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

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Journal of Computational Science 2018 / 11

Benchmarking the performance of plane-wave vs. localized orbital basis set methods in DFT modeling of metal surface: a case study for Fe-(110)

Adhikari, Kapil, Chakrabarty, Aurab, Bouhali, Othmane, Mousseau, Normand, Becquart, Charlotte S., El-Mellouhi, Fedwa
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Language:
english
Journal:
Journal of Computational Science
DOI:
10.1016/j.jocs.2018.10.008
Date:
November, 2018
File:
PDF, 608 KB
english, 2018
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