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This paper describes a Monte Carlo computer simulation study of connectivity effects in a system of two parallel slit pores and a quasi-one-dimensional joint. A numerical method for evaluation of accessible volume in computer simulation studies of adsorption in pores is presented and applied to simple slit pores and systems of interconnected pores. A local version of the grand canonical ensemble Monte Carlo method is used to study adsorption under conditions mimicking mass transfer limitations.
Original language | English |
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Pages (from-to) | 759-763 |
Number of pages | 5 |
Journal | Molecular Simulation |
Volume | 31 |
Issue number | 11 |
DOIs | |
State | Published - 15 Sep 2005 |
ID: 34660715