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Regarding Absolute Error of configurations of training set #628

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bjn123 opened this issue Dec 31, 2023 · 0 comments
Open

Regarding Absolute Error of configurations of training set #628

bjn123 opened this issue Dec 31, 2023 · 0 comments

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@bjn123
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bjn123 commented Dec 31, 2023

Dear all
During the parameterization of GAP model potential of atomic clusters, why the addition of configurations from the validate set to trainset increases the absolute values of forces of the trainset?
Thank you
bjn
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