AB INITIO Molecular Orbital Theory

Inbunden, Engelska, 1986

4 375 kr

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Beskrivning

Describes and discusses the use of theoretical models as an alternative to experiment in making accurate predictions of chemical phenomena. Addresses the formulation of theoretical molecular orbital models starting from quantum mechanics, and compares them to experimental results. Draws on a series of models that have already received widespread application and are available for new applications. A new and powerful research tool for the practicing experimental chemist.

Produktinformation

Utgivningsdatum:1986-04-30
Mått:161 x 242 x 32 mm
Vikt:841 g
Format:Inbunden
Språk:Engelska
Antal sidor:576
Förlag:John Wiley & Sons Inc
ISBN:9780471812418

Utforska kategorier

Fysik inom Naturvetenskap och teknik
Kvantfysik inom Naturvetenskap och teknik

Mer om författaren

Warren J. Hehre is the author of AB INITIO Molecular Orbital Theory, published by Wiley. Leo Radom, born on December 13, 1944 in Shanghai, China, is a computational chemist. He attended North Sydney Boys High School. He has a PhD and a DSc from the University of Sydney and carried out post-doctoral work under the late Sir John Pople.

Innehållsförteckning

Theoretical Background. The Computational Problem. Selection of A Model. Practical Considerations: Input and Output. The Performance of the Model. Index.