Nuclear quantum effects in thermal conductivity from centroid molecular dynamics.

Sutherland, Benjamin J; Moore, William H D; Manolopoulos, David E

Sutherland, Benjamin J; Moore, William H D; Manolopoulos, David E.

Afiliação

Sutherland BJ; Physical and Theoretical Chemistry Laboratory, Department of Chemistry, University of Oxford, South Parks Road, Oxford OX1 3QZ, United Kingdom.
Moore WHD; Physical and Theoretical Chemistry Laboratory, Department of Chemistry, University of Oxford, South Parks Road, Oxford OX1 3QZ, United Kingdom.
Manolopoulos DE; Physical and Theoretical Chemistry Laboratory, Department of Chemistry, University of Oxford, South Parks Road, Oxford OX1 3QZ, United Kingdom.

J Chem Phys ; 154(17): 174104, 2021 May 07.

Article em En | MEDLINE | ID: mdl-34241048

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Texto completo: 1 Bases de dados: MEDLINE Idioma: En Revista: J Chem Phys Ano de publicação: 2021 Tipo de documento: Article País de afiliação: Reino Unido