Missing files from cluster + files necessary for H2S calculations#1
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paulboone wants to merge 7 commits intoWilmerLab:sensor_array_mof_adsorptionfrom
Open
Missing files from cluster + files necessary for H2S calculations#1paulboone wants to merge 7 commits intoWilmerLab:sensor_array_mof_adsorptionfrom
paulboone wants to merge 7 commits intoWilmerLab:sensor_array_mof_adsorptionfrom
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…e presence of H2S
…g) in order to run simulation correctly
…n H2S containing gas mixtures
… the molecules description
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This PR includes a number of files that I think were supposed to be part of this repo in order to allow the sensor_array_mof_adsorption code to run. Also includes new files specific to running H2S calculations, which MAYBE should be part of a different PR or branch.