CB/CFC Monte Carlo Input File

[hooman]

Dear Prof. Dubbeldam, all,

I want to simulate adsorption in MOFs using CB/CFCMC ensemble, but I'm not sure if I'm doing it the right way.
I have done it with the following settings, but although the number of cycles are relatively large and I've done a similar simulation with GCMC, I still see points in the isotherm where the uptake is not consistently increasing with partial pressure and it's at points lower than CBGCMC uptake.

Thank you very much.
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