centre and spread 17 ( 0.399737,-17.023313, 3.305326 ) 64.99833547 WF centre and spread 18 ( 3.841857,-18.175381, 3.307592 ) 81.18342201 Sum of centres and spreads ( 46.851983, 59.243567, 59.508652 ) 1111.12498346 890 -0.932E-01 44.6514360965 1111.1249153593 57.05 <-- CONV O_D= 18.2761405 O_OD= 493.0937980 O_TOT= 1111.1249154 <-- SPRD Delta: O_D= -0.3237017E-01 O_OD= -0.6079455E-01 O_TOT= -0.9316472E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 900 WF centre and spread 1 ( 5.598221, 19.766101, 3.293957 ) 113.66416656 WF centre and spread 2 ( 3.651893, 16.970155, 3.321958 ) 23.32955013 WF centre and spread 3 ( 2.327445, 16.914438, 3.308133 ) 28.45264033 WF centre and spread 4 ( 1.746897, 18.028589, 3.257022 ) 117.13180580 WF centre and spread 5 ( 1.369491,-19.220628, 3.312446 ) 21.45902193 WF centre and spread 6 ( 3.240149,-19.232774, 3.315560 ) 25.55289536 WF centre and spread 7 ( 4.131798, 16.500949, 3.310597 ) 22.46274578 WF centre and spread 8 ( 5.547399, 17.903968, 3.336491 ) 135.09168000 WF centre and spread 9 ( 1.052076, 16.366623, 3.283153 ) 70.38425722 WF centre and spread 10 ( 0.431902, 16.229954, 3.319569 ) 53.35995719 WF centre and spread 11 ( 0.481183,-18.543027, 3.310944 ) 26.57433044 WF centre and spread 12 ( 3.728886,-18.270372, 3.286891 ) 117.30750278 WF centre and spread 13 ( 2.471769, 19.251639, 3.300232 ) 113.04893323 WF centre and spread 14 ( 3.873350,-18.739328, 3.314142 ) 27.36312549 WF centre and spread 15 ( 2.108089, 16.054628, 3.307620 ) 34.77105594 WF centre and spread 16 ( 0.830294, 14.566123, 3.308601 ) 33.73737813 WF centre and spread 17 ( 0.398790,-17.022986, 3.305305 ) 64.98479327 WF centre and spread 18 ( 3.842623,-18.176263, 3.307594 ) 81.17502121 Sum of centres and spreads ( 46.832258, 59.347787, 59.500215 ) 1109.85086079 900 -0.949E-01 75.3427933156 1109.8507928065 57.27 <-- CONV O_D= 17.9673376 O_OD= 492.1284783 O_TOT= 1109.8507928 <-- SPRD Delta: O_D= -0.1154564E-01 O_OD= -0.8338508E-01 O_TOT= -0.9493072E-01 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Cycle: 910 WF centre and spread 1 ( 5.575059, 19.761643, 3.312743 ) 113.55250128 WF centre and spread 2 ( 3.651084, 16.969690, 3.321969 ) 23.30228992 WF centre and spread 3 ( 2.326304, 16.915260, 3.308134 ) 28.41553546 WF centre and spread 4 ( 1.753295, 18.032472, 3.256256 ) 117.14895157 WF centre and spread 5 ( 1.369304,-19.220543, 3.312475 ) 21.42415147 WF centre and spread 6 ( 3.239319,-19.233182, 3.315565 ) 25.52509993 WF centre and spread 7 ( 4.131658, 16.500776, 3.310596 ) 22.47119433 WF centre and spread 8 ( 5.564253, 17.948779, 3.336522 ) 135.31261493 WF centre and spread 9 ( 1.053512, 16.364953, 3.283225 ) 70.42520464 WF centre and spread 10 ( 0.429376, 16.235767, 3.319528 ) 53.38996421 WF centre and spread 11 ( 0.480456,-18.543402, 3.310925 ) 26.59464294 WF centre and spread 12 ( 3.730327,-18.183744, 3.286973 ) 117.52451823 WF centre and