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e-book

Computer Modeling in Inorganic Crystallography (Cód: 3026097)

Catlow,C. Richard A.

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Computer Modeling in Inorganic Crystallography

R$495,43

Descrição

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 of modeling in predicting new crystal structures and refining partially known structures. It also reviews new opportunities being opened up by electronic structure calculation and explains the ways in which these techniques are illuminating our knowledge of bonding in solids.Includes a thorough review of the technical basis of relevant contemporary methodologies including minimization, Monte-Carlo, molecular dynamics, simulated annealing methods, and electronic structure methodsHighlights applications to amorphous and crystalline solidsSurveys simulations of surface and defect properties of solidsDiscusses applications to molecular and inorganic solids

Características

Peso 0.00 Kg
Produto sob encomenda Não
Marca ELSEVIER S&T
Idioma 337
Acabamento e-book
Territorialidade Internacional
Formato Livro Digital Pdf
Gratuito Não
Proteção Drm Sim
Tamanho do Arquivo 36879
Início da Venda 03/02/1997
Código do Formato Pdf
Cód. Barras 9780080502458
Ano da edição 21997
Ano da Publicação 1997
AutorCatlow,C. Richard A.