Concepedia

Transferability Of Potentials

Transferability of Potentials is a property of interatomic potentials that refers to their ability to accurately reproduce material behavior across diverse chemical environments, structural configurations, and thermodynamic conditions beyond those used in their parametrization.

42

Publications

3.4K

Citations

126

Authors

64

Institutions

Publications per year

2017–2026

14

Variants

Potential Transferability

Parents

Publications

42

Quantum and statistical mechanical studies of liquids. 10. Transferable intermolecular potential functions for water, alcohols, and ethers. Application to liquid water

William L. Jorgensen · Journal of the American Chemical Society · 1981 · 1.3K citations

, , +11

Additional condition for transferability in pseudopotentials

Michael P. Teter · Physical review. B, Condensed matter · 1993 · 245 citations

, , +17

A new general methodology for deriving transferable atomic potentials in molecules

G. Nicolas, Ph. Durand · The Journal of Chemical Physics · 1979 · 199 citations

, , +10

Quantum and statistical mechanical studies of liquids. 11. Transferable intermolecular potential functions. Application to liquid methanol including internal rotation

William L. Jorgensen · Journal of the American Chemical Society · 1981 · 160 citations

, , +10

Transferability of pseudopotentials

Stefan Goedecker, K. Maschke · Physical Review A · 1992 · 123 citations

, , +11

1–5 of 42

Authors

126

  1. JR
    J. Richard Elliott

    University of Akron, United States

    3 publications · 87 citations

    3

    h-index

  2. CO
    Christoph Ortner

    University of Warwick, United Kingdom

    2 publications · 126 citations

    2

    h-index

  3. JL
    Julien Lam

    Centre National de la Recherche Scientifique, France

    2 publications · 44 citations

    2

    h-index

  4. WL
    William L. Jorgensen

    Yale University, United States

    2 publications · 1.5K citations

    2

    h-index

  5. ZN
    Z. Nevin Gerek

    Arizona State University, United States

    2 publications · 71 citations

    2

    h-index

1–5 of 126

Institutions

64

  1. University of Akron

    Akron, United States

    3 h-index

    11 publications

    332 citations

  2. Centre National de la Recherche Scientifique

    Paris, France

    3 h-index

    6 publications

    158 citations

  3. University of Cambridge

    Cambridge, United Kingdom

    3 h-index

    5 publications

    335 citations

  4. University of Missouri

    Columbia, United States

    2 h-index

    3 publications

    143 citations

  5. University of California, Davis

    Davis, United States

    2 h-index

    4 publications

    174 citations

  6. Centre d’Élaboration de Matériaux et d’Études Structurales

    Toulouse, France

    2 h-index

    5 publications

    110 citations

  7. University of Warwick

    Coventry, United Kingdom

    2 h-index

    3 publications

    225 citations

  8. École Polytechnique Fédérale de Lausanne

    Lausanne, Switzerland

    2 h-index

    3 publications

    268 citations

1–8 of 64

Venues

  1. The Journal of Chemical Physics

    4 publications · 283 citations

    4

    h-index

  2. Fluid Phase Equilibria

    3 publications · 57 citations

    3

    h-index

  3. Journal of the American Chemical Society

    JACS · 3 publications · 1.5K citations

    3

    h-index

  4. Chemical Physics Letters

    3 publications · 116 citations

    3

    h-index

  5. Molecular Simulation

    2 publications · 40 citations

    2

    h-index

1–5