spread 13 ( 2.472354, 19.289488, 3.299794 ) 113.12665815 WF centre and spread 14 ( 3.873994,-18.739815, 3.314122 ) 27.30451166 WF centre and spread 15 ( 2.107865, 16.055363, 3.307635 ) 34.76291395 WF centre and spread 16 ( 0.829635, 14.564642, 3.308582 ) 33.71783372 WF centre and spread 17 ( 0.398313,-17.022979, 3.305294 ) 64.97315997 WF centre and spread 18 ( 3.843009,-18.176793, 3.307598 ) 81.16563488 Sum of centres and spreads ( 46.829114, 59.518372, 59.517937 ) 1110.13738122 910 0.339E-01 124.4138010886 1110.1373132569 58.91 <-- CONV O_D= 18.5465306 O_OD= 491.8358058 O_TOT= 1110.1373133 <-- SPRD Delta: O_D= 0.4177249E-01 O_OD= -0.7871487E-02 O_TOT= 0.3390101E-01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 920 WF centre and spread 1 ( 5.632277, 19.749289, 3.316866 ) 113.70047347 WF centre and spread 2 ( 3.650659, 16.969187, 3.321978 ) 23.30630267 WF centre and spread 3 ( 2.324422, 16.916738, 3.308123 ) 28.38594338 WF centre and spread 4 ( 1.756479, 18.005943, 3.257248 ) 117.21775077 WF centre and spread 5 ( 1.369157,-19.220345, 3.312496 ) 21.37175153 WF centre and spread 6 ( 3.238672,-19.233547, 3.315560 ) 25.54495441 WF centre and spread 7 ( 4.132058, 16.501079, 3.310593 ) 22.38362491 WF centre and spread 8 ( 5.544235, 17.956747, 3.336512 ) 135.14463502 WF centre and spread 9 ( 1.055553, 16.365366, 3.283317 ) 70.43411679 WF centre and spread 10 ( 0.432191, 16.175035, 3.319561 ) 53.72349675 WF centre and spread 11 ( 0.480196,-18.543461, 3.310901 ) 26.61096317 WF centre and spread 12 ( 3.729235,-18.274643, 3.286980 ) 117.14886479 WF centre and spread 13 ( 2.475997, 19.200369, 3.307191 ) 113.17067300 WF centre and spread 14 ( 3.873334,-18.738697, 3.314080 ) 27.36483625 WF centre and spread 15 ( 2.107813, 16.058126, 3.307654 ) 34.80006947 WF centre and spread 16 ( 0.830124, 14.562740, 3.308546 ) 33.76023163 WF centre and spread 17 ( 0.397775,-17.022181, 3.305279 ) 64.98160321 WF centre and spread 18 ( 3.843796,-18.177507, 3.307592 ) 81.17393824 Sum of centres and spreads ( 46.873973, 59.250238, 59.530475 ) 1110.22422944 920 -0.555E+00 253.5421497800 1110.2241613020 59.54 <-- CONV O_D= 18.6512085 O_OD= 491.8179759 O_TOT= 1110.2241613 <-- SPRD Delta: O_D= -0.8115166E+00 O_OD= 0.2565975E+00 O_TOT= -0.5549191E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 930 WF centre and spread 1 ( 5.601401, 19.764108, 3.312510 ) 113.55823927 WF centre and spread 2 ( 3.649440, 16.968522, 3.321999 ) 23.25204669 WF centre and spread 3 ( 2.322389, 16.918316, 3.308125 ) 28.32867007 WF centre and spread 4 ( 1.757432, 18.039578, 3.256121 ) 117.13174106 WF centre and spread 5 ( 1.368874,-19.220247, 3.312540 ) 21.30730832 WF centre and spread 6 ( 3.237348,-19.234244, 3.315581 ) 25.47844731 WF centre and spread 7 ( 4.131853, 16.500827, 3.310583 ) 22.42960465 WF centre and spread 8 ( 5.552531, 17.915025, 3.336516 ) 135.03949300 WF centre and spread 9 ( 1.057770, 