"Density functional theory method for twisted geometries with application ..."

Hsuan Ming Yu, Amartya S. Banerjee (2022)

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DOI: 10.1016/J.JCP.2022.111023

access: open

type: Journal Article

metadata version: 2023-08-28

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Hsuan Ming Yu, Amartya S. Banerjee:
Density functional theory method for twisted geometries with application to torsional deformations in group-IV nanotubes. J. Comput. Phys. 456: 111023 (2022)

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