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Projects in Awesome Lists by aromanro

A curated list of projects in awesome lists by aromanro .

https://github.com/aromanro/hartreefock

A program implementing the Hartree–Fock (also post-HF: MP2, CCSD(T), CIS and TDHF/RPA)/self-consistent field method (also DIIS) with Gaussian orbitals

atom computational-chemistry computational-physics eigen gaussian gdi-plus hartree-fock mfc molecule orbital physics quantum quantum-chemistry quantum-chemistry-programs quantum-mechanics self-constent-field

Last synced: 26 Sep 2024