Mie potential

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The Mie potential was proposed by Gustav Mie in 1903 [1]. It is given by

Φ12(r)=(nn−m)(nm)m/(n−m)ϵ[(σr)n−(σr)m]

where:

  • r:=|r1−r2|
  • Φ12(r) is the intermolecular pair potential between two particles at a distance r;
  • σ is the value of r at Φ(r)=0 ;
  • ϵ : well depth (energy)

Note that when n=12 and m=6 this becomes the Lennard-Jones model.

The location of the potential minimum is given by

rmin=(nmσn−m)1/(n−m)

(14,7) model

[2] [3]

Second virial coefficient

The second virial coefficient [4] [5] [6] and the Vliegenthart–Lekkerkerker relation [7].

References

Related reading