One-range addition theorems for combined Coulomb and Yukawa like central and noncentral interaction potentials and their derivatives
[ X ]
Tarih
2006
Yazarlar
Dergi Başlığı
Dergi ISSN
Cilt Başlığı
Yayıncı
Springer
Erişim Hakkı
info:eu-repo/semantics/closedAccess
Özet
In this work we present the combined one-range addition theorems for arbitrary Coulomb and Yukawa like central and noncentral interaction potentials and their first and second derivatives occurring in the Hartree-Fock-Roothaan approximation and explicitly correlated methods, and also in the study of electric field and its gradient induced by electrons at the nuclei of a molecule. The relationships obtained for addition theorems are valid for the arbitrary parameters of potentials.
Açıklama
Anahtar Kelimeler
addition theorems, Coulomb potential, Yukawa potential, Slater-type orbitals, Hartree-Fock-Roothaan approximation, correlated methods
Kaynak
Journal of Mathematical Chemistry
WoS Q Değeri
Q2
Scopus Q Değeri
Q2
Cilt
39
Sayı
2











