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Advances in Quantum Chemistry: Density Functional Theory (Hardback)

Jorge M Seminario

Edité par Elsevier Science Publishing Co Inc, United States, 1998
ISBN 10: 0120348322 / ISBN 13: 9780120348329
Neuf(s) / Hardback / Quantité : 1
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Titre : Advances in Quantum Chemistry: Density ...

Éditeur : Elsevier Science Publishing Co Inc, United States

Date d'édition : 1998

Reliure : Hardback

Etat du livre : New

Description :

Language: English . Brand New Book. Quantum mechanics can describe the detailed structure and behavior of matter, from electrons, atoms, and molecules, to the whole universe. It is one of the fields of knowledge that yield extraordinary precessions, limited only by the computational resources available. Among these methods is density functional theory (DFT), which permits one to solve the equations of quantum mechanics more efficiently than with any related method. The present volume represents the most comprehensive summary currently available in density functional theory and its applications in chemistry from atomic physics to molecular dynamics. DFT is currently being used by more than fifty percent of computational chemists. N° de réf. du libraire AA59780120348329

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Synopsis : Quantum mechanics can describe the detailed structure and behavior of matter, from electrons, atoms, and molecules, to the whole universe. It is one of the fields of knowledge that yield extraordinary precessions, limited only by the computational resources available. Among these methods is density functional theory (DFT), which permits one to solve the equations of quantum mechanics more efficiently than with any related method. The present volume represents the most comprehensive summary currently available in density functional theory and its applications in chemistry from atomic physics to molecular dynamics. DFT is currently being used by more than fifty percent of computational chemists.

Critique: "The juxtaposition of the oldest of quantum chemical studies, atomic structure, and one of the newest, quantum biology, highlights the importance of quantum theory in modern chemistry. Thus, having first opened the book in search of a particular article, the reader is stimulated to delve into fields of which he has but a superficial knowledge. In this way the book can be instrumental in broadening the interests and background of those who turn to it." -- THE ROYAL INSTITUTE OF CHEMISTRY

PRAISE FOR THE SERIES "Quantum chemistry has emerged as a subject in its own right. The appearance of a review publication which surveys recent achievements in the field is therefore very appropriate and, when it has the quality of this volume, is most welcome." -- PROCEEDINGS OF THE PHYSICAL SOCIETY

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