On Tue, 2014-09-09 at 18:18 -0300, Osmair Vital Osmair wrote: > Dear user, > I have performed scf calculation for Ti and after I run ph.x with the > input: > Electron-phonon coefficients for Ti > &inputph > tr2_ph=1.0d-10, > prefix='Ti', > fildvscf='aldv', > amass(1)=47.88, > outdir='./', > fildyn='Ti.dyn', > electron_phonon='interpolated', > trans=.true., > ldisp=.true. > nq1=4, nq2=4, nq3=4 > / > $ mpirun -n 8 ph.x < Ti.elph.in > Ti.elph.out & > > > However the calculation stop without error message and only the > Ti.dyn0 and Ti.dyn1 are generated. The end of Ti.elph.out file is > > omega( 3 - 3) = 162.3 [cm-1] --> A I+R > electron-phonon interaction ... > > > Why this occur? and how can I solve this?
it's a little bit difficult to answer such questions with so little information. You might have exceeded time limits; memory limits; disk limits; you might have encountered an error that is not shown in output file (an event not uncommon in parallel execution); hardware failure (or somebody turned your machine off); ... You may try to run the phonon code without the calculation of electron-phonon coefficients, just to figure out if that is the source of the problem Paolo > > Thanks, > Osmair V. Oliveira > Brazil > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum -- Paolo Giannozzi, Dept. Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
