[Wien] Whether Hartree-Fock exchange Alpha is a tunable parameter?

[shamik chakrabarti]

Dear Wien2k users,

                         Whether Hartree-Fock exchange Alpha is a tunable
parameter? Can we change the parameter to see that at which value of Alpha,
the experimental result matches with simulation? Especially when with
Alpha=0.25 the calculation diverges!

Looking forward to hearing from you.

with regards

-- 
Dr. Shamik Chakrabarti
Research Fellow
Department of Physics
Indian Institute of Technology Patna
Bihta-801103
Patna
Bihar, India
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20230131/f2c373b3/attachment.htm>