16.354964, 3.283425 ) 70.46311903 WF centre and spread 10 ( 0.428470, 16.205612, 3.319520 ) 53.37123562 WF centre and spread 11 ( 0.479077,-18.544190, 3.310874 ) 26.59038989 WF centre and spread 12 ( 3.732664,-18.222144, 3.287086 ) 117.21848289 WF centre and spread 13 ( 2.476195, 19.244821, 3.301282 ) 113.06815452 WF centre and spread 14 ( 3.873201,-18.739075, 3.314039 ) 27.30085802 WF centre and spread 15 ( 2.107561, 16.060083, 3.307695 ) 34.68683241 WF centre and spread 16 ( 0.828574, 14.560479, 3.308540 ) 33.67104419 WF centre and spread 17 ( 0.396326,-17.021910, 3.305260 ) 64.95669592 WF centre and spread 18 ( 3.844434,-18.178385, 3.307599 ) 81.15846171 Sum of centres and spreads ( 46.845541, 59.372138, 59.519295 ) 1109.01082455 930 -0.158E+00 67.7499903531 1109.0107565080 60.20 <-- CONV O_D= 18.1450877 O_OD= 491.1106919 O_TOT= 1109.0107565 <-- SPRD Delta: O_D= -0.1469954E+00 O_OD= -0.1105133E-01 O_TOT= -0.1580467E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 940 WF centre and spread 1 ( 5.599717, 19.787757, 3.299613 ) 113.69610893 WF centre and spread 2 ( 3.649367, 16.968322, 3.322005 ) 23.27441151 WF centre and spread 3 ( 2.321321, 16.919025, 3.308118 ) 28.31754196 WF centre and spread 4 ( 1.744888, 18.040051, 3.257177 ) 117.08163840 WF centre and spread 5 ( 1.368622,-19.220251, 3.312549 ) 21.30560337 WF centre and spread 6 ( 3.237369,-19.234434, 3.315579 ) 25.50540136 WF centre and spread 7 ( 4.131688, 16.501001, 3.310579 ) 22.39390536 WF centre and spread 8 ( 5.594534, 17.905618, 3.336548 ) 135.09117489 WF centre and spread 9 ( 1.059340, 16.378154, 3.283469 ) 70.36729458 WF centre and spread 10 ( 0.428275, 16.218206, 3.319490 ) 53.26330102 WF centre and spread 11 ( 0.478673,-18.544587, 3.310854 ) 26.55319333 WF centre and spread 12 ( 3.725061,-18.263969, 3.287131 ) 117.16125112 WF centre and spread 13 ( 2.475854, 19.246849, 3.300420 ) 113.09664251 WF centre and spread 14 ( 3.872762,-18.738659, 3.314016 ) 27.27996652 WF centre and spread 15 ( 2.107614, 16.061466, 3.307699 ) 34.63821993 WF centre and spread 16 ( 0.827917, 14.559382, 3.308522 ) 33.65693133 WF centre and spread 17 ( 0.395788,-17.021861, 3.305247 ) 64.94525867 WF centre and spread 18 ( 3.844836,-18.178687, 3.307595 ) 81.16867432 Sum of centres and spreads ( 46.863627, 59.383381, 59.506608 ) 1108.79651911 940 -0.222E+00 42.9521165485 1108.7964509366 60.79 <-- CONV O_D= 18.0046315 O_OD= 491.0368426 O_TOT= 1108.7964509 <-- SPRD Delta: O_D= -0.2611191E-01 O_OD= -0.1956761E+00 O_TOT= -0.2217880E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 950 WF centre and spread 1 ( 5.600373, 19.810555, 3.303757 ) 113.65147499 WF centre and spread 2 ( 3.648668, 16.968175, 3.322013 ) 23.23348678 WF centre and spread 3 ( 2.319847, 16.920561, 3.308122 ) 28.25730330 WF centre and spread 4 ( 1.762796, 18.024813, 3.256096 ) 117.06981562 WF centre and spread 5 ( 1.368502,-19.220116, 3.312581 ) 