Development of a new quantum trajectory molecular dynamics framework.

Svensson, Pontus; Campbell, Thomas; Graziani, Frank; Moldabekov, Zhandos; Lyu, Ningyi; Batista, Victor S; Richardson, Scott; Vinko, Sam M; Gregori, Gianluca

Svensson, Pontus; Campbell, Thomas; Graziani, Frank; Moldabekov, Zhandos; Lyu, Ningyi; Batista, Victor S; Richardson, Scott; Vinko, Sam M; Gregori, Gianluca.

Afiliación

Svensson P; Department of Physics, University of Oxford, Parks Road, Oxford OX1 3PU, UK.
Campbell T; Department of Physics, University of Oxford, Parks Road, Oxford OX1 3PU, UK.
Graziani F; Lawrence Livermore National Laboratory, Livermore, CA 94550, USA.
Moldabekov Z; Center of Advanced Systems Understanding (CASUS), D-02826 Görlitz, Germany.
Lyu N; Helmholtz-Zentrum Dresden-Rossendorf (HZDR), D-01328 Dresden, Germany.
Batista VS; Department of Chemistry, Yale University, New Haven, CT 06520, USA.
Richardson S; Department of Chemistry, Yale University, New Haven, CT 06520, USA.
Vinko SM; Yale Quantum Institute, Yale University, New Haven, CT 06511, USA.
Gregori G; AWE, Aldermaston, Reading, Berkshire RG7 4PR, UK.

Philos Trans A Math Phys Eng Sci ; 381(2253): 20220325, 2023 Aug 21.

Article en En | MEDLINE | ID: mdl-37393934

Palabras clave

non-adiabatic electron dynamics; warm dense matter; wave packet molecular dynamics

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Idioma: En Revista: Philos Trans A Math Phys Eng Sci Asunto de la revista: BIOFISICA / ENGENHARIA BIOMEDICA Año: 2023 Tipo del documento: Article País de afiliación: Reino Unido Pais de publicación: Reino Unido

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