[Wien] LDA-Fock alpha hybrid functional

hajar.nejatipoor at yahoo.com hajar.nejatipoor at yahoo.com
Sun May 23 08:17:16 CEST 2021


Hello,
I have a question about hybrid functionals in Wien2k.As written in user guide, there are two possible choices for alpha parameter in LDA-Fock alpha hybrid functional, alpha=0.35 and alpha=0.5.I want to know, is it possible to select different alpha values in LDA-Fock alpha functional or not?
Thank you for your response in advance.
Bests
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