21.23540826 WF centre and spread 6 ( 3.236065,-19.234958, 3.315583 ) 25.41970878 WF centre and spread 7 ( 4.131483, 16.501258, 3.310569 ) 22.33526289 WF centre and spread 8 ( 5.539235, 17.885255, 3.336579 ) 135.07854190 WF centre and spread 9 ( 1.060454, 16.348503, 3.283550 ) 70.23011060 WF centre and spread 10 ( 0.427263, 16.244037, 3.319454 ) 53.15680169 WF centre and spread 11 ( 0.477955,-18.544995, 3.310818 ) 26.48142144 WF centre and spread 12 ( 3.727484,-18.347344, 3.287196 ) 117.38134480 WF centre and spread 13 ( 2.475649, 19.246792, 3.300559 ) 113.07031553 WF centre and spread 14 ( 3.871717,-18.738729, 3.313984 ) 27.15585904 WF centre and spread 15 ( 2.107385, 16.063682, 3.307719 ) 34.59622701 WF centre and spread 16 ( 0.827040, 14.557685, 3.308513 ) 33.62728432 WF centre and spread 17 ( 0.394972,-17.021479, 3.305239 ) 64.92444598 WF centre and spread 18 ( 3.845397,-18.179152, 3.307604 ) 81.15534049 Sum of centres and spreads ( 46.822284, 59.284544, 59.509935 ) 1108.06015343 950 0.267E-02 107.4840865040 1108.0600854787 61.47 <-- CONV O_D= 18.0978767 O_OD= 490.2072319 O_TOT= 1108.0600855 <-- SPRD Delta: O_D= -0.4902677E-02 O_OD= 0.7572675E-02 O_TOT= 0.2669997E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 960 WF centre and spread 1 ( 5.604570, 19.798828, 3.302272 ) 113.63033697 WF centre and spread 2 ( 3.648315, 16.967987, 3.322017 ) 23.21950376 WF centre and spread 3 ( 2.319300, 16.920929, 3.308122 ) 28.24081772 WF centre and spread 4 ( 1.763640, 18.017977, 3.255669 ) 117.06927535 WF centre and spread 5 ( 1.368472,-19.220080, 3.312591 ) 21.21872279 WF centre and spread 6 ( 3.235694,-19.235133, 3.315587 ) 25.40114397 WF centre and spread 7 ( 4.131503, 16.501291, 3.310570 ) 22.31806841 WF centre and spread 8 ( 5.558685, 17.872559, 3.336575 ) 135.02034377 WF centre and spread 9 ( 1.061128, 16.353179, 3.283584 ) 70.19425795 WF centre and spread 10 ( 0.427376, 16.253439, 3.319443 ) 53.15395322 WF centre and spread 11 ( 0.477798,-18.545018, 3.310808 ) 26.47288145 WF centre and spread 12 ( 3.725396,-18.289455, 3.287219 ) 117.18347899 WF centre and spread 13 ( 2.476028, 19.246322, 3.300622 ) 113.05580717 WF centre and spread 14 ( 3.871666,-18.738879, 3.313975 ) 27.11825969 WF centre and spread 15 ( 2.107311, 16.064213, 3.307725 ) 34.58175921 WF centre and spread 16 ( 0.826714, 14.557103, 3.308505 ) 33.61634741 WF centre and spread 17 ( 0.394807,-17.021458, 3.305235 ) 64.91634552 WF centre and spread 18 ( 3.845529,-18.179375, 3.307605 ) 81.15113164 Sum of centres and spreads ( 46.843934, 59.324430, 59.508124 ) 1107.56243501 960 -0.816E-02 29.7514400312 1107.5623669579 62.08 <-- CONV O_D= 17.8301409 O_OD= 489.9772492 O_TOT= 1107.5623670 <-- SPRD Delta: O_D= -0.2237313E-03 O_OD= -0.7932592E-02 O_TOT= -0.8156324E-02 <-- DLTA ------------------------------------------------------------------------------ Cycle: 970 WF centre and spread 1 ( 5.603094, 