Hard disk model

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Hard disks are hard spheres in two dimensions. The hard disk intermolecular pair potential is given by[1] [2]

\( \Phi_{12}\left( r \right) = \left\{ \begin{array}{lll} \infty & ; & r < \sigma \\ 0 & ; & r \ge \sigma \end{array} \right. \)

where \( \Phi_{12}\left(r \right) \) is the intermolecular pair potential between two disks at a distance \(r := |\mathbf{r}_1 - \mathbf{r}_2|\), and \( \sigma \) is the diameter of the disk. This page treats hard disks in a two-dimensional space, for three dimensions see the page hard disks in a three dimensional space.

Contents

[edit] Phase transitions

Despite the apparent simplicity of this model/system, the phase behaviour and the nature of the phase transitions remains an area of active study ever since the early work of Alder and Wainwright [3]. In a recent publication by Mak [4] using over 4 million particles \((2048^2)\) one appears to have the phase diagram isotropic \((\eta < 0.699)\), a hexatic phase, and a solid phase \((\eta > 0.723)\) (the maximum possible packing fraction is given by \(\eta = \pi / \sqrt{12} \approx 0.906899...\) [5]) . Similar results have been found using the BBGKY hierarchy [6] and by studying tessellations (the hexatic region: \(0.680 < \eta < 0.729\)) [7].

[edit] Equations of state

Main article: Equations of state for hard disks

[edit] Virial coefficients

Main article: Hard sphere: virial coefficients

[edit] References

  1. Nicholas Metropolis, Arianna W. Rosenbluth, Marshall N. Rosenbluth, Augusta H. Teller and Edward Teller, "Equation of State Calculations by Fast Computing Machines", Journal of Chemical Physics 21 pp.1087-1092 (1953)
  2. W. W. Wood "Monte Carlo calculations of the equation of state of systems of 12 and 48 hard circles", Los Alamos Scientific Laboratory Report LA-2827 (1963)
  3. B. J. Alder and T. E. Wainwright "Phase Transition in Elastic Disks", Physical Review 127 pp. 359-361 (1962)
  4. C. H. Mak "Large-scale simulations of the two-dimensional melting of hard disks", Physical Review E 73 065104(R) (2006)
  5. L. Fejes Tóth "Über einen geometrischen Satz." Mathematische Zeitschrift 46 pp. 83-85 (1940)
  6. Jarosław Piasecki, Piotr Szymczak, and John J. Kozak "Prediction of a structural transition in the hard disk fluid", Journal of Chemical Physics 133 164507 (2010)
  7. John J. Kozak, Jack Brzezinski and Stuart A. Rice "A Conjecture Concerning the Symmetries of Planar Nets and the Hard disk Freezing Transition", Journal of Physical Chemistry B 112 pp. 16059-16069 (2008)

Related reading

[edit] External links

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