UFF force field

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Universal Force Field (UFF)

Functional form[edit]

Parameters[edit]

References[edit]

  1. A. K. Rappe, C. J. Casewit, K. S. Colwell, W. A. Goddard, and W. M. Skiff "UFF, a full periodic table force field for molecular mechanics and molecular dynamics simulations", Journal of the American Chemical Society 114 pp. 10024 - 10035 (1992)
  2. Anthony K. Rappe and William A. Goddard "Charge equilibration for molecular dynamics simulations",Journal of Physical Chemistry 95 pp. 3358 - 3363 (1991)