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Speed difference between local_frame and se descriptor

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Post time: 2020-02-20 18:38:03
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As I checked the speed of NN potential using the local frame (old version) and the se descriptor, I found that the speed difference is an order of ~10. And I wonder if it is a natural consequence of algorithm or if it could be a possible bug.

Thank you for the reply in advance!

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Post time: 2020-05-27 09:06:59
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Yes, the local frame is faster than the new one. However, the old one is not smooth and has a bad performance in several systems.
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2020-07-02 17:36 GMT+8 , Processed in 0.096767 sec., 19 queries .

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