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Computer modelling of microporous materials
Authors: --- ---
ISBN: 008047229X 9780080472294 9780121641375 0121641376 1280968281 9781280968280 9786610968282 Year: 2004 Publisher: Amsterdam Boston Elsevier :Academic Press

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Abstract

Microporous materials, including both zeolites and aluminophosphates are amongst the most fascinating classes of materials, with wide ranging important applications in catalysis, gas separation and ion exchange. The breadth of the field has, moreover, been extended in the last ten years by the discovery of the versatile and exciting ranges of mesoporous materials.Computational methods have a long and successful history of application in solid state and materials science, where they are indeed established tools in modelling structural and dynamic properties of the bulk and surfaces of solid

Nanoporous materials
Authors: ---
ISBN: 1281347507 9786611347505 1860946569 1591249848 9781860946561 9781591249849 9781860942105 1860942105 9781860942112 1860942113 Year: 2004 Volume: v. 4 Publisher: London Imperial College Press

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Abstract

Porous materials are of scientific and technological importance because of the presence of voids of controllable dimensions at the atomic, molecular, and nanometer scales, enabling them to discriminate and interact with molecules and clusters. Interestingly the big deal about this class of materials is about the "nothingness" within the pore space. International Union of Pure and Applied Chemistry (IUPAC) classifies porous materials into three categories micropores of less than 2 nm in diameter, mesopores between 2 and 50 nm, and macropores of greater than 50 nm. In this book, nanoporous m

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