PARTIALLY UNRESTRICTED HARTREE-FOCK CALCULATIONS OF LIGHT ATOMS,

Abstract

Iterative solution of Partially Unrestricted Hartree-Fock (PUHF) equations for light atoms (N = 2 to 7) and the negative carbon ion resulted in radial functions independent of M sub L and M sub S except where this is clearly inconsistent with the form of the variational equations (spin-polarization for M sub S unequal to 0). Multiple solutions of PUHF equations exist for artificial cases of nonintegral Z (slightly above Z of negative ion) for N = 2 and 4. (Author)

Document Details

Document Type
Technical Report
Publication Date
Oct 05, 1965
Accession Number
AD0474966

Entities

People

  • J. F. Perkins

Tags

DTIC Thesaurus Topics

  • Differential Equations
  • Equations
  • Mathematics
  • Polarization
  • Variational Equations

Fields of Study

  • Physics

Readers

  • Calculus or Mathematical Analysis
  • Plasma Physics.
  • Quantum spin resonance or Electron Paramagnetic Resonance spectroscopy.