Fourth-Order terms in the diagrammatic perturbation expansion for the electronic energy of atoms and molecules
β Scribed by Stephen Wilson; David M. Silver
- Publisher
- John Wiley and Sons
- Year
- 1979
- Tongue
- English
- Weight
- 466 KB
- Volume
- 15
- Category
- Article
- ISSN
- 0020-7608
No coin nor oath required. For personal study only.
β¦ Synopsis
Abstract
Thirdβorder diagrammatic perturbation theory provides a simple and accurate description of the electronic structure of atoms and molecules beyond that afforded by independent electron models. The largest corrections to such treatments, the fourthβorder terms, are presented and discussed. All of the diagrams, which arise when the closedβshell HartreeβFock function is utilized as a reference function, are given through fourth order.
π SIMILAR VOLUMES
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The efficient evaluation of the second-order expression in the many-body perturbation theory expansion for the correlation energy on vector processing and parallel processing computers is discussed. It is argued that the linked diagram theorem not only leads to the well known theoretical advantages