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Make sure to not allow filling more electrons than orbitals available #526

Merged

awvwgk merged 2 commits into grimme-lab:master from awvwgk:filling

Oct 21, 2021

+4 −0

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awvwgk commented Oct 21, 2021


          Make sure to not allow filling more electrons than orbitals available

cc0e17b

awvwgk added the bug label


          Fix error

b42d9eb

awvwgk merged commit 4a51bea into grimme-lab:master

awvwgk deleted the filling branch

October 21, 2021 19:21

awvwgk added this to the v6.5.0 milestone

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