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Refactor soap to gap #4

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chc273 opened this issue Jan 27, 2020 · 1 comment
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Refactor soap to gap #4

chc273 opened this issue Jan 27, 2020 · 1 comment
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@YunxingZuo

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@chc273
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chc273 commented Jan 27, 2020

@YunxingZuo
Please change the model name and all related modules to Gaussian approximation potential (GAP) instead of using its feature name smooth overlap of atomic positions (SOAP).
@YunxingZuo
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Sure, I will incorporate all mlearn modules into the pes folder.

@YunxingZuo YunxingZuo self-assigned this Jan 27, 2020
@chc273 chc273 closed this as completed Feb 24, 2020
@xinglong-zhang xinglong-zhang mentioned this issue May 15, 2021
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