[QE-users] how to get data.save for yambo code using qe-6.3

foudil zaabar foufou191085 at hotmail.fr
Sat Nov 17 14:48:10 CET 2018


dear all

can any one help me  to know how to get data.save for yambo code  using qe-6.3

i want to calculat scf and nscf using qe-6.3, to get the data base ""prefix.save ""  for yambo calculation but

i have got only the wavefunction without the k points (eigenvalues)

  i used the following flags in the control namelist

for scf

&CONTROL
  calculation = 'scf',
  pseudo_dir  = '/local/funsilab/karim/foud/outil',
  restart_mode='from_scratch',
  prefix='mose2',
  outdir      = './test',
  etot_conv_thr = 1.0D-6
  verbosity = 'high' ,

#### for nscf###""
/
calculation = 'nscf',
  pseudo_dir  = "/local/funsilab/karim/foud/outil",
  restart_mode='from_scratch',
  prefix='mose2',
  outdir      = './test',
  etot_conv_thr = 1.0D-6
  wf_collect= .true.
  verbosity = 'high' ,
############
knowing, that i have used the same input for  qe-5.4.0 but have gote the point k and the wavefunction

best regards

zaabar foudil
university of bejaia
algeria

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