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<DIV><FONT face="B Lotus" size=4>Dear Gabriele,</FONT></DIV>
<DIV><FONT face="B Lotus" size=4>Thank you for your reply.
"vc-relax"+"cell_dofree="z"" work fine. I have to examine a little bit more to
explore more details.</FONT></DIV>
<DIV><FONT face="B Lotus" size=4>Cheers,</FONT></DIV>
<DIV><FONT face="B Lotus" size=4>mahmoud</FONT></DIV>
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<DIV><FONT face="B Lotus" size=4></FONT><BR></DIV>
<DIV><BR></DIV>I don't see any point in doing a vc-relax with cell_dofree="z"
for a slab with the surface plane perpendicular to the z axis (as it was in
your first output file, if I understood correctly)... What's your real aim?
<DIV><BR></DIV>
<DIV><BR></DIV>
<DIV>GS<BR>
<DIV><BR></DIV>
<DIV><BR>
<DIV>
<DIV>Il giorno 25/nov/2010, alle ore 08.43, Mahmoud Payami ha
scritto:</DIV><BR class=Apple-interchange-newline>
<BLOCKQUOTE type="cite">
<DIV>Dear Stefano,<BR>Thank you. I followed your suggestion and it worked
perfect.<BR>Cheers,<BR>mahmoud<BR><BR><BR>
<BLOCKQUOTE type="cite">Dear Mahmoud Payami,<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"> are you specifing calc='vc-relax' in the
&control namelist ?<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"> otherwise the code will skip the CELL
part.<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"> I thnk that one should specify
cell_dofree="z" (with z into quotation <BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite">marks)<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"><BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite">stefano<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"><BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite">Quoting Mahmoud Payami <<A
href="mailto:mpayami@aeoi.org.ir">mpayami@aeoi.org.ir</A>>:<BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite"><BR></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">Dear Eyvaz,<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">Thank you very much for "cell_dofree" switch. I
looked at INPUT_PW<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">and added "cell_dofree=z" in the &CELL
namelist but in the output<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">file I noticed that it is ignored with the
message:<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">Warning: card &CELL
ignored<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">Warning: card CELL_DOFREE=z
ignored<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite"><BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">Am I committing a mistake in using
that?<BR></BLOCKQUOTE></BLOCKQUOTE>
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<BLOCKQUOTE type="cite">Bests,<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">mahmoud<BR></BLOCKQUOTE></BLOCKQUOTE>
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<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite"> If you mean changes only along Z-direction
add cell_dofree=z. For<BR></BLOCKQUOTE></BLOCKQUOTE>
<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite">ore info please have a look at
INPUT_PW,txt in /Doc.<BR></BLOCKQUOTE></BLOCKQUOTE>
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<BLOCKQUOTE type="cite">
<BLOCKQUOTE type="cite"> Bests,<BR></BLOCKQUOTE></BLOCKQUOTE>
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<BLOCKQUOTE type="cite"> Eyvaz.<BR></BLOCKQUOTE></BLOCKQUOTE>
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<DIV><SPAN class=Apple-style-span
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class=Apple-interchange-newline>§ Gabriele Sclauzero, EPFL SB ITP
CSEA</SPAN></DIV>
<DIV><FONT class=Apple-style-span color=#7e7e7e><I> PH H2 462,
Station 3, CH-1015 Lausanne</I></FONT></DIV></SPAN></DIV><BR></DIV></DIV>
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