[Wien] problem in optic BNxP1-x compound

Hajari Nejatii hajar.nejatipoor at yahoo.com
Sat Feb 26 08:29:50 CET 2011



--- On Thu, 2/24/11, Hajari Nejatii <hajar.nejatipoor at yahoo.com> wrote:


From: Hajari Nejatii <hajar.nejatipoor at yahoo.com>
Subject: [Wien] problem in optic
To: "wien2k (for send question)" <wien at zeus.theochem.tuwien.ac.at>
Date: Thursday, February 24, 2011, 7:24 AM







Dear wien2k users and Dr. Blaha
I calculated electronic and structural properties of BNxP(1-x) with x=0.25 (nitrogen impurity of BP), without any problem. Now I am studing about optical properties of this compound. I excute (x lapw2 -fermi -p) without problem. Then I excute (x optic -p) and face with this error:
 
Commandline: x optic -p
Program input is: ""
running OPTIC in parallel mode
[1] 32632
[2] 32638
 OPTIC END
[1]  - Done                          ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >>  ...
[3] 32644
 OPTIC END
[2]  - Done                          ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >>  ...
[4] 32654
 OPTIC END
[3]  - Done                          ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >>  ...
[5] 32660
 OPTIC END
 OPTIC END
[5]  + Done                          ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >>  ...
[4]  + Done                          ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >>  ...
   Summary of opticpara:
   node3  user=7.796  wallclock=8.17
mv: cannot stat `bn.25p.symop_1': No such file or directory
rm: No match.
cat: bn.25p.symmat_1: No such file or directory
cat: bn.25p.mommat_1: No such file or directory
cat: bn.25p.mat_diag_1: No such file or directory
cat: bn.25p.mme_1: No such file or directory
rm: cannot remove `bn.25p.symmat_1': No such file or directory
rm: cannot remove `bn.25p.mommat_1': No such file or directory
rm: cannot remove `bn.25p.mat_diag_1': No such file or directory
rm: cannot remove `bn.25p.mme_1': No such file or directory
tail: cannot open `bn.25p.symmat_2' for reading: No such file or directory
tail: cannot open `bn.25p.mommat_2' for reading: No such file or directory
tail: cannot open `bn.25p.mat_diag_2' for reading: No such file or directory
tail: cannot open `bn.25p.mme_2' for reading: No such file or directory
rm: cannot remove `bn.25p.symmat_2': No such file or directory
rm: cannot remove `bn.25p.mommat_2': No such file or directory
rm: cannot remove `bn.25p.mat_diag_2': No such file or directory
rm: cannot remove `bn.25p.mme_2': No such file or directory
tail: cannot open `bn.25p.symmat_3' for reading: No such file or directory
tail: cannot open `bn.25p.mommat_3' for reading: No such file or directory
tail: cannot open `bn.25p.mat_diag_3' for reading: No such file or directory
tail: cannot open `bn.25p.mme_3' for reading: No such file or directory
rm: cannot remove `bn.25p.symmat_3': No such file or directory
rm: cannot remove `bn.25p.mommat_3': No such file or directory
rm: cannot remove `bn.25p.mat_diag_3': No such file or directory
rm: cannot remove `bn.25p.mme_3': No such file or directory
tail: cannot open `bn.25p.symmat_4' for reading: No such file or directory
tail: cannot open `bn.25p.mommat_4' for reading: No such file or directory
tail: cannot open `bn.25p.mat_diag_4' for reading: No such file or directory
tail: cannot open `bn.25p.mme_4' for reading: No such file or directory
rm: cannot remove `bn.25p.symmat_4': No such file or directory
rm: cannot remove `bn.25p.mommat_4': No such file or directory
rm: cannot remove `bn.25p.mat_diag_4': No such file or directory
rm: cannot remove `bn.25p.mme_4': No such file or directory
tail: cannot open `bn.25p.symmat_5' for reading: No such file or directory
tail: cannot open `bn.25p.mommat_5' for reading: No such file or directory
tail: cannot open `bn.25p.mat_diag_5' for reading: No such file or directory
tail: cannot open `bn.25p.mme_5' for reading: No such file or directory
rm: cannot remove `bn.25p.symmat_5': No such file or directory
rm: cannot remove `bn.25p.mommat_5': No such file or directory
rm: cannot remove `bn.25p.mat_diag_5': No such file or directory
rm: cannot remove `bn.25p.mme_5': No such file or directory
7.820u 0.216s 0:05.90 136.1% 0+0k 0+0io 0pf+0w
 
Please help me to solve this problem.
Thanks alot!


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