GitHub - GaryZ700/Hartree-Fock: Python Implementation of the Hartree-Fock Method

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Python Implementation of the Hartree-Fock Method

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Name		Name	Last commit message	Last commit date
Latest commit History 17 Commits
tests		tests
HF.py		HF.py
HF2.py		HF2.py
basis.py		basis.py
integrals.py		integrals.py
readme		readme
scf.py		scf.py

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Python implementation the Hartree-Fock method. 

Built by Gary Zeri, part of the Furche Group, NS2 UCI. 

References:
	
	"Modern Quantum Chemistry Introduction to Advanced Electronic Structure Theory" by Attila Szabo, and Neil S. Ostlund

	https://www.uam.es/docencia/quimcursos/Docs/Knowledge/Fundamental_Theory/hf/node6.html