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Small Refactoring for include_state #239

Merged
merged 23 commits into from
Mar 7, 2024
Merged

Small Refactoring for include_state #239

merged 23 commits into from
Mar 7, 2024

Commits on Nov 17, 2023

  1. model version for Potential class is added

    @kenko911
    kenko911 committed Nov 17, 2023
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  2. model version for Potential class is modified

    @kenko911
    kenko911 committed Nov 17, 2023
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Commits on Nov 26, 2023

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Nov 26, 2023
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  2. Merge branch 'main' of https://github.com/kenko911/matgl

    @kenko911
    kenko911 committed Nov 26, 2023
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Commits on Dec 13, 2023

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Dec 13, 2023
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Commits on Feb 5, 2024

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Feb 5, 2024
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Commits on Feb 14, 2024

  1. Merge branch 'main' of https://github.com/kenko911/matgl

    @kenko911
    kenko911 committed Feb 14, 2024
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  2. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Feb 14, 2024
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  3. Merge branch 'main' of https://github.com/kenko911/matgl

    @kenko911
    kenko911 committed Feb 14, 2024
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Commits on Feb 16, 2024

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Feb 16, 2024
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  2. Merge branch 'main' of https://github.com/kenko911/matgl

    @kenko911
    kenko911 committed Feb 16, 2024
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  3. Enable the smooth version of Spherical Bessel function in TensorNet

    @kenko911
    kenko911 committed Feb 16, 2024
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  4. max_n, max_l for SphericalBessel radial basis functions are included … 

    …in TensorNet class
    @kenko911
    kenko911 committed Feb 16, 2024
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Commits on Feb 17, 2024

  1. adding united tests for improving the coverage score

    @kenko911
    kenko911 committed Feb 17, 2024
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Commits on Feb 18, 2024

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Feb 18, 2024
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Commits on Feb 19, 2024

  1. little clean up in _so3.py and so3.py

    @kenko911
    kenko911 committed Feb 19, 2024
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Commits on Feb 20, 2024

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Feb 20, 2024
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Commits on Mar 1, 2024

  1. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Mar 1, 2024
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  2. remove unnecessary data storage in dgl graphs

    @kenko911
    kenko911 committed Mar 1, 2024
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Commits on Mar 3, 2024

  1. update pymatgen version to fix the bug

    @kenko911
    kenko911 committed Mar 3, 2024
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Commits on Mar 7, 2024

  1. refractor all include_states into include_state for consistency

    @kenko911
    kenko911 committed Mar 7, 2024
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  2. change include_states into include_state in test_graph_conv.py

    @kenko911
    kenko911 committed Mar 7, 2024
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  3. Merge branch 'materialsvirtuallab:main' into main

    @kenko911
    kenko911 authored Mar 7, 2024
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