GitHub / GES-compchem / GES-comp-echem

A python-based engine for computational chemistry calculations

JSON API: http://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/GES-compchem%2FGES-comp-echem
PURL: pkg:github/GES-compchem/GES-comp-echem

Stars: 2
Forks: 3
Open issues: 7

License: gpl-3.0
Language: Python
Size: 42.9 MB
Dependencies parsed at: Pending

Created at: over 3 years ago
Updated at: about 2 years ago
Pushed at: almost 2 years ago
Last synced at: almost 2 years ago

Topics: computational-chemistry, dft-calculations, dftbplus, orca-quantum-chemistry, xtb

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