Revised Damping Parameters for the D3 Dispersion Correction to Density Functional Theory.

Smith, Daniel G A; Burns, Lori A; Patkowski, Konrad; Sherrill, C David

Smith, Daniel G A; Burns, Lori A; Patkowski, Konrad; Sherrill, C David.

Afiliação

Smith DG; Department of Chemistry and Biochemistry, Auburn University , Auburn, Alabama 36849, United States.
Burns LA; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry, Georgia Institute of Technology , Atlanta, Georgia 30332-0400, United States.
Patkowski K; Department of Chemistry and Biochemistry, Auburn University , Auburn, Alabama 36849, United States.
Sherrill CD; Center for Computational Molecular Science and Technology, School of Chemistry and Biochemistry and School of Computational Science and Engineering, Georgia Institute of Technology , Atlanta, Georgia 30332-0400, United States.

J Phys Chem Lett ; 7(12): 2197-203, 2016 Jun 16.

Article em En | MEDLINE | ID: mdl-27203625

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: J Phys Chem Lett Ano de publicação: 2016 Tipo de documento: Article País de afiliação: Estados Unidos País de publicação: Estados Unidos

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