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Efficient Adiabatic Connection Approach for Strongly Correlated Systems: Application to Singlet-Triplet Gaps of Biradicals.
Drwal, Daria; Beran, Pavel; Hapka, Michal; Modrzejewski, Marcin; Sokól, Adam; Veis, Libor; Pernal, Katarzyna.
Afiliação
  • Drwal D; Institute of Physics, Lodz University of Technology, ul. Wolczanska 219, 90-924 Lodz, Poland.
  • Beran P; J. Heyrovský Institute of Physical Chemistry, Academy of Sciences of the Czech Republic, v.v.i., Dolejskova 3, 18223 Prague 8, Czech Republic.
  • Hapka M; Faculty of Mathematics and Physics, Charles University, Ke Karlovu 2027/3, 12116 Prague 2, Czech Republic.
  • Modrzejewski M; Institute of Physics, Lodz University of Technology, ul. Wolczanska 219, 90-924 Lodz, Poland.
  • Sokól A; Faculty of Chemistry, University of Warsaw, ul. L. Pasteura 1, 02-093 Warsaw, Poland.
  • Veis L; Faculty of Chemistry, University of Warsaw, ul. L. Pasteura 1, 02-093 Warsaw, Poland.
  • Pernal K; Institute of Physics, Lodz University of Technology, ul. Wolczanska 219, 90-924 Lodz, Poland.
J Phys Chem Lett ; 13(20): 4570-4578, 2022 May 26.
Article em En | MEDLINE | ID: mdl-35580342
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article
Texto completo
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2022 Tipo de documento: Article