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deepmodeling / deepmd-kit Public

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throw errros if rmin is no less than rmax#3393

Merged

njzjz merged 9 commits intodeepmodeling:develdeepmodeling/deepmd-kit:develfrom

njzjz:dpmodel-fix-nannjzjz/deepmd-kit:dpmodel-fix-nanCopy head branch name to clipboard

Mar 5, 2024

Conversation Commits9 (9)Checks Files changed

Merged

throw errros if rmin is no less than rmax#3393
njzjz merged 9 commits intodeepmodeling:develfrom
njzjz:dpmodel-fix-nan

Commits

Commits on Mar 2, 2024

fix compute_smooth_weight nan output
njzjz
committed
dtype
njzjz
committed

Commits on Mar 5, 2024

Revert "dtype"
njzjz
committed
Revert "fix compute_smooth_weight nan output"
njzjz
committed
throw erros when rmin is no less than rmax
njzjz
committed
set rcut=2.2 rcut_smth=0.4
njzjz
committed
fix rcut_smth>rcut
njzjz
committed
Merge branch 'devel' into dpmodel-fix-nan
njzjz
authored
typo
njzjz
authored

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