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Computer simulation techniques are now having a major impact on almost all areas of the physical and biological sciences. This book concentrates on the application of these methods to inorganic materials, including topical and industrially relevant systems including zeolites and high Tc superconductors.The central theme of the book is the use of modern simulation techniques as a structural tool in solid state science. Computer Modelling in Inorganic Crystallography describes the current range of techniques used in modeling crystal structures, and strong emphasis is given to the use

Crystallography --- Crystals --- Inorganic compounds. --- Compounds, Inorganic --- Inorganic chemicals --- Chemicals --- Chemistry, Inorganic --- Chemical models --- Data processing. --- Models.

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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

Porous materials --- Microstructure --- Materials --- Matter --- Morphology --- Micromechanics --- Stereology --- Porous media --- Porosity --- Computer simulation. --- Constitution