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Grand Canonical Monte Carlo (GCMC)

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2 results in Keywords: Grand Canonical Monte Carlo (GCMC)

Chemical Engineering and Industrial Chemistry

A Robust Framework for Generating Adsorption Isotherms to Screen Materials for Carbon Capture

Elias Moubarak, Seyed Mohamad Moosavi, Charithea Charalambous, Susana Garcia, Berend Smit

Version 1 posted 26 April 2023

447

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Theoretical and Computational Chemistry

Methane Adsorption Isotherms for MOF Structures from the PrISMa Database

Elias Moubarak, Susana Garcia, Berend Smit

Version 1 posted 26 June 2024

241

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