<div dir="ltr"><div class="gmail_default" style="font-family:verdana,sans-serif;color:#000000">Wien2k is setup so that the name of the directory you are using, what we call the "case", provides information about the specific problem. For example, if one is performing calculations on titanium carbide, the standard approach would be to use "TiC" for the name of the directory. Then TiC.struct would be the structure file etc.</div><div class="gmail_default" style="font-family:verdana,sans-serif;color:#000000"><br></div><div class="gmail_default" style="font-family:verdana,sans-serif;color:#000000">From what you just sent it appears that the name of your directory at some time was "case", and at another time was "KScC". You can't do this. You need to ensure that you have just one name, and it is the directory name.</div><div class="gmail_default" style="font-family:verdana,sans-serif;color:#000000"><br></div><div class="gmail_default" style="font-family:verdana,sans-serif;color:#000000">This seems to be an error in your use of linux and organization -- my guess.</div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Feb 14, 2020 at 11:44 AM Peeyush kumar kamlesh <<a href="mailto:peeyush.physik.rku@gmail.com">peeyush.physik.rku@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr">Sir,<div>Greetings!<br><div>Problem still exists. Error is appearing during running JOINT. Details of optic.def file as follows:</div></div><div><br></div><div>
<p style="margin-bottom:0cm;line-height:100%">4, './case.mommat2'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">5, 'case.inop' ,
'OLD', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">6, 'case.outputop' ,
'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">3, './case.symmat'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">13, './case.symma1'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">14, './case.symma2'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">9, './case.mat_diag'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">10,'./case.vector'
, 'OLD', 'UNFORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">11,'./case.vectordn'
, 'UNKNOWN' , 'UNFORMATTED' ,0</p>
<p style="margin-bottom:0cm;line-height:100%">18,'case.vsp' ,
'OLD', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">19,'case.vspdn'
, 'UNKNOWN' , 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">20,'case.struct' ,
'OLD', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">28,'case.inso' ,
'UNKNOWN', 'FORMATTED' , 0</p>
<p style="margin-bottom:0cm;line-height:100%">24,'./case.mme'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">25,'case.symop'
, 'UNKNOWN', 'FORMATTED', 0</p>
<p style="margin-bottom:0cm;line-height:100%">30,'case.inc',
'UNKNOWN', 'formatted',0</p>
<p style="margin-bottom:0cm;line-height:100%">35,'case.corewf',
'UNKNOWN','formatted',0</p>
<p style="margin-bottom:0cm;line-height:100%">36,'case.corewfdn',
'UNKNOWN','formatted',0</p>
<p style="margin-bottom:0cm;line-height:100%">40,'case.pmat',
'UNKNOWN', 'FORMATTED', 0</p></div><div><br></div><div>Kindly help me in solving this issue. </div><div>Best regards!</div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Feb 14, 2020 at 5:41 PM Peeyush kumar kamlesh <<a href="mailto:peeyush.physik.rku@gmail.com" target="_blank">peeyush.physik.rku@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div> Dear Blaha Sir,</div><div>When I run JOINT it is showing following error:</div><div><br></div><div>'JOINT' - can't open unit: 3 </div> 'JOINT' - filename: ./KScC.symmat <br><div> 'JOINT' - status: OLD form: FORMATTED <br></div><div><br></div><div><br></div><div>Best Regards </div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Feb 14, 2020 at 12:07 AM Peeyush kumar kamlesh <<a href="mailto:peeyush.physik.rku@gmail.com" target="_blank">peeyush.physik.rku@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr">Dear Sir,<br><div>Thank you so much for you kind reply. I did not try joint. If it looks OK then i can try for joint and kram.</div><div><br></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Thu, Feb 13, 2020 at 11:42 PM Peeyush kumar kamlesh <<a href="mailto:peeyush.physik.rku@gmail.com" target="_blank">peeyush.physik.rku@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div>Dear Blaha Sir and Gavin Sir,</div><div>I am using WIEN2k_19.1. I read the previous problems. But I am unable to find out the solution of my problem. Kindly look into it</div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Thu, Feb 13, 2020 at 1:16 AM Peeyush kumar kamlesh <<a href="mailto:peeyush.physik.rku@gmail.com" target="_blank">peeyush.physik.rku@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex"><div dir="ltr"><div>Sir,</div><div>When I run the following command, I get error in its execution. Error is as follows:<br></div><div><br></div><div>Commandline: <b>x optic -p </b><br>
Program input is: <b>""</b></div><div>
<span></span>
<pre>running OPTIC in parallel mode
[1] 5101
[2] 5108
[3] 5132
[4] 5137
OPTIC END
OPTIC END
OPTIC END
OPTIC END
[4] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...
