✦ LIBER ✦

Coupled perturbed Hartree—Fock equations. An alternative derivation and generalization to non-orthogonal orbitals

✍ Scribed by Béla Paizs; István Mayer

Publisher: Elsevier Science
Year: 1994
Tongue: English
Weight: 381 KB
Volume: 220
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(94)00139-1

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✦ Synopsis

An altemative derivation of the coupled perturbed Hartree-Fock equations is given including the most general case of nonorthogonal molecnlar orbitals and non-Hermitian Fockians.