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Theory and applications of computational chemistry : the first forty years /

Computational chemistry is a means of applying theoretical ideas using computers and a set of techniques for investigating chemical problems within which common questions vary from molecular geometry to the physical properties of substances. Theory and Applications of Computational Chemistry: The Fi...

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Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Dykstra, Clifford E.
Formato: Electrónico eBook
Idioma:Inglés
Publicado: Amsterdam ; Boston : Elsevier, 2005.
Edición:1st ed.
Temas:
Acceso en línea:Texto completo
Descripción
Sumario:Computational chemistry is a means of applying theoretical ideas using computers and a set of techniques for investigating chemical problems within which common questions vary from molecular geometry to the physical properties of substances. Theory and Applications of Computational Chemistry: The First Forty Years is a collection of articles on the emergence of computational chemistry. It shows the enormous breadth of theoretical and computational chemistry today and establishes how theory and computation have become increasingly linked as methodologies and technologies have advanced. Written by the pioneers in the field, the book presents historical perspectives and insights into the subject, and addresses new and current methods, as well as problems and applications in theoretical and computational chemistry. Easy to read and packed with personal insights, technical and classical information, this book provides the perfect introduction for graduate students beginning research in this area. It also provides very readable and useful reviews for theoretical chemists. * Written by well-known leading experts * Combines history, personal accounts, and theory to explain much of the field of theoretical and compuational chemistry * Is the perfect introduction to the field.
Descripción Física:1 online resource (xxvii, 1308 pages) : illustrations (some color)
Bibliografía:Includes bibliographical references and index.
ISBN:9780444517197
0444517197
0080456243
9780080456249
1280638222
9781280638220
9786610638222
6610638225