<div dir="ltr"><div class="gmail_default" style="font-family:arial black,sans-serif"><br></div><div class="gmail_extra"><br><div class="gmail_quote">On Mon, Sep 7, 2015 at 12:05 PM, reyna mendez camacho <span dir="ltr"><<a href="mailto:reyna129b@hotmail.com" target="_blank">reyna129b@hotmail.com</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">
<div><div dir="ltr">Thanks for your attention:<div>I follow this procedure:</div></div></div></blockquote><div><br></div><div><div class="gmail_default" style="font-family:'arial black',sans-serif">you need to pay close attention to the output. </div><div class="gmail_default" style="font-family:'arial black',sans-serif">you require mpiifort as parallel fortran compiler wrapper, but that doesn't seem to be available. configure then falls back to assuming gfortran. however, mpif90 is producing warnings and errors pointing at it using ifort as underlying compiler.</div><div class="gmail_default" style="font-family:'arial black',sans-serif"><br></div><div class="gmail_default" style="font-family:'arial black',sans-serif">try using MPIF90=mpif90</div><div class="gmail_default" style="font-family:'arial black',sans-serif"><br></div><div class="gmail_default" style="font-family:'arial black',sans-serif">if that fails, try compiling a serial version first and then take it from there.</div><div class="gmail_default" style="font-family:'arial black',sans-serif"><br></div><div class="gmail_default" style="font-family:'arial black',sans-serif">axel.</div><br></div><div> </div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div><div dir="ltr"><div><br></div><div>1.- download QE 5.1.</div><div>2.- Clone the linear algebra package libxphi from Github.</div><div>3.- Untar te QE software.</div><div>4.- Source the intel compiler, in my case composer_xe_2015.3.187 and mkl: </div><div> <span style="font-family:Menlo;font-size:11px">source /opt/intel/composer_xe_2015.3.187/bin/compilervars.sh intel64</span></div><div><font face="Menlo"><span style="font-size:11px"> </span></font><span style="font-family:Menlo;font-size:11px">source /opt/intel/mkl/bin/intel64/mklvars_intel64.sh</span></div><div>5.- Change to the espresso directory and run the configure script</div><div> cd espresso-5.1</div><div> export LAPACK_LIBS=<span style="color:rgb(0,0,255);font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(255,255,255)">"-mkl=parallel"</span></div><div><span style="background-color:rgb(255,255,255)"> export BLAS_LIBS= </span><span style="color:rgb(0,0,255);font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(255,255,255)">"-mkl=parallel"</span></div><div><span style="background-color:rgb(255,255,255)"><font color="#0000ff" face="Consolas, Bitstream Vera Sans Mono, Courier New, Courier, monospace"><span style="font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap"> </span></font></span><span style="background-color:rgb(255,255,255)">export FFT_LIBS= </span><span style="color:rgb(0,0,255);font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(255,255,255)">"-mkl=parallel" </span></div><div><span style="font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(248,248,248)"> export MPIF90=mpiifort</span></div><div><font face="Consolas, Bitstream Vera Sans Mono, Courier New, Courier, monospace"><span style="font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap"><span style="background-color:rgb(248,248,248)"> </span></span></font><span style="font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(255,255,255)">export AR=xiar</span></div><div><font face="Consolas, Bitstream Vera Sans Mono, Courier New, Courier, monospace"><span style="font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap"><span style="background-color:rgb(255,255,255)"> </span></span></font><span style="font-family:Consolas,'Bitstream Vera Sans Mono','Courier New',Courier,monospace;font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap;background-color:rgb(248,248,248)">./configure --enable-openmp</span></div><div><font face="Consolas, Bitstream Vera Sans Mono, Courier New, Courier, monospace"><span style="font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap"><span style="background-color:rgb(248,248,248)"><br></span></span></font></div><div><font face="Consolas, Bitstream Vera Sans Mono, Courier New, Courier, monospace"><span style="font-size:14px;line-height:15.399999618530273px;white-space:pre-wrap"><span style="background-color:rgb(248,248,248)"> </span></span></font><span style="font-family:Menlo;font-size:11px">configure: WARNING: using cross tools not prefixed with host triplet</span>
<p style="font-size:11px;font-family:Menlo">checking whether the Fortran compiler works... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for Fortran compiler default output file name... a.out</p>
