[Wien] Optimization prior to applying HSE06

[shamik chakrabarti]

Dear Wien2k users,

                         As we know that atomic coordinates can not be
optimized using HSE06, *should we optimize cell shape & coordinates with
GGA, prior to applying HSE06 and then use HSE06 for further optimization of
lattice parameters?*

Any response will be eagerly awaited.

Thanks & Regards,

-- 
Dr. Shamik Chakrabarti
Research Fellow
Department of Physics
Indian Institute of Technology Patna
Bihta-801103
Patna
Bihar, India
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