Accurate and Fast Evaluation of Three-Center Nuclear Attraction Integrals of Coulomb–Yukawa Like Correlated Interaction Potentials and Slater Type Orbitals

Autor:	Nurşen Seçkin Görgün, Israfil I. Guseinov
Rok vydání:	2013
Předmět:	Atomic orbital Computational chemistry Chemistry Quantum mechanics Slater–Condon rules Yukawa potential Coulomb Center (algebra and category theory) General Chemistry Complete active space Physics::Chemical Physics Attraction Slater-type orbital
Zdroj:	Bulletin of the Chemical Society of Japan. 86:31-36
ISSN:	1348-0634 0009-2673
DOI:	10.1246/bcsj.20120243
Popis:	With the use of one-range addition theorems of Slater type orbitals (STOs) introduced by one of the authors, three-center nuclear attraction integrals containing Coulomb–Yukawa like correlated inte...
Databáze:	OpenAIRE
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