One-Range Addition Theorems in Terms of ??-ETOs for STOs and Coulomb-Yukawa Like Correlated Interaction Potentials of Integer and Noninteger Indices

[ X ]

Tarih

2008

Dergi Başlığı

Dergi ISSN

Cilt Başlığı

Yayıncı

Iop Publishing Ltd

Erişim Hakkı

info:eu-repo/semantics/closedAccess

Özet

The expansion formulas in terms of complete orthonormal sets of Psi(alpha)-exponential type orbitals are established for the Slater type orbitals and Coulomb-ukawa like correlated interaction potentials of integer and non integer indices. These relations are used in obtaining their unsymmetrical and symmetrical one-range addition theorems. The final results are especially useful in the calculations of multi centre multi electron integrals occurring when Hartree-Fock-Roothaan and explicitly correlated methods are employed.

Açıklama

Anahtar Kelimeler

Complete Orthonormal Sets, Noncentral Interaction Potentials, Exponential-Type Orbitals, Slater-Type Orbitals, Ground-State, Hydrogen Molecule, Expansion Theorems, Integrals, Coordinate, 2-Center

Kaynak

Chinese Physics Letters

WoS Q Değeri

Q3

Scopus Q Değeri

Q1

Cilt

25

Sayı

12

Künye