Modern quantum chemistry : introduction to advanced electronic structure theory

作者：Attila Szabó, Neil S. Ostlund · 年份：1982 · 被引用次数：3662 · 研究领域：Various Chemistry Research Topics、History and advancements in chemistry

The aim of this graduate-level textbook is to present and explain, at other than a superficial level, modem ab initio approaches to the calculation of the electronic structure and properties of molecules. The first three chapters contain introductory material culminating in a thorough discussion of the Hartree-Fock approximation.The remaining four chapters describe a variety of more sophisticated approaches, which improve upon this approximation.Among the highlights of the seven chapters are (1) a review of the mathematics (mostly matrix algebra) required for the rest of the book, (2) an intr