<p style="font-size:11px;font-family:Menlo">checking for suffix of executables... </p>
<p style="font-size:11px;font-family:Menlo">checking whether we are cross compiling... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for suffix of object files... o</p>
<p style="font-size:11px;font-family:Menlo">checking whether we are using the GNU Fortran compiler... no</p>
<p style="font-size:11px;font-family:Menlo">checking whether ifort accepts -g... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for Fortran flag to compile .f90 files... none</p>
<p style="font-size:11px;font-family:Menlo">checking for mpiifort... no</p>
<p style="font-size:11px;font-family:Menlo">checking whether we are using the GNU Fortran compiler... no</p>
<p style="font-size:11px;font-family:Menlo">checking whether accepts -g... no</p>
<p style="font-size:11px;font-family:Menlo">configure: WARNING: MPIF90 not found: using MPIF90 anyway</p>
<p style="font-size:11px;font-family:Menlo">checking version of mpiifort... unknown, assuming gfortran</p>
<p style="font-size:11px;font-family:Menlo">configure: WARNING: parallel compiler mpiifort uses gfortran, but serial compiler ifort was detected</p>
<p style="font-size:11px;font-family:Menlo">configure: WARNING: assuming F90=gfortran, discarding ifort</p>
<p style="font-size:11px;font-family:Menlo">setting F90... gfortran</p>
<p style="font-size:11px;font-family:Menlo">setting MPIF90... mpiifort</p>
<p style="font-size:11px;font-family:Menlo">checking for cc... cc</p>
<p style="font-size:11px;font-family:Menlo">checking whether we are using the GNU C compiler... yes</p>
<p style="font-size:11px;font-family:Menlo">checking whether cc accepts -g... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for cc option to accept ISO C89... none needed</p>
<p style="font-size:11px;font-family:Menlo">setting CC... cc</p>
<p style="font-size:11px;font-family:Menlo">checking how to run the C preprocessor... cc -E</p>
<p style="font-size:11px;font-family:Menlo">checking for grep that handles long lines and -e... /usr/bin/grep</p>
<p style="font-size:11px;font-family:Menlo">checking for egrep... /usr/bin/grep -E</p>
<p style="font-size:11px;font-family:Menlo">checking for ANSI C header files... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for sys/types.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for sys/stat.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for stdlib.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for string.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for memory.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for strings.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for inttypes.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for stdint.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking for unistd.h... yes</p>
<p style="font-size:11px;font-family:Menlo">checking size of int *... 8</p>
<p style="font-size:11px;font-family:Menlo">checking malloc.h usability... no</p>
<p style="font-size:11px;font-family:Menlo">checking malloc.h presence... no</p>
<p style="font-size:11px;font-family:Menlo">checking for malloc.h... no</p>
<p style="font-size:11px;font-family:Menlo">checking for gfortran... gfortran</p>
<p style="font-size:11px;font-family:Menlo">checking whether we are using the GNU Fortran 77 compiler... yes</p>
<p style="font-size:11px;font-family:Menlo">checking whether gfortran accepts -g... yes</p>
<p style="font-size:11px;font-family:Menlo">setting F77... gfortran</p>
<p style="font-size:11px;font-family:Menlo">using F90... gfortran</p>
<p style="font-size:11px;font-family:Menlo">setting FFLAGS... -O3 -g -fopenmp</p>
<p style="font-size:11px;font-family:Menlo">setting F90FLAGS... $(FFLAGS) -x f95-cpp-input -fopenmp</p>
<p style="font-size:11px;font-family:Menlo">setting FFLAGS_NOOPT... -O0 -g</p>
<p style="font-size:11px;font-family:Menlo">setting CFLAGS... -O3</p>
<p style="font-size:11px;font-family:Menlo">setting CPP... cpp</p>
<p style="font-size:11px;font-family:Menlo">setting CPPFLAGS... -P -C -traditional</p>
<p style="font-size:11px;font-family:Menlo">setting LD... mpiifort</p>
<p style="font-size:11px;font-family:Menlo">setting LDFLAGS... -g -pthread -fopenmp</p>
<p style="font-size:11px;font-family:Menlo">setting AR... xiar</p>
<p style="font-size:11px;font-family:Menlo">setting ARFLAGS... ruv</p>
<p style="font-size:11px;font-family:Menlo">checking whether make sets $(MAKE)... yes</p>
<p style="font-size:11px;font-family:Menlo">checking whether Fortran files must be preprocessed... no</p>
<p style="font-size:11px;font-family:Menlo">checking host system type... i386-apple-darwin13.4.0</p>
<p style="font-size:11px;font-family:Menlo">checking how to get verbose linking output from gfortran... -v</p>
