SPC/F model of water

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The SPC/F model is a modified version of the simple point-charge model SPC for water. The SPC model is rigid, whilst the SPC/F model is flexible. This model gives the correct density and dielectric permittivity of water. The model implemented in the computer programs MDynaMix and Abalone.

References

  1. Kahled Toukan and Aneesur Rahman "Molecular-dynamics study of atomic motions in water", Physical Review B 31 pp. 2643 - 2648 (1985)