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Phase equilibria and critical behavior of square‐well fluids of variable width by Gibbs ensemble Monte Carlo simulation
The vapor–liquid phase equilibria of square‐well systems with hard‐sphere diameters σ,
well‐depths ε, and ranges λ= 1.25, 1.375, 1.5, 1.75, and 2 are determined by Monte Carlo …
well‐depths ε, and ranges λ= 1.25, 1.375, 1.5, 1.75, and 2 are determined by Monte Carlo …
Progress in the perturbation approach in fluid and fluid-related theories
S Zhou, JR Solana - Chemical reviews, 2009 - ACS Publications
Since the formulation of the so-called high temperature series expansion (HTSE) by
Zwanzig, 1 thermodynamic perturbation theories developed along this line have been one of …
Zwanzig, 1 thermodynamic perturbation theories developed along this line have been one of …
Monte Carlo study of phase separation in aqueous protein solutions
A Lomakin, N Asherie, GB Benedek - The Journal of chemical physics, 1996 - pubs.aip.org
The binary liquid phase separation of aqueous solutions of γ‐crystallins is utilized to gain
insight into the microscopic interactions between these proteins. The interactions are …
insight into the microscopic interactions between these proteins. The interactions are …
A completely analytic perturbation theory for the square-well fluid of variable well width
J Chang, SI Sandler - Molecular Physics, 1994 - Taylor & Francis
We present an analytic equation of state, without any adjustable parameters, for the square-
well fluid of variable well width (1⩽ λ⩽ 2) based on perturbation theory using the real …
well fluid of variable well width (1⩽ λ⩽ 2) based on perturbation theory using the real …
Vapor-liquid equilibrium and critical behavior of the square-well fluid of variable range: A theoretical study
E Schöll-Paschinger, AL Benavides… - The Journal of …, 2005 - pubs.aip.org
The vapor-liquid phase behavior and the critical behavior of the square-well (SW) fluid are
investigated as a function of the interaction range, λ∊[1.25, 3], by means of the self …
investigated as a function of the interaction range, λ∊[1.25, 3], by means of the self …
The thermodynamics of molecules with discrete potentials
Fluids formed by molecules interacting with discrete potentials are examined in the context
of perturbation theory and the reference hypernetted chain equation (RHNC) solution to the …
of perturbation theory and the reference hypernetted chain equation (RHNC) solution to the …
Deviations from corresponding-states behavior in the vapor-liquid equilibrium of the square-well fluid
The vapor-liquid equilibrium of the square-well (SW) fluid of variable range is studied. The
analysis focuses on the dependence on the SW range, which exhibits deviations from …
analysis focuses on the dependence on the SW range, which exhibits deviations from …
Optimized equation of the state of the square-well fluid of variable range based on a fourth-order free-energy expansion
R Espíndola-Heredia, F del Río… - The Journal of chemical …, 2009 - pubs.aip.org
The free energy of square-well (SW) systems of hard-core diameter σ with ranges 1≤ λ≤ 3
is expanded in a perturbation series. This interval covers most ranges of interest, from short …
is expanded in a perturbation series. This interval covers most ranges of interest, from short …
Generalized equation of state for square-well potentials of variable range
An equation of state for square-well fluids of short and long potential range λ is presented
and compared with Gibbs ensemble and canonical Monte Carlo simulation data; vapour …
and compared with Gibbs ensemble and canonical Monte Carlo simulation data; vapour …
Properties of the square-well fluid of variable width: III. Long-range expansion
The Helmholtz free-energy of a square-well fluid is studied as a function of the range of the
well. A high-temperature perturbation expansion is carried out to second order, which is …
well. A high-temperature perturbation expansion is carried out to second order, which is …