The effects of partial charges and water models on water adsorption in nanostructured zeolites, application of PN-TrAz potential in parallel GCMC

Author: Khosravi A.   Golchoobi A.   Modarress H.   Ahmadzadeh A.  

Publisher: Taylor & Francis Ltd

ISSN: 0892-7022

Source: Molecular Simulation, Vol.39, Iss.6, 2013-05, pp. : 495-504

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