<html><head></head><body style="word-wrap: break-word; -webkit-nbsp-mode: space; -webkit-line-break: after-white-space; "><div>Hello,</div><div><br></div><div><blockquote type="cite">Hello everyone,<br><br>I'm confronting a probably stupid problem with cppp.x! I saw this problem being reported two times in the forum:<br><br><a href="http://www.democritos.it/pipermail/pw_forum/2011-February/019298.html" target="_blank">http://www.democritos.it/pipermail/pw_forum/2011-February/019298.html</a><br>
<br><a href="http://www.democritos.it/pipermail/pw_forum/2008-May/009020.html" target="_blank">http://www.democritos.it/pipermail/pw_forum/2008-May/009020.html</a><br><br></blockquote><div><br></div><div>I think the second link here above is not related to your error message.</div><br><blockquote type="cite">Having read those, I'm still getting the following error:<br>
<br>
Cannot open file ....espresso/out/cp_51.save/data-file.xml<br><br>I checked the corresponding address, and the files are there!<br>and I also renamed the save directory and files to match the default cp_51 and .....<br><br>
<br>This is my input file for cppp.x:<br><br><br>&INPUTPP<br>! prefix=Anatase,<br> fileout=out,<br> output=xsf,<br> outdir=..mypath../espresso/out,<br></blockquote><div><br></div><div>outdir should be a fortran string, that is to say that you have to enclose the path within quotation marks ( " or ' ).</div><div><br></div><blockquote type="cite"> wfcdir=..mypath../espresso/out,<br></blockquote><div><br></div><div>This variable is not in the namelist, so you should get another error message from the code when the input is read.</div><div>Is this really the input file you used?</div><br><blockquote type="cite"> lrotation,<br> ns1, ns2, ns3,<br> np1, np2, np3,<br></blockquote><div><br></div><div>Also these three lines above (and many others below) would make the code complain. Inside a namelist you have to stick to the list-directed syntax of F90, i.e.</div><div>variable = value,</div><div>where variable is one of those listed here:</div><div><a href="http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_CPPP.html">http://www.quantum-espresso.org/wp-content/uploads/Doc/INPUT_CPPP.html</a></div><div><br></div><div><br></div><div>HTH</div><div><br></div><div><br></div><div>GS</div></div><br><div>
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