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Double perturbation method on LCAO-SCF functions

✍ Scribed by Uzi Landman

Book ID
107731176
Publisher
Elsevier Science
Year
1967
Tongue
English
Weight
183 KB
Volume
1
Category
Article
ISSN
0009-2614

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πŸ“œ SIMILAR VOLUMES

One-Electron properties from approximate
One-Electron properties from approximate LCAO-SCF wave functions
✍ G. L. Bendazzoli; M. Dixon; P. Palmieri πŸ“‚ Article πŸ“… 1973 πŸ› John Wiley and Sons 🌐 English βš– 467 KB

## Abstract Approximate and __ab initio__ molecular wave functions are obtained using Gaussian expansions of different length for the Slater orbitals. The expectation values of several one‐electron operators are obtained and the accuracy of different wave functions discussed.