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Thanks very much..That was a stupid mistake to do.<BR>
<BR>
Regards<BR>
<BR>
Elie<BR> <BR>
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From: sclauzer@sissa.it<BR>To: pw_forum@pwscf.org<BR>Date: Fri, 4 Jun 2010 15:34:45 +0200<BR>Subject: Re: [Pw_forum] error 208, reading namelist cell<BR><BR>Dear Elie,
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<DIV> the / should go at the end of each namelist, not at the beginning. The F90 standard prescribes that a namelist named, for instance, TEST, can be accessed with</DIV>
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<DIV>&TEST</DIV>
<DIV>...</DIV>
<DIV>/ </DIV>
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<DIV>or</DIV>
<DIV><BR></DIV>
<DIV>&TEST</DIV>
<DIV>...</DIV>
<DIV>&END</DIV>
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<DIV>The namelist "cell" has not been closed in your example.</DIV>
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<DIV>HTH</DIV>
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<DIV>GS</DIV>
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<DIV>Il giorno 04/giu/10, alle ore 15:25, Elie Moujaes ha scritto:</DIV><BR class=ecxApple-interchange-newline>
<BLOCKQUOTE><SPAN class=ecxApple-style-span style="WORD-SPACING: 0px; FONT: medium Helvetica; TEXT-TRANSFORM: none; COLOR: rgb(0,0,0); TEXT-INDENT: 0px; WHITE-SPACE: normal; LETTER-SPACING: normal; BORDER-COLLAPSE: separate">
<DIV class=ecxhmmessage style="FONT-SIZE: 10pt; FONT-FAMILY: Verdana">Dear All,<BR> <BR>I am trying to relax a system using vc-relax and I am getting the following error:<BR> <BR><FONT size=4>From read_namelists : error # 1</FONT><BR><FONT size=4>reading namelist cell....</FONT><BR> <BR>I have checked that the input is missing and that &ions precedes &cell in the input. Part of the input is below..Thanks<BR> <BR>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>/</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>&system<SPAN> </SPAN></FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>ibrav=<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0, celldm(1) =1.88972, nat=60, ntyp= 1, ecutwfc = 110D0 ,occupations='smearing', smearing='methfessel-paxton', degauss=0.01</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>/</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>&electrons</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>conv_thr=1.D-8,<SPAN> </SPAN></FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN><SPAN> </SPAN>mixing_beta=0.05D0,</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>mixing_mode='local-TF',</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>diagonalization='david'</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>/</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>&ions</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>ion_dynamics = 'bfgs',</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>pot_extrapolation = 'second-order',</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>wfc_extrapolation = 'second-order'</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>/</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>&cell</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>cell_dynamics = 'bfgs',</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>press_conv_thr = 0.1</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3> </FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>CELL_PARAMETERS hexagonal</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3> </FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>24.527679<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0.000000<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0.000000</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>0.000003<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>6.614491<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0.000000</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>0.000000<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN><SPAN> </SPAN>0.000000<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>10.000000</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3> </FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>ATOMIC_SPECIES</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>C<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>12.0107<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>C.pz-vbc.UPF</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3>ATOMIC_POSITIONS angstrom</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>C<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>-11.737980<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>-3.561278<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0.000000</FONT></SPAN></DIV>
<DIV style="PADDING-RIGHT: 0px; PADDING-LEFT: 0px; MARGIN-BOTTOM: 0pt; PADDING-BOTTOM: 0px; MARGIN-LEFT: 0in; MARGIN-RIGHT: 0in; PADDING-TOP: 0px"><SPAN lang=EN-GB style="FONT-FAMILY: 'Courier New'"><FONT size=3><SPAN> </SPAN>C<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>-11.057718<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>-1.211571<SPAN> <SPAN class=ecxApple-converted-space> </SPAN></SPAN>0.000000</FONT></SPAN></DIV>.......<BR>..............<BR> <BR>Elie Moujaes<BR>University of Nottingham<BR>NG7 2RD<BR>UK<BR> <BR><BR>
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