19.806679, 3.311812 ) 113.63004773 WF centre and spread 2 ( 3.648303, 16.967654, 3.322028 ) 23.26360977 WF centre and spread 3 ( 2.318339, 16.921556, 3.308116 ) 28.23542336 WF centre and spread 4 ( 1.749294, 17.937466, 3.256914 ) 117.41331808 WF centre and spread 5 ( 1.368055,-19.220013, 3.312607 ) 21.22402828 WF centre and spread 6 ( 3.235180,-19.235012, 3.315575 ) 25.47155767 WF centre and spread 7 ( 4.131411, 16.501239, 3.310569 ) 22.31969993 WF centre and spread 8 ( 5.556863, 17.648108, 3.336601 ) 138.26889877 WF centre and spread 9 ( 1.063875, 16.357866, 3.283649 ) 70.19324280 WF centre and spread 10 ( 0.426631, 16.380744, 3.319397 ) 53.99278704 WF centre and spread 11 ( 0.477359,-18.545141, 3.310792 ) 26.54753505 WF centre and spread 12 ( 3.731983,-18.301564, 3.287243 ) 117.16132857 WF centre and spread 13 ( 2.476936, 19.245506, 3.300734 ) 113.05673891 WF centre and spread 14 ( 3.872065,-18.738201, 3.313952 ) 27.19892585 WF centre and spread 15 ( 2.107363, 16.065070, 3.307728 ) 34.58824932 WF centre and spread 16 ( 0.826299, 14.555876, 3.308475 ) 33.63098660 WF centre and spread 17 ( 0.394386,-17.021520, 3.305226 ) 64.91145946 WF centre and spread 18 ( 3.845923,-18.179707, 3.307600 ) 81.15813585 Sum of centres and spreads ( 46.833358, 59.146605, 59.519018 ) 1112.26597304 970 0.400E+01 128.3476298064 1112.2659050039 62.69 <-- CONV O_D= 22.1372536 O_OD= 490.3736746 O_TOT= 1112.2659050 <-- SPRD Delta: O_D= 0.3947968E+01 O_OD= 0.4713951E-01 O_TOT= 0.3995107E+01 <-- DLTA ------------------------------------------------------------------------------ Cycle: 980 WF centre and spread 1 ( 5.597069, 19.654170, 3.316898 ) 116.47032996 WF centre and spread 2 ( 3.646731, 16.966538, 3.322048 ) 23.22171728 WF centre and spread 3 ( 2.314967, 16.925026, 3.308102 ) 28.33535556 WF centre and spread 4 ( 1.774030, 17.978740, 3.256333 ) 117.50943368 WF centre and spread 5 ( 1.368322,-19.219300, 3.312657 ) 21.12593913 WF centre and spread 6 ( 3.233757,-19.235829, 3.315581 ) 25.40274488 WF centre and spread 7 ( 4.127904, 16.499533, 3.310511 ) 22.60617779 WF centre and spread 8 ( 5.590872, 17.966947, 3.336300 ) 135.12685946 WF centre and spread 9 ( 1.055208, 16.347073, 3.283809 ) 73.25620716 WF centre and spread 10 ( 0.423581, 16.201834, 3.319367 ) 53.50887107 WF centre and spread 11 ( 0.482336,-18.543532, 3.310788 ) 26.75361916 WF centre and spread 12 ( 3.754309,-18.460055, 3.287289 ) 117.86329726 WF centre and spread 13 ( 2.474150, 19.249528, 3.309813 ) 113.37971841 WF centre and spread 14 ( 3.872330,-18.735369, 3.313952 ) 27.80098370 WF centre and spread 15 ( 2.107917, 16.069233, 3.307783 ) 34.67670857 WF centre and spread 16 ( 0.823669, 14.551627, 3.308396 ) 33.86192702 WF centre and spread 17 ( 0.388109,-17.016953, 3.305388 ) 65.16040198 WF centre and spread 18 ( 3.846274,-18.181222, 3.307605 ) 81.15878096 Sum of centres and spreads ( 46.881534, 59.017987, 59.532620 ) 