I am running wien version WIEN2k_11.1 (Release 14/6/2011) on a machine with operating system Centos 5.5, fortran compiler ifort 11.1<br><br><a>The SCF cycle ran <b><i>correctly</i></b>, but when i try to get the optic properties using the x optic -p command, throws the following <i><b>errors</b></i>.</a><br>
<br><pre>running OPTIC in parallel mode<br>[1] 3449<br> OPTIC END<br>[1] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...<br>[1] 3455<br> OPTIC END<br>[1] + Done ( cd $PWD; $t $exe ${def}_${loop}.def; rm -f .lock_$lockfile[$p] ) >> ...<br>
Summary of opticpara:<br> localhost user=0 wallclock=20358<br>cat: TiC.symmat_1: No such file or directory<br>cat: TiC.mommat_1: No such file or directory<br>cat: TiC.mat_diag_1: No such file or directory<br>cat: TiC.mme_1: No such file or directory<br>
rm: cannot remove `TiC.symmat_1': No such file or directory<br>rm: cannot remove `TiC.mommat_1': No such file or directory<br>rm: cannot remove `TiC.mat_diag_1': No such file or directory<br>rm: cannot remove `TiC.mme_1': No such file or directory<br>
tail: cannot open `TiC.symmat_2' for reading: No such file or directory<br>tail: cannot open `TiC.mommat_2' for reading: No such file or directory<br>tail: cannot open `TiC.mat_diag_2' for reading: No such file or directory<br>
tail: cannot open `TiC.mme_2' for reading: No such file or directory<br>rm: cannot remove `TiC.symmat_2': No such file or directory<br>rm: cannot remove `TiC.mommat_2': No such file or directory<br>rm: cannot remove `TiC.mat_diag_2': No such file or directory<br>
rm: cannot remove `TiC.mme_2': No such file or directory<br>0.308u 0.175s 0:02.29 20.5% 0+0k 0+0io 16pf+0w<br></pre><br><br>The compilation options are shown below<br><br>current:FOPT:-FR -mp1 -w -prec_div -pc80 -pad -align -DINTEL_VML -traceback -I/opt/intel/mkl/<a href="http://10.2.6.038/include">10.2.6.038/include</a><br>
current:FPOPT:$(FOPT)<br>current:LDFLAGS:$(FOPT) -L/opt/intel/mkl/<a href="http://10.2.6.038/lib/em64t">10.2.6.038/lib/em64t</a><br>current:DPARALLEL:'-DParallel'<br>current:R_LIBS:-lmkl_lapack -lmkl_sequential -lmkl_core -lmkl_intel_lp64 -lguide<br>
current:RP_LIBS:-lmkl_scalapack_lp64 -lmkl_solver_lp64 -lmkl_blacs_lp64 -L/usr/local/FFTW/lib -lfftw_mpi -lfftw $(R_LIBS)<br>current:MPIRUN:mpirun -np _NP_ -machinefile _HOSTS_ _EXEC_<br><br clear="all"><br>-- <br>M.I. Rodrigo Domínguez García<br>
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