[3] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...
[2] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...
[1] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...
Summary of opticpara:
localhost user=0 wallclock=40716
cat: .case.symmat_1: No such file or directory
cat: .case.symma1_1: No such file or directory
cat: .case.symma2_1: No such file or directory
cat: .case.mat_diag_1: No such file or directory
cat: .case.mme_1: No such file or directory
rm: cannot remove '.case.symmat_1': No such file or directory
rm: cannot remove '.case.mat_diag_1': No such file or directory
rm: cannot remove '.case.mme_1': No such file or directory
tail: cannot open '.case.symmat_2' for reading: No such file or directory
tail: cannot open '.case.symma1_2' for reading: No such file or directory
tail: cannot open '.case.symma2_2' for reading: No such file or directory
tail: cannot open '.case.mat_diag_2' for reading: No such file or directory
tail: cannot open '.case.mme_2' for reading: No such file or directory
rm: cannot remove '.case.symmat_2': No such file or directory
rm: cannot remove '.case.mat_diag_2': No such file or directory
rm: cannot remove '.case.mme_2': No such file or directory
tail: cannot open '.case.symmat_3' for reading: No such file or directory
tail: cannot open '.case.symma1_3' for reading: No such file or directory
tail: cannot open '.case.symma2_3' for reading: No such file or directory
tail: cannot open '.case.mat_diag_3' for reading: No such file or directory
tail: cannot open '.case.mme_3' for reading: No such file or directory
rm: cannot remove '.case.symmat_3': No such file or directory
rm: cannot remove '.case.mat_diag_3': No such file or directory
rm: cannot remove '.case.mme_3': No such file or directory
tail: cannot open '.case.symmat_4' for reading: No such file or directory
tail: cannot open '.case.symma1_4' for reading: No such file or directory
tail: cannot open '.case.symma2_4' for reading: No such file or directory
tail: cannot open '.case.mat_diag_4' for reading: No such file or directory
tail: cannot open '.case.mme_4' for reading: No such file or directory
rm: cannot remove '.case.symmat_4': No such file or directory
rm: cannot remove '.case.mat_diag_4': No such file or directory
rm: cannot remove '.case.mme_4': No such file or directory
145.7u 3.8s 1:48.68 137.6% 0+0k 5932576+404504io 35pf+0w<br><br></pre><pre>Kindly suggest the solution.<br><br></pre><pre>Best regards! <br></pre>
</div></div>
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</blockquote></div><br clear="all"><div><br></div>-- <br><div dir="ltr" class="gmail_signature"><div dir="ltr">Professor Laurence Marks<br>Department of Materials Science and Engineering<br>Northwestern University<br><a href="http://www.numis.northwestern.edu/" target="_blank">www.numis.northwestern.edu</a><div>Corrosion in 4D: <a href="http://www.numis.northwestern.edu/MURI" target="_blank">www.numis.northwestern.edu/MURI</a><br>Co-Editor, Acta Cryst A<br>"Research is to see what everybody else has seen, and to think what nobody else has thought"<br>Albert Szent-Gyorgi</div></div></div>