Fundamental-measure theory: Difference between revisions
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<ref>[http://dx.doi.org/10.1103/PhysRevLett.63.980 Yaakov Rosenfeld "Free-energy model for the inhomogeneous hard-sphere fluid mixture and density-functional theory of freezing", Physical Review Letters '''63''' 980-983 (1989)]</ref> | <ref>[http://dx.doi.org/10.1103/PhysRevLett.63.980 Yaakov Rosenfeld "Free-energy model for the inhomogeneous hard-sphere fluid mixture and density-functional theory of freezing", Physical Review Letters '''63''' 980-983 (1989)]</ref> | ||
==Modified fundamental measure theory-White Bear I== | ==Modified fundamental measure theory-White Bear I== | ||
Modified fundamental measure theory-White Bear I <ref>[http://dx.doi.org/10.1088/0953-8984/14/46/313 R. Roth, R. Evans, A. Lang, and G. Kahl "Fundamental measure theory for hard-sphere mixtures revisited: the White Bear version", Journal of Physics: Condensed Matter '''14''' pp. 12063 (2002)] ( http://whitebear-bristol.co.uk/ )</ref> <ref>[http://dx.doi.org/10.1063/1.1520530 Y. Yu | Modified fundamental measure theory-White Bear I <ref>[http://dx.doi.org/10.1088/0953-8984/14/46/313 R. Roth, R. Evans, A. Lang, and G. Kahl "Fundamental measure theory for hard-sphere mixtures revisited: the White Bear version", Journal of Physics: Condensed Matter '''14''' pp. 12063 (2002)] ( http://whitebear-bristol.co.uk/ )</ref> <ref>[http://dx.doi.org/10.1063/1.1520530 Y. Yu and J. Wu, “Structures of hard-sphere fluids from a modified fundamental measure theory”, Journal of Chemical Physics, 117, 22, 10156-10164(2002)] (http://www.engr.ucr.edu/jwu/ )</ref> <ref>[http://dx.doi.org/10.1063/1.1763142 Y. Yu, J. Wu, Y. Xin and G. Gao, “Structures and correlation functions of multicomponent and polydisperse hard-sphere mixtures from a density functional theory”, Journal of Chemical Physics, 121, 3, 1535-1541(2004)] (http://www.engr.ucr.edu/jwu/ )</ref> uses the [[Equations of state for hard sphere mixtures#Mansoori, Carnahan, Starling, and Leland| Mansoori, Carnahan, Starling, and Leland]] equation of state for [[multicomponent and polydisperse hard-sphere mixtures]]. | ||
==White Bear II== | ==White Bear II== | ||
Revision as of 17:45, 24 August 2015
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Fundamental-measure theory
Rosenfeld
Modified fundamental measure theory-White Bear I
Modified fundamental measure theory-White Bear I [2] [3] [4] uses the Mansoori, Carnahan, Starling, and Leland equation of state for multicomponent and polydisperse hard-sphere mixtures.
White Bear II
White Bear II [5].
References
- ↑ Yaakov Rosenfeld "Free-energy model for the inhomogeneous hard-sphere fluid mixture and density-functional theory of freezing", Physical Review Letters 63 980-983 (1989)
- ↑ R. Roth, R. Evans, A. Lang, and G. Kahl "Fundamental measure theory for hard-sphere mixtures revisited: the White Bear version", Journal of Physics: Condensed Matter 14 pp. 12063 (2002) ( http://whitebear-bristol.co.uk/ )
- ↑ Y. Yu and J. Wu, “Structures of hard-sphere fluids from a modified fundamental measure theory”, Journal of Chemical Physics, 117, 22, 10156-10164(2002) (http://www.engr.ucr.edu/jwu/ )
- ↑ Y. Yu, J. Wu, Y. Xin and G. Gao, “Structures and correlation functions of multicomponent and polydisperse hard-sphere mixtures from a density functional theory”, Journal of Chemical Physics, 121, 3, 1535-1541(2004) (http://www.engr.ucr.edu/jwu/ )
- ↑ Hendrik Hansen-Goos and Roland Roth "Density functional theory for hard-sphere mixtures: the White Bear version mark II", Journal of Physics: Condensed Matter 18 pp. 8413-8426 (2006)
- Related reading
- E. Kierlik and M. L. Rosinberg "Free-energy density functional for the inhomogeneous hard-sphere fluid: Application to interfacial adsorption", Physical Review A 42 pp. 3382 - 3387 (1990)
- P. Tarazona, J.A. Cuesta and Y. Martínez-Ratón "Density Functional Theories of Hard Particle Systems", in "Theory and Simulation of Hard-Sphere Fluids and Related Systems", Lecture Notes in Physics 753/2008 pp. 247-341 Springer (2008)
- Roland Roth "Fundamental measure theory for hard-sphere mixtures: a review", Journal of Physics: Condensed Matter 22 063102 (2010)
- R. Evans "Density Functional Theory for Inhomogeneous Fluids I: Simple FLuids in Equlibrium", Lecture notes at 3rd Warsaw School of Statistical Physics, Kazimierz Dolny, June 2009 pp. 43-85 Warsaw University Press (2010)