mizu-bai / He-Atom-Hartree-Fock

Simple Implementation of Hartree-Fock Method to Calculate the Ground State Electronic Energy of He Atom

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He Atom Hartree Fock

Simple Implementation of Hartree-Fock Method to Calculate the Ground State Electronic Energy of He Atom

Introduction

This is a simple example in Quantium Chemistry written by Levine.

Result

Final energy of ground state He atom is -2.86166954 Hartree.

Dependencies

  • LinearAlegbra.jl

About

Simple Implementation of Hartree-Fock Method to Calculate the Ground State Electronic Energy of He Atom

License:BSD 2-Clause "Simplified" License


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