<p style="font-size:11px;font-family:Menlo">checking for Fortran 77 libraries of gfortran... -L/opt/intel/composer_xe_2015.3.187/compiler/lib -L/opt/intel/composer_xe_2015.3.187/mkl/lib -L/usr/local/Cellar/gcc/5.2.0/lib/gcc/5/gcc/x86_64-apple-darwin13.4.0/5.2.0 -L/usr/local/Cellar/gcc/5.2.0/lib/gcc/5/gcc/x86_64-apple-darwin13.4.0/5.2.0/../../.. -lgfortran -lquadmath -lm</p>
<p style="font-size:11px;font-family:Menlo">checking for dummy main to link with Fortran 77 libraries... none</p>
<p style="font-size:11px;font-family:Menlo">checking for Fortran 77 name-mangling scheme... lower case, underscore, no extra underscore</p>
<p style="font-size:11px;font-family:Menlo">setting BLAS_LIBS... -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">setting LAPACK_LIBS... -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">setting FFT_LIBS... -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">setting MASS_LIBS...</p>
<p style="font-size:11px;font-family:Menlo">checking for library containing mpi_init... no</p>
<p style="font-size:11px;font-family:Menlo">setting MPI_LIBS...</p>
<p style="font-size:11px;font-family:Menlo">checking for library containing mpi_init... (cached) no</p>
<p style="font-size:11px;font-family:Menlo">setting SCALAPACK_LIBS...</p>
<p style="font-size:11px;font-family:Menlo">setting DFLAGS... -D__GFORTRAN -D__STD_F95 -D__FFTW -D__OPENMP</p>
<p style="font-size:11px;font-family:Menlo">setting IFLAGS... -I../include</p>
<p style="font-size:11px;font-family:Menlo">setting FDFLAGS... $(DFLAGS)</p>
<p style="font-size:11px;font-family:Menlo">checking for ranlib... ranlib</p>
<p style="font-size:11px;font-family:Menlo">setting RANLIB... ranlib -c</p>
<p style="font-size:11px;font-family:Menlo">checking for wget... wget -O</p>
<p style="font-size:11px;font-family:Menlo">setting WGET... wget -O</p>
<p style="font-size:11px;font-family:Menlo">configure: creating ./config.status</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating include/fft_defs.h</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating make.sys</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating configure.msg</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating install/make_wannier90.sys</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating install/make_blas.inc</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating install/make_lapack.inc</p>
<p style="font-size:11px;font-family:Menlo">config.status: creating include/c_defs.h</p>
<p style="font-size:11px;font-family:Menlo">config.status: include/c_defs.h is unchanged</p>
<p style="font-size:11px;font-family:Menlo">--------------------------------------------------------------------</p>
<p style="font-size:11px;font-family:Menlo">ESPRESSO can take advantage of several optimized numerical libraries</p>
<p style="font-size:11px;font-family:Menlo">(essl, fftw, mkl...). This configure script attempts to find them,</p>
<p style="font-size:11px;font-family:Menlo">but may fail if they have been installed in non-standard locations.</p>
<p style="font-size:11px;font-family:Menlo">If a required library is not found, the local copy will be compiled.</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">The following libraries have been found:</p>
<p style="font-size:11px;font-family:Menlo"> BLAS_LIBS=-mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo"> LAPACK_LIBS=-mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo"> FFT_LIBS=-mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">Please check if this is what you expect.</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">If any libraries are missing, you may specify a list of directories</p>
<p style="font-size:11px;font-family:Menlo">to search and retry, as follows:</p>
<p style="font-size:11px;font-family:Menlo"> ./configure LIBDIRS="list of directories, separated by spaces"</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">Parallel environment not detected \(is this a parallel machine?\).\</p>
<p style="font-size:11px;font-family:Menlo">Configured for compilation of serial executables.</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">For more info, read the ESPRESSO User's Guide (Doc/users-guide.tex).</p>
<p style="font-size:11px;font-family:Menlo">--------------------------------------------------------------------</p>
<p style="font-size:11px;font-family:Menlo">configure: success</p><div><br></div><div>6.- Edit the make.sys file. This is my end file:</div><div><br></div><div><p style="font-size:11px;font-family:Menlo"># make.sys. Generated from <a href="http://make.sys.in" target="_blank">make.sys.in</a> by configure.</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># compilation rules</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">.SUFFIXES :</p>
