On Fri, May 27, 2016 at 11:12:30AM -0400, Wangwei Lan wrote:
> Dear WIEN2K user,
>
> Can you tell me how to extract lattice parameter as a function of pressure?
> I didn't find it in case.eosfit as mentioned here
> http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg04276.html
If
Can you tell me how to extract lattice parameter as a function of pressure?
I didn't find it in case.eosfit as mentioned here
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg04276.html
It would be trivial to do this for a crystal that is entirely determined
by the volume
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