[Pw_forum] larger k mesh

Amit Kumar amit76.india at gmail.com
Wed Apr 4 16:48:50 CEST 2007


Respected Users,

This suggestion is to get convreged  lambda for example 7.

*>>> Repeat the calculation with a larger k mesh,
for example, 32x32x32.*


My  confusion :

Where I  have to increase K-points ---- in

 al.scf.in or  al.nscf2.in or in both input files??????


For new version,     in

 al.scf.fit.in   or    al.scf.in or   in both input files??????


 Looking forward to your kind help.

  With best regards,
  Amit
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