Development of equations for differential and integral enthalpy change of adsorption for simulation studies

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Development of equations for differential and integral enthalpy change of adsorption for simulation studies

We present equations to calculate the differential and integral enthalpy changes of adsorption for their use in Monte Carlo simulation. Adsorption of a system of N molecules, subject to an external potential energy, is viewed as one of transferring these molecules from a reference gas phase (state 1...

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Bibliographic Details
Main Authors:	Do, D., Nicholson, D., Fan, Chunyan
Format:	Journal Article
Published:	American Chemical Society 2011
Online Access:	http://hdl.handle.net/20.500.11937/55270

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