[Pw_forum] [Pw_Forum] heat capacity

Wilfredo Ibarra Hernandez wibarrah at gmail.com
Fri Feb 25 03:26:56 CET 2011

Dear all

I'm used the QHA package for Cv calculation in FCC structure and works 
very well. But now I try to use it for a Trigonal R (ibrav = 5) and it's 
not implemented yet in QHA, there is another way to calculate that.

Thanks all.

Ibarra Hernández Wilfredo
Master student in Materials Science
Cinvestav Unidad Quéretaro
Quéretaro, México

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