Updated OpenMKM IO functionality

VlachosGroup / pMuTT

Python Multiscale Thermochemistry Toolbox (pMuTT)

https://vlachosgroup.github.io/pMuTT/

41 stars 23 forks source link

Updated OpenMKM IO functionality #148

Closed jonlym closed 4 years ago

jonlym commented 4 years ago

Added option to change activation function for adsorption reactions. By default, beta will be set to 0 for adsorption, 1 for surface reactions. Updated omkm example