[Wien] Fraction of exact exchange for a full hybrid calculation

[Wahid Kamal]

Thank you Prof. Laurence Marks

I want to study a material from where I have only the cell parameter that
is known, how to estimate alpha in this case?

2017-12-01 22:07 GMT+01:00 Wahid Kamal <kamal.wahhid at gmail.com>:

> Dear wien2k users;
>
> how to choose the fraction of exact exchange for a full hybrid calculation?
> can it take an alpha = 1 value for more precision?
>
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20171201/532e47fe/attachment.html>