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Allow spreadsheet entry for species with an emperical relationship (NASA, NASA9, Shomate) #186

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wittregr opened this issue Mar 16, 2021 · 0 comments
Open

Allow spreadsheet entry for species with an emperical relationship (NASA, NASA9, Shomate) #186

wittregr opened this issue Mar 16, 2021 · 0 comments
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Current spreadsheet entries support ab initio data from DFT simulations. pMuTT can also use empirical relationships (NASA, NASA9, Shomate) when creating input files for Chemkin (thermdat) or openMKM (therm.xml).

Allow spreadsheet entry of empirical relationships for some/all species in the reaction mechanism
@wittregr wittregr added the enhancement New feature or request label Mar 16, 2021
@wittregr wittregr self-assigned this Mar 16, 2021
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