[Pw_forum] Resuming Electron-phonon calculations after calculation's unintentional end

Hüseyin Yasin Uzunok hyuzunok at sakarya.edu.tr
Sat Apr 30 10:57:53 CEST 2016


Dear All,
While I was calculating dynamical matrices an accident has occured and i
ended unintentionally at the 25th mode. So I need to resume  the
calculation where it ended before, but i couldn't find it how. Could you
help me to resume the calculation? My input file is mentioned below.
Yours.





cat > elph.in <<EOF
el-phonons in  La
 &inputph
   tr2_ph=1.0d-14,
   alpha_mix(1)=0.200,
   prefix='La'
   fildvscf='La.dv',
   trans=.true.,
   electron_phonon='interpolated',
   el_ph_sigma=0.002,
   el_ph_nsigma=10,
   amass(1)= 138.910000,
     outdir='$HOME/murx/La/'
   fildyn='La.dyn5'
 /
0.250000000000000E+00  -0.500000000000000E+00   0.108648413733159E+00


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*Arş. Gör. H. Yasin UZUNOK*


*Sakarya Üniversitesi Fizik Bölümü*
*tel:0.264.295 6192*
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