jjgoings / McMurchie-Davidson

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

Date Created 2017-02-10 (7 years ago)

Commits 195 (last one 5 months ago)

Stargazers 79 (0 this week)

Watchers 3 (0 this week)

Forks 17

License bsd-3-clause

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RepositoryStats indexes 584,777 repositories, of these jjgoings/McMurchie-Davidson is ranked #340,649 (42nd percentile) for total stargazers, and #422,609 for total watchers. Github reports the primary language for this repository as Python, for repositories using this language it is ranked #63,725/116,437.

jjgoings/McMurchie-Davidson is also tagged with popular topics, for these it's ranked: chemistry (#110/174)

Other Information

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All Topics

scf chemistry integrals hartree-fock quantum-chemistry mcmurchie-davidson electronic-structure

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3 commits on the default branch (master) since jan '22

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updated: 2024-11-07 @ 07:49pm, id: 81615513 / R_kgDOBN1amQ