1117.21907302 980 -0.538E+00 105.3412409013 1117.2190047947 63.33 <-- CONV O_D= 20.3221467 O_OD= 497.1418813 O_TOT= 1117.2190048 <-- SPRD Delta: O_D= -0.1695582E+00 O_OD= -0.3686101E+00 O_TOT= -0.5381683E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 990 WF centre and spread 1 ( 5.619675, 19.696512, 3.315858 ) 114.86622837 WF centre and spread 2 ( 3.645590, 16.966059, 3.322063 ) 23.20766147 WF centre and spread 3 ( 2.311742, 16.927320, 3.308093 ) 28.16597286 WF centre and spread 4 ( 1.778172, 17.958836, 3.255876 ) 117.29195320 WF centre and spread 5 ( 1.367698,-19.219113, 3.312715 ) 21.03528165 WF centre and spread 6 ( 3.232651,-19.236938, 3.315588 ) 25.32255880 WF centre and spread 7 ( 4.128313, 16.499664, 3.310496 ) 22.42678751 WF centre and spread 8 ( 5.569398, 17.942404, 3.336382 ) 134.38258517 WF centre and spread 9 ( 1.058940, 16.365536, 3.283939 ) 72.08609058 WF centre and spread 10 ( 0.424459, 16.224215, 3.319298 ) 53.11347247 WF centre and spread 11 ( 0.479666,-18.544824, 3.310722 ) 26.44190411 WF centre and spread 12 ( 3.736333,-18.364743, 3.287444 ) 117.18835544 WF centre and spread 13 ( 2.477541, 19.232886, 3.300653 ) 113.40861658 WF centre and spread 14 ( 3.873095,-18.735996, 3.313898 ) 27.24583460 WF centre and spread 15 ( 2.107765, 16.072519, 3.307842 ) 34.50221463 WF centre and spread 16 ( 0.821511, 14.547890, 3.308338 ) 33.66699000 WF centre and spread 17 ( 0.387072,-17.016188, 3.305344 ) 64.98035389 WF centre and spread 18 ( 3.847392,-18.181934, 3.307616 ) 81.14862260 Sum of centres and spreads ( 46.867013, 59.134107, 59.522162 ) 1110.48148394 990 -0.518E+00 123.5623157912 1110.4814157533 63.92 <-- CONV O_D= 18.7015123 O_OD= 492.0249265 O_TOT= 1110.4814158 <-- SPRD Delta: O_D= -0.5834311E+00 O_OD= 0.6589244E-01 O_TOT= -0.5175386E+00 <-- DLTA ------------------------------------------------------------------------------ Cycle: 1000 WF centre and spread 1 ( 5.592350, 19.755352, 3.312823 ) 114.27309408 WF centre and spread 2 ( 3.645057, 16.965507, 3.322080 ) 23.20124653 WF centre and spread 3 ( 2.309771, 16.928368, 3.308083 ) 28.11329378 WF centre and spread 4 ( 1.767277, 18.008279, 3.256276 ) 117.13484840 WF centre and spread 5 ( 1.367407,-19.219018, 3.312744 ) 21.00786166 WF centre and spread 6 ( 3.232168,-19.237087, 3.315596 ) 25.34279384 WF centre and spread 7 ( 4.128546, 16.499498, 3.310492 ) 22.40322425 WF centre and spread 8 ( 5.532986, 17.936761, 3.336433 ) 134.38273761 WF centre and spread 9 ( 1.062967, 16.355239, 3.284020 ) 71.71600022 WF centre and spread 10 ( 0.424437, 16.277074, 3.319259 ) 53.00631874 WF centre and spread 11 ( 0.478366,-18.545461, 3.310695 ) 26.44684224 WF centre and spread 12 ( 3.708390,-18.260627, 3.287530 ) 117.33801843 WF centre and spread 13 ( 2.480069, 19.182732, 3.305865 ) 113.57226985 WF centre and spread 14 ( 3.873457,-18.736192, 3.313860 ) 27.13745972 WF centre and spread 15 ( 2.107470, 