[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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