[Pw_forum] help regarding fqha.x
bramha pandey
pandey.bramha at gmail.com
Sat Jan 28 15:11:40 CET 2012
Good evening to all QE users
I wanted to calculate the thermodynamical property of system using QE. i
was trying to use fqha.x code which was giving only free energy at each
temperature. but i require other properties of thermodynamic like cv,
internal energy etc. how can i get other properties of thermodynamic using
fqha.x.
Thanks in advanced for your valuable comments.
--
Thanks and Regards
Bramha Prasad Pandey
Assistant Professor (Electronics and Communication Engg)
GLA Group of Institutions, Mathura.
Ph. No. 08954143009
email id pandey.bramha at gmail.com
bpglaitm at yahoo.co.in
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