16.073819, 3.307856 ) 34.43252122 WF centre and spread 16 ( 0.820178, 14.545691, 3.308314 ) 33.57814734 WF centre and spread 17 ( 0.386079,-17.016378, 3.305331 ) 64.93142462 WF centre and spread 18 ( 3.848165,-18.182574, 3.307614 ) 81.14722000 Sum of centres and spreads ( 46.765142, 59.330984, 59.524871 ) 1109.16532254 1000 -0.654E+00 73.0992462887 1109.1652547399 64.53 <-- CONV O_D= 18.4284338 O_OD= 490.9818441 O_TOT= 1109.1652547 <-- SPRD Delta: O_D= -0.4131050E+00 O_OD= -0.2405644E+00 O_TOT= -0.6536693E+00 <-- DLTA ------------------------------------------------------------------------------ Writing checkpoint file GrapACW.chk... done Final State WF centre and spread 1 ( 5.592350, 19.755352, 3.312823 ) 114.27309408 WF centre and spread 2 ( 3.645057, 16.965507, 3.322080 ) 23.20124653 WF centre and spread 3 ( 2.309771, 16.928368, 3.308083 ) 28.11329378 WF centre and spread 4 ( 1.767277, 18.008279, 3.256276 ) 117.13484840 WF centre and spread 5 ( 1.367407,-19.219018, 3.312744 ) 21.00786166 WF centre and spread 6 ( 3.232168,-19.237087, 3.315596 ) 25.34279384 WF centre and spread 7 ( 4.128546, 16.499498, 3.310492 ) 22.40322425 WF centre and spread 8 ( 5.532986, 17.936761, 3.336433 ) 134.38273761 WF centre and spread 9 ( 1.062967, 16.355239, 3.284020 ) 71.71600022 WF centre and spread 10 ( 0.424437, 16.277074, 3.319259 ) 53.00631874 WF centre and spread 11 ( 0.478366,-18.545461, 3.310695 ) 26.44684224 WF centre and spread 12 ( 3.708390,-18.260627, 3.287530 ) 117.33801843 WF centre and spread 13 ( 2.480069, 19.182732, 3.305865 ) 113.57226985 WF centre and spread 14 ( 3.873457,-18.736192, 3.313860 ) 27.13745972 WF centre and spread 15 ( 2.107470, 16.073819, 3.307856 ) 34.43252122 WF centre and spread 16 ( 0.820178, 14.545691, 3.308314 ) 33.57814734 WF centre and spread 17 ( 0.386079,-17.016378, 3.305331 ) 64.93142462 WF centre and spread 18 ( 3.848165,-18.182574, 3.307614 ) 81.14722000 Sum of centres and spreads ( 46.765142, 59.330984, 59.524871 ) 1109.16532254 Spreads (Ang^2) Omega I = 599.754976863 ================ Omega D = 18.428433796 Omega OD = 490.981844081 Final Spread (Ang^2) Omega Total = 1109.165254740 ------------------------------------------------------------------------------ Time for wannierise 58.081 (sec) Writing checkpoint file GrapACW.chk... done *---------------------------------------------------------------------------* | PLOTTING | *---------------------------------------------------------------------------* Translated centres translation centre in fractional coordinate: 0.488923 0.470743 0.220658 WF centre 1 ( 1.298659, 19.755352, 3.312823 ) WF centre 2 ( 3.645057, 16.965507, 3.322080 ) WF centre 3 ( 2.309771, 16.928368, 3.308083 ) WF centre 4 ( 1.767277, 18.008279, 3.256276 ) WF centre 5 ( 1.367407, 20.781011, 3.312744 ) WF centre 6 ( 3.232168, 20.762942, 3.315596 ) WF centre 7 ( 4.128546, 16.499498, 3.310492 ) WF centre 8 ( 1.239295, 