Cleaving method

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The cleaving method[1][2] is a computer simulation technique for calculating the Helmholtz energy function of a solid-fluid interface.

[edit] References

  1. J. Q. Broughton and G. H. Gilmer "Molecular dynamics investigation of the crystal–fluid interface. VI. Excess surface free energies of crystal–liquid systems", Journal of Chemical Physics 84 pp. 5759- (1986)
  2. Ruslan L. Davidchack and Brian B. Laird "Direct Calculation of the Hard-Sphere Crystal /Melt Interfacial Free Energy", Physical Review Letters 85 pp. 4751-4754 (2000)
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