[Pw_forum] Regarding Vdw interactions
konda.physics at gmail.com
Wed Feb 1 07:31:54 CET 2012
I have confusion on implementation of grimme (london = .true.) in DFT. Is
it valid only for ground state or at high pressures also????
Please give clarification for me to do High pressure structral transitions
using grimme correction to PBE is how much valid?????
I expect favorable reply
Thanks in advance
University of Hyderabad
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