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pesmaker

Foundation-potential-assisted workflow for application-oriented machine-learning potential dataset generation.

Ecosystem
pypi.org
Latest Release
0.1.0
5 months ago
Versions
1
Downloads
11 last month
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    Readme
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    Links
    Registry pypi.org
    Source Repository
    Docs Documentation
    JSON API View JSON
    CodeMeta codemeta.json
    Package Details
    PURL pkg:pypi/pesmaker
    spec
    License GPL-3.0-or-later
    First Release 5 months ago
    Last Synced 19 days ago
    Keywords
    atomistic simulation machine-learned interatomic potentials MACE GPUMD VASP
    Repository
    Stars 9 on GitHub
    Forks 2 on GitHub
    repos.ecosyste.ms