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Support supercells as input #80

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ExpHP opened this issue Oct 17, 2018 · 1 comment
Open

Support supercells as input #80

ExpHP opened this issue Oct 17, 2018 · 1 comment
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@ExpHP
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ExpHP commented Oct 17, 2018

supercells are currently forbidden because it is difficult to compute their symmetries. However, supporting them would be useful for metastable states that relax into a lower translational symmetry.
@ExpHP ExpHP mentioned this issue Oct 17, 2018
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ExpHP commented May 21, 2019

Current workaround is to disable symmetry using symmetry-tolerance: 0

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