Numerical and Theoretical Aspects of the DMRG-TCC Method Exemplified by the Nitrogen Dimer.

Faulstich, Fabian M; Máté, Mihály; Laestadius, Andre; Csirik, Mihály András; Veis, Libor; Antalik, Andrej; Brabec, Jirí; Schneider, Reinhold; Pittner, Jirí; Kvaal, Simen; Legeza, Örs

Faulstich, Fabian M; Máté, Mihály; Laestadius, Andre; Csirik, Mihály András; Veis, Libor; Antalik, Andrej; Brabec, Jirí; Schneider, Reinhold; Pittner, Jirí; Kvaal, Simen; Legeza, Örs.

Afiliação

Faulstich FM; Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry , University of Oslo , P.O. Box 1033 Blindern, N-0315 Oslo , Norway.
Máté M; Strongly Correlated Systems "Lendület" Research Group , Wigner Research Center for Physics , H-1525 , P.O. Box 49, Budapest , Hungary.
Laestadius A; Department of Physics of Complex Systems , Eötvös Loránd University , Pf. 32 , H-1518 Budapest , Hungary.
Csirik MA; Hylleraas Centre for Quantum Molecular Sciences, Department of Chemistry , University of Oslo , P.O. Box 1033 Blindern, N-0315 Oslo , Norway.
Veis L; Strongly Correlated Systems "Lendület" Research Group , Wigner Research Center for Physics , H-1525 , P.O. Box 49, Budapest , Hungary.
Antalik A; J. Heyrovský Institute of Physical Chemistry , Academy of Sciences of the Czech Republic , v.v.i., Dolejskova 3 , 18223 Prague 8 , Czech Republic.
Brabec J; J. Heyrovský Institute of Physical Chemistry , Academy of Sciences of the Czech Republic , v.v.i., Dolejskova 3 , 18223 Prague 8 , Czech Republic.
Schneider R; Faculty of Mathematics and Physics , Charles University , 11636 Prague , Czech Republic.
Pittner J; J. Heyrovský Institute of Physical Chemistry , Academy of Sciences of the Czech Republic , v.v.i., Dolejskova 3 , 18223 Prague 8 , Czech Republic.
Kvaal S; Modeling, Simulation and Optimization in Science, Department of Mathematics , Technische Universität Berlin , Sekretariat MA 5-3, Straße des 17. Juni 136 , 10623 Berlin , Germany.
Legeza Ö; J. Heyrovský Institute of Physical Chemistry , Academy of Sciences of the Czech Republic , v.v.i., Dolejskova 3 , 18223 Prague 8 , Czech Republic.

J Chem Theory Comput ; 15(4): 2206-2220, 2019 Apr 09.

Article em En | MEDLINE | ID: mdl-30802406

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Chem Theory Comput Ano de publicação: 2019 Tipo de documento: Article País de afiliação: Noruega País de publicação: Estados Unidos

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