[Pw_forum] Gibbs Free energy
Saied Md Pratik
saiedchempratik at gmail.com
Fri Apr 4 13:28:28 CEST 2014
After running QHA (implemented in Quantum espresso) I have got
E_internal,F_vibration, Specific heat (C_v), Entropy etc. Does F_vibration
correspond to Helmholtz free energy? If so, Can anybody please tell me
that how can I calculate Gibbs free energy?
Thanks in advance.
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