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Unrestricted Hartree-Fock Method

✍ Scribed by Pratt, George W.

Book ID: 121300993
Publisher: The American Physical Society
Year: 1956
Tongue: English
Weight: 478 KB
Volume: 102
Category: Article
ISSN: 0031-899X
DOI: 10.1103/PhysRev.102.1303

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## Abstract The generator coordinate method was implemented in the unrestricted Hartree‐Fock formalism. Weight functions were built from Gaussian generator functions for 1s, 2s, and 2p orbitals of carbon and oxygen atoms. These weight functions show a similar behavior to those found in the generato