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Fine tuning classical and quantum molecular dynamics using a generalized Langevin equation.
Rossi, Mariana; Kapil, Venkat; Ceriotti, Michele.
Afiliação
  • Rossi M; Laboratory of Computational Science and Modelling, Institute of Materials, Ecole Polytechnique Fédérale de Lausanne, Lausanne, Switzerland.
  • Kapil V; Laboratory of Computational Science and Modelling, Institute of Materials, Ecole Polytechnique Fédérale de Lausanne, Lausanne, Switzerland.
  • Ceriotti M; Laboratory of Computational Science and Modelling, Institute of Materials, Ecole Polytechnique Fédérale de Lausanne, Lausanne, Switzerland.
J Chem Phys ; 148(10): 102301, 2018 Mar 14.
Article em En | MEDLINE | ID: mdl-29544334

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2018 Tipo de documento: Article

Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Tipo de estudo: Prognostic_studies Idioma: En Ano de publicação: 2018 Tipo de documento: Article