Reduced local energy for atomic Hartree-Fock wavefunctions
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资源简介：
Title of program: REDUCED LOCAL ENERGY FOR ATOMS
Catalogue Id: ACCE_v1_0
Nature of problem
The reduced local energy (diagonal elements of the reduced local energy 1-matrix) is defined in position space for an n electron system (N>2). An analogous definition holds in the Hartree-Fock approximation. The program evaluates ELHF(r1), the Hartree-Fock reduced local energy, for atomic systems.
Versions of this program held in the CPC repository in Mendeley Data
ACCE_v1_0; REDUCED LOCAL ENERGY FOR ATOMS; 10.1016/0010-4655(84)90073-0
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2019)
创建时间：
2019-11-11
