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refactor DeepPot and support AutoBatchSize #173

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merged 5 commits into from
Jan 24, 2024
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@njzjz njzjz commented Jan 18, 2024

Fix #137.
Refactor DeepPot, support AutoBatchSize, and pass the do_atomic_virial argument.
It requires deepmodeling/deepmd-kit#3153, otherwise, there is a circular import. However, it seems the UT has passed.

njzjz added 5 commits January 18, 2024 01:59
Signed-off-by: Jinzhe Zeng <[email protected]>
Signed-off-by: Jinzhe Zeng <[email protected]>
Signed-off-by: Jinzhe Zeng <[email protected]>
@wanghan-iapcm wanghan-iapcm requested a review from iProzd January 20, 2024 14:11
@wanghan-iapcm wanghan-iapcm merged commit 1aabb48 into reformat Jan 24, 2024
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3 participants