<p style="font-size:11px;font-family:Menlo">.SUFFIXES : .o .c .f .f90</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># most fortran compilers can directly preprocess c-like directives: use</p>
<p style="font-size:11px;font-family:Menlo"># $(MPIF90) $(F90FLAGS) -c $<</p>
<p style="font-size:11px;font-family:Menlo"># if explicit preprocessing by the C preprocessor is needed, use:</p>
<p style="font-size:11px;font-family:Menlo"># $(CPP) $(CPPFLAGS) $< -o $*.F90 </p>
<p style="font-size:11px;font-family:Menlo"># $(MPIF90) $(F90FLAGS) -c $*.F90 -o $*.o</p>
<p style="font-size:11px;font-family:Menlo"># remember the tabulator in the first column !!!</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">.f90.o:</p>
<p style="font-size:11px;font-family:Menlo"> $(MPIF90) $(F90FLAGS) -c $<</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># .f.o and .c.o: do not modify</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">.f.o:</p>
<p style="font-size:11px;font-family:Menlo"> $(F77) $(FFLAGS) -c $<</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">.c.o:</p>
<p style="font-size:11px;font-family:Menlo"> $(CC) $(CFLAGS) -c $<</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># topdir for linking espresso libs with plugins</p>
<p style="font-size:11px;font-family:Menlo">TOPDIR = /Users/sqs-ciacyt/espresso-5.1</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># DFLAGS = precompilation options (possible arguments to -D and -U)</p>
<p style="font-size:11px;font-family:Menlo"># used by the C compiler and preprocessor</p>
<p style="font-size:11px;font-family:Menlo"># FDFLAGS = as DFLAGS, for the f90 compiler</p>
<p style="font-size:11px;font-family:Menlo"># See include/defs.h.README for a list of options and their meaning</p>
<p style="font-size:11px;font-family:Menlo"># With the exception of IBM xlf, FDFLAGS = $(DFLAGS)</p>
<p style="font-size:11px;font-family:Menlo"># For IBM xlf, FDFLAGS is the same as DFLAGS with separating commas </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># MANUAL_DFLAGS = additional precompilation option(s), if desired</p>
<p style="font-size:11px;font-family:Menlo"># You may use this instead of tweaking DFLAGS and FDFLAGS</p>
<p style="font-size:11px;font-family:Menlo"># BEWARE: will not work for IBM xlf! Manually edit FDFLAGS</p>
<p style="font-size:11px;font-family:Menlo">MANUAL_DFLAGS = -D__KNC_OFFLOAD</p>
<p style="font-size:11px;font-family:Menlo">DFLAGS = -D__INTEL -D__FFTW -D__MPI -D__PARA -D__SCALAPACK -D__OPENMP $(MANUAL_DFLAGS)</p>
<p style="font-size:11px;font-family:Menlo">FDFLAGS = $(DFLAGS) $(MANUAL_DFLAGS)</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># IFLAGS = how to locate directories where files to be included are</p>
<p style="font-size:11px;font-family:Menlo"># In most cases, IFLAGS = -I../include</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">IFLAGS = -I../include</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># MOD_FLAGS = flag used by f90 compiler to locate modules</p>
<p style="font-size:11px;font-family:Menlo"># Each Makefile defines the list of needed modules in MODFLAGS</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">MOD_FLAG = -I</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># Compilers: fortran-90, fortran-77, C</p>
<p style="font-size:11px;font-family:Menlo"># If a parallel compilation is desired, MPIF90 should be a fortran-90 </p>
<p style="font-size:11px;font-family:Menlo"># compiler that produces executables for parallel execution using MPI</p>
<p style="font-size:11px;font-family:Menlo"># (such as for instance mpif90, mpf90, mpxlf90,...);</p>
<p style="font-size:11px;font-family:Menlo"># otherwise, an ordinary fortran-90 compiler (f90, g95, xlf90, ifort,...)</p>
<p style="font-size:11px;font-family:Menlo"># If you have a parallel machine but no suitable candidate for MPIF90,</p>
<p style="font-size:11px;font-family:Menlo"># try to specify the directory containing "mpif.h" in IFLAGS</p>
<p style="font-size:11px;font-family:Menlo"># and to specify the location of MPI libraries in MPI_LIBS</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">MPIF90 = mpif90</p>
<p style="font-size:11px;font-family:Menlo">#F90 = gfortran</p>
<p style="font-size:11px;font-family:Menlo">CC = icc</p>
<p style="font-size:11px;font-family:Menlo">F77 = ifort</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># C preprocessor and preprocessing flags - for explicit preprocessing, </p>
<p style="font-size:11px;font-family:Menlo"># if needed (see the compilation rules above)</p>
<p style="font-size:11px;font-family:Menlo"># preprocessing flags must include DFLAGS and IFLAGS</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">CPP = cpp</p>