17.936761, 3.336433 ) WF centre 9 ( 1.062967, 16.355239, 3.284020 ) WF centre 10 ( 0.424437, 16.277074, 3.319259 ) WF centre 11 ( 0.478366, 21.454568, 3.310695 ) WF centre 12 ( 3.708390, 21.739402, 3.287530 ) WF centre 13 ( 2.480069, 19.182732, 3.305865 ) WF centre 14 ( 3.873457, 21.263837, 3.313860 ) WF centre 15 ( 2.107470, 16.073819, 3.307856 ) WF centre 16 ( 0.820178, 14.545691, 3.308314 ) WF centre 17 ( 0.386079, 22.983651, 3.305331 ) WF centre 18 ( 3.848165, 21.817455, 3.307614 ) ------------------------------------------------------------------------------ Calculating interpolated band-structure Time to calculate interpolated band structure 1.239 (sec) Time for plotting 1.413 (sec) *---------------------------------------------------------------------------* | TRANSPORT | *---------------------------------------------------------------------------* Calculation of Quantum Conductance and DoS: bulk mode Maximum imaginary part of the real-space Hamiltonian: 1.120553 dist_cutoff 251.00000 Ang is too large reset to 128.81073 Ang ------------------------------------------------------------------------------ Maximum real part of the real-space Hamiltonian at each lattice point -------------------------------------------------------------- Lattice point R Max |H_ij(R)| -31 0.000000 -30 0.013810 -29 0.021034 -28 0.020282 -27 0.013585 -26 0.016016 -25 0.014562 -24 0.019911 -23 0.030724 -22 0.034915 -21 0.029962 -20 0.029597 -19 0.021565 -18 0.016349 -17 0.024760 -16 0.028904 -15 0.036485 -14 0.046171 -13 0.038384 -12 0.035100 -11 0.035542 -10 0.046307 -9 0.028798 -8 0.054644 -7 0.076208 -6 0.115665 -5 0.203352 -4 0.318195 -3 0.629141 -2 0.905389 -1 2.172665 0 4.963260 1 2.172665 2 0.905389 3 0.629141 4 0.318195 5 0.203352 6 0.115665 7 0.076208 8 0.054644 9 0.028798 10 0.046307 11 0.035542 12 0.035100 13 0.038384 14 0.046171 15 0.036485 16 0.028904 17 0.024760 18 0.016349 19 0.021565 20 0.029597 21 0.029962 22 0.034915 23 0.030724 24 0.019911 25 0.014562 26 0.016016 27 0.013585 28 0.020282 29 0.021034 30 0.013810 31 0.000000 -------------------------------------------------------------- Number of unit cells inside the principal layer: 30 Number of Wannier Functions inside the principal layer: 540 Calculating quantum conductance and density of states... done Time for transport 7860.739 (sec) Total Execution Time 7923.372 (sec) *===========================================================================* | TIMING INFORMATION | *===========================================================================* | Tag Ncalls Time (s)| |---------------------------------------------------------------------------| |kmesh: get : 1 2.711| |overlap: allocate : 1 0.004| |overlap: read : 1 0.364| |wann: main : 1 58.081| |plot: main : 1 1.413| |tran: main : 1 7860.739| *---------------------------------------------------------------------------* All done: wannier90 exiting