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Supporting Information RASPA3: A Monte Carlo Code for Computing Adsorption and Diffusion in Nanoporous Materials and Thermodynamics Properties of Fluids

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The supplementary material contains simulation results on adsorption of methane and CO2 in MFI, an equimolar mixture of CO2 and N2 in MFI, adsorption of CO2 in Cu-BTC, a Gibbs VLE simulation of methane, and diffusivity results on small gas molecules in IRMOF-1.

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2024-09-16
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