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Relativistic Orbital-Optimized Density Functional Theory for Accurate Core-Level Spectroscopy.
Cunha, Leonardo A; Hait, Diptarka; Kang, Richard; Mao, Yuezhi; Head-Gordon, Martin.
  • Cunha LA; Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, United States.
  • Hait D; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States.
  • Kang R; Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, United States.
  • Mao Y; Chemical Sciences Division, Lawrence Berkeley National Laboratory, Berkeley, California 94720, United States.
  • Head-Gordon M; Kenneth S. Pitzer Center for Theoretical Chemistry, Department of Chemistry, University of California, Berkeley, California 94720, United States.
J Phys Chem Lett ; 13(15): 3438-3449, 2022 Apr 21.
Article en En | MEDLINE | ID: mdl-35412838
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Texto completo: 1 Banco de datos: MEDLINE Tipo de estudio: Prognostic_studies Idioma: En Año: 2022 Tipo del documento: Article
Texto completo
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XML
PubMed Links
Search on Google

Texto completo: 1 Banco de datos: MEDLINE Tipo de estudio: Prognostic_studies Idioma: En Año: 2022 Tipo del documento: Article