Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics

Errol G Lewars

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Langue : anglais

Edité par Kluwer Academic Publishers, 2003

1402074220 / 9781402074226

Vendeur : World of Books Inc, Montgomery, IL, Etats-UnisWorld of Books Inc

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Computational chemistry has become extremely important in the last decade, being widely used in academic and industrial research. Yet there have been few books designed to teach the subject to nonspecialists. Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics is an invaluable tool for teaching and researchers alike. The book provides an overview of the field, explains the basic underlying theory at a meaningful level that is not beyond beginners, and it gives numerous comparisons of different methods with one another and with experiment. The following concepts are illustrated and their possibilities and limitations are given: - potential energy surfaces; - simple and extended Huckel methods; - ab initio, AM1 and related semiempirical methods; - density functional theory (DFT). Topics are placed in a historical context, adding interest to them and removing much of their apparently arbitrary aspect. The large number of references, to all significant topics mentioned, should make this book useful not only to undergraduates but also to graduate students and academic and industrial researchers.…

N° de réf. du vendeur CIN1402074220A

Titre
Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics
Auteur
Errol G Lewars
Éditeur
Kluwer Academic Publishers
Année de publication
2003
État de l'article
Fair
Reliure
Paperback
Langue
anglais
ISBN à 10 chiffres
1402074220
ISBN à 13 chiffres
9781402074226

World of Books Inc

Montgomery, IL, Etats-Unis

Vendeur avec une évaluation de 4 étoiles

Vendeur AbeBooks depuis 23 mars 2026

Frais d'expédition à l'intérieur de ce pays : Etats-Unis

Article4 à 12 jours ouvrés3 à 6 jours ouvrés
Premier articleEUR 0,00EUR 9,81
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