<p style="font-size:11px;font-family:Menlo">CPPFLAGS = -P -C -traditional $(DFLAGS) $(IFLAGS)</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># compiler flags: C, F90, F77</p>
<p style="font-size:11px;font-family:Menlo"># C flags must include DFLAGS and IFLAGS</p>
<p style="font-size:11px;font-family:Menlo"># F90 flags must include MODFLAGS, IFLAGS, and FDFLAGS with appropriate syntax</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">CFLAGS = -O3 $(DFLAGS) $(IFLAGS)</p>
<p style="font-size:11px;font-family:Menlo">F90FLAGS = $(FFLAGS) -x f95-cpp-input -fopenmp $(FDFLAGS) $(IFLAGS) $(MODFLAGS)</p>
<p style="font-size:11px;font-family:Menlo">FFLAGS = -O3 -g -fopenmp</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># compiler flags without optimization for fortran-77</p>
<p style="font-size:11px;font-family:Menlo"># the latter is NEEDED to properly compile dlamch.f, used by lapack</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">FFLAGS_NOOPT = -O0 -g</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># compiler flag needed by some compilers when the main is not fortran</p>
<p style="font-size:11px;font-family:Menlo"># Currently used for Yambo</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">FFLAGS_NOMAIN = </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># Linker, linker-specific flags (if any)</p>
<p style="font-size:11px;font-family:Menlo"># Typically LD coincides with F90 or MPIF90, LD_LIBS is empty</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">LD = mpiifort</p>
<p style="font-size:11px;font-family:Menlo">LDFLAGS = -g -pthread -fopenmp</p>
<p style="font-size:11px;font-family:Menlo">LD_LIBS = </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># External Libraries (if any) : blas, lapack, fft, MPI</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># If you have nothing better, use the local copy :</p>
<p style="font-size:11px;font-family:Menlo"># BLAS_LIBS = /your/path/to/espresso/BLAS/blas.a</p>
<p style="font-size:11px;font-family:Menlo"># BLAS_LIBS_SWITCH = internal</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">BLAS_LIBS = -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">BLAS_LIBS_SWITCH = external</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># If you have nothing better, use the local copy :</p>
<p style="font-size:11px;font-family:Menlo"># LAPACK_LIBS = /your/path/to/espresso/lapack-3.2/lapack.a</p>
<p style="font-size:11px;font-family:Menlo"># LAPACK_LIBS_SWITCH = internal</p>
<p style="font-size:11px;font-family:Menlo"># For IBM machines with essl (-D__ESSL): load essl BEFORE lapack !</p>
<p style="font-size:11px;font-family:Menlo"># remember that LAPACK_LIBS precedes BLAS_LIBS in loading order</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">LAPACK_LIBS = -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo">LAPACK_LIBS_SWITCH = external</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">ELPA_LIBS_SWITCH = disabled</p>
<p style="font-size:11px;font-family:Menlo">SCALAPACK_LIBS = </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># nothing needed here if the the internal copy of FFTW is compiled</p>
<p style="font-size:11px;font-family:Menlo"># (needs -D__FFTW in DFLAGS)</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">FFT_LIBS = -mkl=parallel</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># For parallel execution, the correct path to MPI libraries must</p>
<p style="font-size:11px;font-family:Menlo"># be specified in MPI_LIBS (except for IBM if you use mpxlf)</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">MPI_LIBS = </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># IBM-specific: MASS libraries, if available and if -D__MASS is defined in FDFLAGS</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">MASS_LIBS = </p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># ar command and flags - for most architectures: AR = ar, ARFLAGS = ruv</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">AR = xiar</p>
<p style="font-size:11px;font-family:Menlo">ARFLAGS = ruv</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># ranlib command. If ranlib is not needed (it isn't in most cases) use</p>
<p style="font-size:11px;font-family:Menlo"># RANLIB = echo</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">RANLIB = ranlib -c</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># all internal and external libraries - do not modify</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">FLIB_TARGETS = all</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo">LIBOBJS = ../flib/ptools.a ../flib/flib.a ../clib/clib.a ../iotk/src/libiotk.a </p>
<p style="font-size:11px;font-family:Menlo">LIBS = $(SCALAPACK_LIBS) $(LAPACK_LIBS) $(FFT_LIBS) $(BLAS_LIBS) $(MPI_LIBS) $(MASS_LIBS) $(LD_LIBS)</p>
<p style="font-size:11px;font-family:Menlo;min-height:13px"><br></p>
