Exp-6 potential: Difference between revisions

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(Corrected functional form: r_min NOT sigma)
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The '''exp-6 potential''' (or '''Exp-Six''' potential) is a modified form of the [[Buckingham potential]] and is given by (Eq. 1 in <ref>[http://dx.doi.org/10.1063/1.1740026 Edward A. Mason "Transport Properties of Gases Obeying a Modified Buckingham (Exp‐Six) Potential", Journal of Chemical Physics '''22''' pp. 169-186 (1954)]</ref>):
The '''exp-6 potential''' (or '''Exp-Six''' potential) is a modified form of the [[Buckingham potential]] and is given by (Eq. 1 in <ref>[http://dx.doi.org/10.1063/1.1740026 Edward A. Mason "Transport Properties of Gases Obeying a Modified Buckingham (Exp‐Six) Potential", Journal of Chemical Physics '''22''' pp. 169-186 (1954)]</ref>):



Latest revision as of 10:04, 14 May 2015

The exp-6 potential (or Exp-Six potential) is a modified form of the Buckingham potential and is given by (Eq. 1 in [1]):

where

  • is the intermolecular pair potential between two particles or sites
  • is the value of at which is a minimum.
  • is the well depth (energy)
  • is the "steepness" of the repulsive energy

Melting point[edit]

An approximate method to locate the melting point is given in [2]. See also [3].

See also[edit]

References[edit]

Related reading