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"Benchmarking the performance of plane-wave vs. localized orbital ..."

Kapil Adhikari et al. (2018)

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DOI: 10.1016/J.JOCS.2018.10.008

access: closed

type: Journal Article

metadata version: 2024-02-05

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Kapil Adhikari, Aurab Chakrabarty, Othmane Bouhali, Normand Mousseau, Charlotte S. Becquart, Fedwa El-Mellouhi:
Benchmarking the performance of plane-wave vs. localized orbital basis set methods in DFT modeling of metal surface: a case study for Fe-(110). J. Comput. Sci. 29: 163-167 (2018)

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