Code

feat(pt): train with energy Hessian#4169

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wanghan-iapcm merged 223 commits intodeepmodeling:develdeepmodeling/deepmd-kit:develfrom 1azyking:enerhess1azyking/deepmd-kit:enerhessCopy head branch name to clipboardDec 27, 2024

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Commits on Aug 6, 2024

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Commits on Aug 15, 2024

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Commits on Aug 21, 2024

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Commits on Aug 26, 2024

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• Create train-energy-hessian.md

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Commits on Sep 30, 2024

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Commits on Oct 4, 2024

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Commits on Oct 9, 2024

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Commits on Oct 10, 2024

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Commits on Oct 11, 2024

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Commits on Oct 15, 2024

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Commits on Oct 17, 2024

• Fixed bugs and formatted codes for fitting with hessian

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• Merge branch 'devel' into enerhess

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Commits on Dec 6, 2024

• Update env_mat.py

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• Update make_hessian_model.py

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• Merge branch 'devel' into enerhess

  1azyking

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• Resovling conversations

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• Merge branch 'devel' into enerhess

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Commits on Dec 15, 2024

• Update ener_model.py

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  1azyking

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• Update test_change_bias.py

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Commits on Dec 23, 2024

• Merge branch 'devel' into enerhess

  1azyking

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Commits on Dec 25, 2024

• Merge branch 'devel' into enerhess

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• Update train-energy-hessian.md

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  1azyking

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• Merge branch 'devel' into enerhess

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  1azyking

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• Update train-energy-hessian.md

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Commits on Dec 26, 2024

• Merge branch 'devel' into enerhess

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Commits on Dec 27, 2024

• Merge branch 'devel' into enerhess

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• Update input.json

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