SMF - Just Installed!

Main Menu

MC and adsorption capacity

Started by YadiJiang, October 02, 2021, 03:47:37 PM

Previous topic - Next topic


Hi Prof. Dubbeldam,

When using Monte Carlo method to carry out a simulation, i can gaint 'average loading absolute' and 'average loading excess' of absorbate. However i don't know the theory of obtaining the adsorption capacity by Monte Carlo method. What is the theory of this process, or what can I learn to understand the theory?

Thank you,

David Dubbeldam

Search for books and literature on grand-canonical ensembles. There are also many books, reviews, articles on the topic of simulation of adsorption.