General Hartree-Fock program
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Abstract
Title of program: HF86 Catalogue number: AATK Program obtainable from: CPC Program Library, Queen's University of Belfast, N. Ireland (see application from in this issue) Computer: Vax 11/780; Installation: Vanderbilt University, Nashville, TN 37235, USA Operation system: VMS Version 4.4 Programming language used: FORTRAN 77 Virtual memory: 526 kbytes No. of bits in a word: 32 Peripherals used: disk, printer, terminal No. of lines in combined program and test deck: 4167
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Title of program: HF86
Catalogue Id: AATK_v1_0
Nature of problem
Numerical non-relativistic Hartree-Fock wavefunctions are determined for atoms in a bound state. These are used to predict a variety of atomic parameters.
Versions of this program held in the CPC repository in Mendeley Data
AATK_v1_0; HF86; 10.1016/0010-4655(87)90053-1
This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)
创建时间：
2019-11-11
