[Pw_forum] (no subject)

ashkan shekaari shekaari at gmail.com
Wed Jul 22 21:13:34 CEST 2015


Dear we users
If I import van der Waals correction grimme dftd2 to relaxation of a
system, get relaxed position, then run a scf calculation without this
correction and then run a phonon calculation, is it a right calculation?
Or I have to consider the correction for all calculations?

Kind regards
Ashkan Shekaari
Tell: +98 933 459 7122; +98 921 346 7384
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