jjgoings/McMurchie-Davidson

do a simple closed shell Hartree-Fock using McMurchie-Davidson to compute integrals

PythonStars 84Forks 18Watchers 84Open issues 3License BSD 3-Clause "New" or "Revised" License

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Ownerjjgoings

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Last pushed2024-06-08

Last updated2025-12-15

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