Dimension-dependent two-electron Hamiltonian matrix elements

Citation
Jh. Summerfield et Jg. Loeser, Dimension-dependent two-electron Hamiltonian matrix elements, J MATH CHEM, 25(2-3), 1999, pp. 309-315
Citations number
14
Categorie Soggetti
Chemistry
Journal title
JOURNAL OF MATHEMATICAL CHEMISTRY
ISSN journal
02599791 → ACNP
Volume
25
Issue
2-3
Year of publication
1999
Pages
309 - 315
Database
ISI
SICI code
0259-9791(1999)25:2-3<309:DTHME>2.0.ZU;2-S
Abstract
Since the birth of quantum mechanics the ground state electronic energy of the two-electron atom has received special attention. This is because the t wo-electron system is the simplest atom to include electron-electron intera ctions. These interactions are key to understanding many-electron systems. This paper adds to the knowledge of two-electron atoms by presenting closed form solutions for Hamiltonian matrix elements at arbitrary spatial dimens ion, D. The basis functions are the D-dependent hydrogenic wavefunctions: { 1s(2),2p(2),3d(2),4f(2)}. The electron-electron repulsion integrals are sol ved by the Fourier integral transform.