<p style="font-size:11px;font-family:Menlo"># wget or curl - useful to download from network</p>
<p style="font-size:11px;font-family:Menlo">WGET = wget -O</p></div><div><br></div><div>7.- Build the QE PW binary: make pw -j16</div><div><br></div><div><p style="font-size:11px;font-family:Menlo">test -d bin || mkdir bin</p>
<p style="font-size:11px;font-family:Menlo">cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f extlibs_makefile libiotk</p>
<p style="font-size:11px;font-family:Menlo">cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f extlibs_makefile libelpa</p>
<p style="font-size:11px;font-family:Menlo">cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f extlibs_makefile liblapack</p>
<p style="font-size:11px;font-family:Menlo">cd install ; /Applications/Xcode.app/Contents/Developer/usr/bin/make -f extlibs_makefile libblas</p>
<p style="font-size:11px;font-family:Menlo">if test ! -d ../S3DE; then \</p>
<p style="font-size:11px;font-family:Menlo"><span style="white-space:pre-wrap"> </span>(gzip -dc ../archive/iotk-1.2.beta.tar.gz | (cd ../; tar -xvf -)) ; \</p>
<p style="font-size:11px;font-family:Menlo"><span style="white-space:pre-wrap"> </span>if test -e Makefile_iotk; then \</p>
<p style="font-size:11px;font-family:Menlo"> (cp Makefile_iotk ../S3DE/iotk/src/Makefile); fi; \</p>
<p style="font-size:11px;font-family:Menlo"><span style="white-space:pre-wrap"> </span>if test -e iotk_config.h; then \</p>
<p style="font-size:11px;font-family:Menlo"><span style="white-space:pre-wrap"> </span>(cp iotk_config.h ../S3DE/iotk/include/iotk_config.h); fi; fi</p>
<p style="font-size:11px;font-family:Menlo">touch fake_libelpa.a</p>
<p style="font-size:11px;font-family:Menlo">touch fake_liblapack.a</p>
<p style="font-size:11px;font-family:Menlo">touch fake_libblas.a</p>
<p style="font-size:11px;font-family:Menlo">rm fake_libblas.a</p>
<p style="font-size:11px;font-family:Menlo">cd ../S3DE/iotk/src; /Applications/Xcode.app/Contents/Developer/usr/bin/make lib+util; </p>
<p style="font-size:11px;font-family:Menlo">rm fake_libelpa.a</p>
<p style="font-size:11px;font-family:Menlo">rm fake_liblapack.a</p>
<p style="font-size:11px;font-family:Menlo">mpif90 -O3 -g -fopenmp -x f95-cpp-input -fopenmp -D__INTEL -D__FFTW -D__MPI -D__PARA -D__SCALAPACK -D__OPENMP -D__KNC_OFFLOAD -D__KNC_OFFLOAD -I../include -c iotk_base.f90</p>
<p style="font-size:11px;font-family:Menlo">ifort: command line warning #10155: ignoring option '-x'; argument required</p>
<p style="font-size:11px;font-family:Menlo">ifort: error #10236: File not found: 'f95-cpp-input'</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(20): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#include "iotk_config.h"</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(26): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#include "iotk_auxmacros.h"</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(52): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_maxrank = __IOTK_MAXRANK ! Controlled by cpp</p>
<p style="font-size:11px;font-family:Menlo">--------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(66): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_LOGICAL1</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(68): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(69): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_LOGICAL2</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(67): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_LOGICAL1 = __IOTK_LOGICAL1</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(71): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(72): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_LOGICAL3</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(70): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_LOGICAL2 = __IOTK_LOGICAL2</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(74): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(75): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_LOGICAL4</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(73): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_LOGICAL3 = __IOTK_LOGICAL3</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(77): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(78): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_INTEGER1</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(76): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_LOGICAL4 = __IOTK_LOGICAL4</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(80): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(81): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_INTEGER2</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(79): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_INTEGER1 = __IOTK_INTEGER1</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(83): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(84): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_INTEGER3</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(82): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_INTEGER2 = __IOTK_INTEGER2</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(86): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(87): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_INTEGER4</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(85): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_INTEGER3 = __IOTK_INTEGER3</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(89): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(90): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_REAL1</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(88): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_INTEGER4 = __IOTK_INTEGER4</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(92): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(93): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_REAL2</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(91): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_REAL1 = __IOTK_REAL1</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(95): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(96): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_REAL3</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(94): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_REAL2 = __IOTK_REAL2</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(98): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(99): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_REAL4</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(97): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_REAL3 = __IOTK_REAL3</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(101): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(102): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_COMPLEX1</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(100): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_REAL4 = __IOTK_REAL4</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(104): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(105): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_COMPLEX2</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(103): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_COMPLEX1 = __IOTK_COMPLEX1</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(107): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(108): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_COMPLEX3</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(106): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_COMPLEX2 = __IOTK_COMPLEX2</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(110): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(111): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_COMPLEX4</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(109): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_COMPLEX3 = __IOTK_COMPLEX3</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(113): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(114): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_CHARACTER1</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(112): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_COMPLEX4 = __IOTK_COMPLEX4</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(116): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(117): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_CHARACTER2</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(115): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_CHARACTER1 = __IOTK_CHARACTER1</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(119): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(120): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_CHARACTER3</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(118): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_CHARACTER2 = __IOTK_CHARACTER2</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(122): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(123): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_CHARACTER4</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(121): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_CHARACTER3 = __IOTK_CHARACTER3</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(125): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(124): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_CHARACTER4 = __IOTK_CHARACTER4</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(133): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#ifdef __IOTK_STREAMS</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(130): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_header_kind = __IOTK_HEADER_KIND</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(136): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_record_kind = __IOTK_RECORD_KIND</p>
