Dear Wien2k users,
We know XC_SCAN is a very useful potential for calculating
total energy / electronic structure for chalcogenides. However, whether
HSE06 would be equally useful?
If yes, then how? as we know that HSE06 considers exact exchange but do not
include the Vanderwall Interaction.
Looking forward to your response.
with regards,
--
Dr. Shamik Chakrabarti
Research Fellow
Department of Physics
Indian Institute of Technology Patna
Bihta-801103
Patna
Bihar, India
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