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@dyzheng dyzheng commented Mar 22, 2022

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dyzheng added 2 commits March 22, 2022 14:50
ABACUS will print which structure is better and then using the input structure for calculating.
@dyzheng dyzheng requested a review from wenfei-li April 2, 2022 09:33
@dyzheng dyzheng merged commit c41592b into develop Apr 3, 2022
@dyzheng dyzheng deleted the symmetry-debug branch April 3, 2022 08:39
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k-point symmetry affects final energy in simple monoclinic lattice in both pw and LCAO base

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