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A molecular simulation approach to the study of adsorption of hydrogen cyanide and methyl ethyl ketone in silicalite, mordenite and zeolite beta structures
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A molecular simulation approach to the study of adsorption of hydrogen cyanide and methyl ethyl ketone in silicalite, mordenite and zeolite beta structures

RR Kotdawala, AO Yazaydin, N Kazantzis and RW Thompson
MOLECULAR SIMULATION, Vol.33(9-10), pp.843-850
01/01/2007

Abstract

Science & Technology Physical Sciences Chemistry Physical Physics Atomic Molecular & Chemical Chemistry Physics CHEMISTRY PHYSICAL PHYSICS ATOMIC MOLECULAR & CHEMICAL hazardous molecules adsorption molecular modeling molecular simulation hydrogen cyanide methyl ethyl ketone UNITED-ATOM DESCRIPTION VOLATILE ORGANIC-COMPOUNDS PHASE-EQUILIBRIA TRANSFERABLE POTENTIALS VAPOR ALKANES ENSEMBLE
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