<p style="font-size:11px;font-family:Menlo">-------------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(139): warning #5117: Bad # preprocessor line</p>
<p style="font-size:11px;font-family:Menlo">#endif</p>
<p style="font-size:11px;font-family:Menlo">-^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(137): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_record_length = __IOTK_RECORD_LENGTH</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(143): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">character, parameter :: iotk_newline = __IOTK_NEWLINE</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(144): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">character, parameter :: iotk_eos = __IOTK_EOS</p>
<p style="font-size:11px;font-family:Menlo">-------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(174): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_maxargs = __IOTK_MAXARGS</p>
<p style="font-size:11px;font-family:Menlo">---------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(260): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_unitmin_def = __IOTK_UNITMIN</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(262): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_unitmax_def = __IOTK_UNITMAX</p>
<p style="font-size:11px;font-family:Menlo">-----------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(264): error #5192: Lead underscore not allowed</p>
<p style="font-size:11px;font-family:Menlo">integer, parameter :: iotk_error_unit_def = __IOTK_ERROR_UNIT</p>
<p style="font-size:11px;font-family:Menlo">--------------------------------------------------------------^</p>
<p style="font-size:11px;font-family:Menlo">iotk_base.f90(266): catastrophic error: Too many errors, exiting</p>
<p style="font-size:11px;font-family:Menlo">compilation aborted for iotk_base.f90 (code 1)</p>
<p style="font-size:11px;font-family:Menlo">make[2]: *** [iotk_base.o] Error 1</p>
<p style="font-size:11px;font-family:Menlo">make[1]: *** [libiotk] Error 2</p>
<p style="font-size:11px;font-family:Menlo">make: *** [libiotk] Error 2</p><p style="font-size:11px;font-family:Menlo"><br></p><p style="font-size:11px;font-family:Menlo"><br></p></div><div>Sorry for the inconvenience. Regards</div><div><font face="Calibri" size="4">M. C. </font><span style="font-family:Calibri;font-size:16pt">Reyna Méndez Camacho.</span></div><br><br><div>> From: <a href="mailto:lorenzo.paulatto@impmc.upmc.fr" target="_blank">lorenzo.paulatto@impmc.upmc.fr</a><br>> To: <a href="mailto:pw_forum@pwscf.org" target="_blank">pw_forum@pwscf.org</a><br>> Date: Mon, 7 Sep 2015 15:39:57 +0200<br>> Subject: Re: [Pw_forum] INSTALL QE ON MAC PRO SIX CORE (INTEL XEON E5)<div><div class="h5"><br>> <br>> On Monday, September 07, 2015 08:00:48 AM reyna mendez camacho wrote:<br>> > Hi good day:<br>> > I am trying to install quantum espresso in a Mac Pro 2013, can you<br>> > recommend some tutorial or modifications to Intel XeonPhi brand ?, but when<br>> > compiling files for errors in libiotk and iotk.f90. Thank you very much<br>> > <br>> > Reyna Méndez Camacho.<br>> <br>> Please be more specific.<br>> <br>> kind regards<br>> <br>> -- <br>> Dr. Lorenzo Paulatto<br>> IdR @ IMPMC -- CNRS & Université Paris 6<br>> +33 (0)1 44 275 084 / skype: paulatz<br>> <a href="http://www.impmc.upmc.fr/~paulatto/" target="_blank">http://www.impmc.upmc.fr/~paulatto/</a><br>> 23-24/4é16 Boîte courrier 115<br>> 4 place Jussieu 75252 Paris Cédex 05<br>> <br>> <br>> _______________________________________________<br>> Pw_forum mailing list<br>> <a href="mailto:Pw_forum@pwscf.org" target="_blank">Pw_forum@pwscf.org</a><br>> <a href="http://pwscf.org/mailman/listinfo/pw_forum" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br></div></div></div></div> </div></div>
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<a href="http://pwscf.org/mailman/listinfo/pw_forum" rel="noreferrer" target="_blank">http://pwscf.org/mailman/listinfo/pw_forum</a><br></blockquote></div><br><br clear="all"><div><br></div>-- <br><div class="gmail_signature">Dr. Axel Kohlmeyer <a href="mailto:akohlmey@gmail.com" target="_blank">akohlmey@gmail.com</a> <a href="http://goo.gl/1wk0" target="_blank">http://goo.gl/1wk0</a><br>College of Science & Technology, Temple University, Philadelphia PA, USA<br>International Centre for Theoretical Physics, Trieste. Italy.</div>
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