GitHub / paolodeangelis / Enhancing_ReaxFF_DFT_database
Database used for retraining the ReaxFF force field for the inorganic compound LiF.
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PURL: pkg:github/paolodeangelis/Enhancing_ReaxFF_DFT_database
Stars: 5
Forks: 1
Open issues: 1
License: cc-by-4.0
Language: Jupyter Notebook
Size: 3.48 MB
Dependencies parsed at: Pending
Created at: about 2 years ago
Updated at: about 2 months ago
Pushed at: about 1 month ago
Last synced at: about 1 month ago
Commit Stats
Commits: 83
Authors: 3
Mean commits per author: 27.67
Development Distribution Score: 0.12
More commit stats: https://commits.ecosyste.ms/hosts/GitHub/repositories/paolodeangelis/Enhancing_ReaxFF_DFT_database
Topics: battery, database, density-functional-theory, jupyter, molecular-dynamics, python, reaxff