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VlachosGroup / pMuTT

Python Multiscale Thermochemistry Toolbox (pMuTT)
https://vlachosgroup.github.io/pMuTT/
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Pressure dependence for Empirical objects #76

Closed jonlym closed 4 years ago

jonlym commented 5 years ago

Currently, pmutt.empirical.nasa.Nasa and pmutt.empirical.shomate.Shomate only evaluate properties as a function of temperature. However, we could add a pressure dependence for gas-phase species:

S(T, P) = S(T, P=1 bar) - R ln(P/1 bar)