Square shoulder model: Difference between revisions

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'''Related reading'''
'''Related reading'''
*[http://dx.doi.org/10.1088/0953-8984/9/1/001 A R Denton and H Löwen  "Isostructural solid - solid transitions in square-shoulder systems", Journal of Physics: Condensed Matter '''9''' pp. L1-L5  (1997)]
*[http://dx.doi.org/10.1088/0953-8984/9/1/001 A. R. Denton and H Löwen  "Isostructural solid - solid transitions in square-shoulder systems", Journal of Physics: Condensed Matter '''9''' pp. L1-L5  (1997)]
*[http://dx.doi.org/10.1088/0953-8984/9/2/006  Peter Bolhuis and Daan Frenkel "Isostructural solid - solid transitions in systems with a repulsive `shoulder' potential", Journal of Physics: Condensed Matter '''9''' pp. 381-387  (1997)]
*[http://dx.doi.org/10.1088/0953-8984/9/2/006  Peter Bolhuis and Daan Frenkel "Isostructural solid - solid transitions in systems with a repulsive `shoulder' potential", Journal of Physics: Condensed Matter '''9''' pp. 381-387  (1997)]
*[http://dx.doi.org/10.1063/1.3006065  Gernot J. Pauschenwein and Gerhard Kahl "Zero temperature phase diagram of the square-shoulder system", Journal of Chemical Physics '''129''' 174107 (2008)]
*[http://dx.doi.org/10.1063/1.3006065  Gernot J. Pauschenwein and Gerhard Kahl "Zero temperature phase diagram of the square-shoulder system", Journal of Chemical Physics '''129''' 174107 (2008)]
*[http://dx.doi.org/10.1063/1.3265984 Shiqi Zhou and J. R. Solana "Inquiry into thermodynamic behavior of hard sphere plus repulsive barrier of finite height", Journal of Chemical Physics '''131''' 204503 (2009)]
*[http://dx.doi.org/10.1063/1.3265984 Shiqi Zhou and J. R. Solana "Inquiry into thermodynamic behavior of hard sphere plus repulsive barrier of finite height", Journal of Chemical Physics '''131''' 204503 (2009)]
*[http://dx.doi.org/10.1080/00268976.2011.562472 S. B. Yuste, A. Santos and M. López de Haro "Structure of the square-shoulder fluid", Molecular Physics '''109''' pp. 987-995 (2011)]
*[http://dx.doi.org/10.1080/00268976.2011.562472 S. B. Yuste, A. Santos and M. López de Haro "Structure of the square-shoulder fluid", Molecular Physics '''109''' pp. 987-995 (2011)]
 
*[http://dx.doi.org/10.1063/1.4801659  S. P. Hlushak, P. A. Hlushak, and A. Trokhymchuk "An improved first-order mean spherical approximation theory for the square-shoulder fluid", Journal of Chemical Physics '''138''' 164107 (2013)]
*[http://dx.doi.org/10.1080/00268976.2016.1154199 M. López de Haro, S. B. Yuste and A. Santos "Theoretical approaches to the structural properties of the square-shoulder fluid", Molecular Physics '''114''' pp. 2382-2390 (2016)]
*[http://dx.doi.org/10.1063/1.4977934  Harini Pattabhiraman and Marjolein Dijkstra "Phase behaviour of quasicrystal forming systems of core-corona particles", Journal of Chemical Physics '''146''' 114901 (2017)]


[[Category: Models]]
[[Category: Models]]

Latest revision as of 16:38, 23 March 2017

The square shoulder model is given by [1]

where is the intermolecular pair potential, is the height of the shoulder, is the distance between site 1 and site 2 , σ is the hard diameter and λ > 1.

Direct correlation function[edit]

The direct correlation function [2]

Equation of State[edit]

[3].

Binary mixture[edit]

[4]

References[edit]

Related reading