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Author Topic: localized charge setting in complex vdW stacking supercells  (Read 3027 times)

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Offline beauyy

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localized charge setting in complex vdW stacking supercells
« on: May 2, 2023, 06:26 »
Dear all, I need to applied nonzero charge on the sublayer in a vdW stacking supercell. Is it possible to do this operation in QuantumATK 2018.06? Or is there any script to achieve this? 
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