ELSI: A unified software interface for Kohn-Sham electronic structure solvers

Victor Wen-zhe Yu, Fabiano Corsetti, Alberto García, William P. Huhn, Mathias Jacquelin, Weile Jia, Björn Lange, Lin Lin 0001, Jianfeng Lu 0001, Wenhui Mi, Ali Seifitokaldani, Álvaro Vázquez-Mayagoitia, Chao Yang 0001, Haizhao Yang, Volker Blum. ELSI: A unified software interface for Kohn-Sham electronic structure solvers. Computer Physics Communications, 222:267-285, 2018. [doi]

Authors

Victor Wen-zhe Yu

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Fabiano Corsetti

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Alberto García

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William P. Huhn

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Mathias Jacquelin

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Weile Jia

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Björn Lange

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Lin Lin 0001

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Jianfeng Lu 0001

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Wenhui Mi

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Ali Seifitokaldani

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Álvaro Vázquez-Mayagoitia

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Chao Yang 0001

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Haizhao Yang

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Volker Blum

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