Dear Blaha Sir, As My optic.def file as follows:
4, 'case.mommat2' , 'UNKNOWN', 'FORMATTED', 0 5, 'case.inop' , 'OLD', 'FORMATTED', 0 6, 'case.outputop' , 'UNKNOWN', 'FORMATTED', 0 3, 'case.symmat' , 'UNKNOWN', 'FORMATTED', 0 13, 'case.symma1' , 'UNKNOWN', 'FORMATTED', 0 14, 'case.symma2' , 'UNKNOWN', 'FORMATTED', 0 9, 'case.mat_diag' , 'UNKNOWN', 'FORMATTED', 0 10,'case.vectorhf' , 'OLD', 'UNFORMATTED', 0 11,'case.vectorhfdn' , 'UNKNOWN' , 'UNFORMATTED' ,0 18,'case.vsp' , 'OLD', 'FORMATTED', 0 19,'case.vspdn' , 'UNKNOWN' , 'FORMATTED', 0 20,'case.struct' , 'OLD', 'FORMATTED', 0 28,'case.inso' , 'UNKNOWN', 'FORMATTED' , 0 24,'case.mme' , 'UNKNOWN', 'FORMATTED', 0 25,'case.symop' , 'UNKNOWN', 'FORMATTED', 0 30,'case.inc', 'UNKNOWN', 'formatted',0 35,'case.corewf', 'UNKNOWN','formatted',0 36,'case.corewfdn', 'UNKNOWN','formatted',0 40,'case.pmat', 'UNKNOWN', 'FORMATTED', 0 So how can I correct it? Regards Peeyush Kumar Kamlesh On Mon, Sep 23, 2019 at 9:42 AM Peeyush kumar kamlesh < peeyush.physik....@gmail.com> wrote: > Sir, > Greetings! > I am trying to calculate optical properties of a semiconducting material > with hf potentials. After running scf cycles by hf potential, I generated a > new k-mesh with the given procedure in user guide. Then I run "x lapw2 > -fermi -hf -p" in the terminal. Which was followed by editing .inop file. > Then I am trying to run "x optic -c -hf -p". And encountered by following > errors: > > ________________________________________________________ > > x optic -c -hf -p > > running OPTIC in parallel mode > > [1] 10649 > > [2] 10654 > > [3] 10659 > > [4] 10664 > > 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 > > touch: cannot touch '/Case.symmat': Permission denied > > touch: cannot touch '/Case.mommat2': Permission denied > > touch: cannot touch '/Case.mat_diag': Permission denied > > touch: cannot touch '/Case.mme': Permission denied > > /Case.symmat: Permission denied. > > /Case.symma1: Permission denied. > > /Case.symma2: Permission denied. > > /Case.mat_diag: Permission denied. > > /Case.mme: Permission denied. > > 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 > > /Case.symmat: Permission denied. > > /Case.symma1: Permission denied. > > /Case.symma2: Permission denied. > > /Case.mat_diag: Permission denied. > > /Case.mme: Permission denied. > > 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 > > /Case.symmat: Permission denied. > > /Case.symma1: Permission denied. > > /Case.symma2: Permission denied. > > /Case.mat_diag: Permission denied. > > /Case.mme: Permission denied. > > 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 > > /Case.symmat: Permission denied. > > /Case.symma1: Permission denied. > > /Case.symma2: Permission denied. > > /Case.mat_diag: Permission denied. > > /Case.mme: Permission denied. > > 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 > > 17.9u 0.1s 0:05.51 329.2% 0+0k 0+5912io 0pf+0w > > __________________________________________________________ > > > > Kindly suggest me how can I resolve this issue. > > Thank You! > > > Regards > > Peeyush Kumar Kamlesh >
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