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Hartree-Fock program as showed by Szabo and Ostlund in Modern Quantum Chemistry

License: GNU General Public License v3.0

Fortran 100.00%
ab chemistry hartree-fock initio quantum-chemistry szabo ostlund

hfszaboostlund's Introduction

HFSzaboOstlund

Hartree-Fock program as showed by Szabo and Ostlund in Modern Quantum Chemistry

This is the code almost line by line as shown in the book.

Mostly for people that would be lazy to code it by hand and dealing with the nuisances of F77

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