COMBINED THEORY OF NONRELATIVISTIC AND QUASIRELATIVISTIC ATOMIC INTEGRALS OVER INTEGER AND NONINTEGER N-SLATER-TYPE ORBITALS


Guseinov I. I.

JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY, cilt.8, ss.47-56, 2009 (SCI İndekslerine Giren Dergi) identifier identifier

  • Cilt numarası: 8 Konu: 1
  • Basım Tarihi: 2009
  • Doi Numarası: 10.1142/s0219633609004393
  • Dergi Adı: JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY
  • Sayfa Sayıları: ss.47-56

Özet

One- and two-electron nonrelativistic and quasirelativistic basic functions are introduced. The combined analytical relations in terms of these basic functions are derived for the non- and quasi-relativistic atomic integrals over integer and noninteger n-Slater-type orbitals. The relationships obtained are valid for the arbitrary values of principal quantum numbers and screening constants of Slater orbitals.