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This book focuses on ab initio valence bond theory. Part I gives examples of two-electron calculations and the necessary theory to extend these to larger systems. Part II discusses a series of case studies. Reference is made throughout to the freely available CRUNCH computer program for molecular structure calculations.
- Format: Inbunden
- ISBN: 9780521803922
- Språk: Engelska
- Antal sidor: 256
- Utgivningsdatum: 2002-07-11
- Förlag: Cambridge University Press