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qzhu2017 / PyXtal

A code to generate atomic structure with symmetry
MIT License
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molecular distance #198

Closed qzhu2017 closed 2 years ago

qzhu2017 commented 2 years ago

At the moment, we only checked the auto distance for the 1st site. We need to check all sites.

qzhu2017 commented 2 years ago

according to symmetry. We really just need to check it once.