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Perturbation Theories for the Thermodynamic Properties of Fluids and Solids

Solana, J. R

1st edition, 2013

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Progress in the Perturbation Approach in Fluid and Fluid-Related Theories

Chemical reviews, 2009-06, Vol.109 (6), p.2829-2858

2009

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The First Three Coefficients in the High Temperature Series Expansion of Free Energy for Simple Potential Models with Hard-Sphere Cores and Continuous Tails

The journal of physical chemistry. B, 2013-08, Vol.117 (31), p.9305-9313

2013

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Thermodynamic properties of a hard-core Lennard-Jones fluid from computer simulation and the coupling parameter series expansion

Molecular physics, 2016-09, Vol.114 (16-17), p.2391-2399

2016

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Integral equation theories for fluid with very short-range screened Coulomb plus power series interactions

Molecular physics, 2023-01, Vol.121 (2)

2023

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Thermodynamic properties of fluids with Lennard-Jones-Gauss potential from computer simulation and the coupling parameter series expansion

Molecular physics, 2018-02, Vol.116 (4), p.491-506

2018

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On the choice of the effective diameter in the high-temperature expansion for the Lennard-Jones fluid

Molecular physics, 2022-04, Vol.120 (7)

2022

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Thermodynamic properties of fluids with Mie n − m potentials and application to tune effective Mie potentials for simple real fluids

Molecular simulation, 2024-02, Vol.50 (3), p.236-245

2024

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Monte Carlo and theoretical calculations of the first four perturbation coefficients in the high temperature series expansion of the free energy for discrete and core-softened potential models

The Journal of chemical physics, 2013-06, Vol.138 (24), p.244115-244115

2013

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Low temperature behavior of thermodynamic perturbation theory

Physical chemistry chemical physics : PCCP, 2009-01, Vol.11 (48), p.11528-11537

2009

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Equilibrium thermodynamic properties of Lennard-Jones fluid mixtures from a single-component effective fluid model

Molecular simulation, 2023-07, Vol.49 (11), p.1117-1124

2023

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Monte Carlo simulation and theoretical calculation of the thermodynamic properties of binary hard-core Lennard-Jones fluid mixtures

Molecular simulation, 2020-09, Vol.46 (14), p.1116-1124

2020

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Equations of state of hard-body fluids: a new proposal

Molecular physics, 2015-05, Vol.113 (9-10), p.1003-1013

Solana, J.R.

2015

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Square-well mixtures revisited: computer simulation, mixing rules and one-fluid theory

Molecular simulation, 2020-01, Vol.46 (2), p.102-110

2020

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Excellence of numerical differentiation method in calculating the coefficients of high temperature series expansion of the free energy and convergence problem of the expansion

The Journal of chemical physics, 2014-12, Vol.141 (24), p.244506-244506

2014

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The role of higher-order terms in perturbation approaches to the monomer and bonding contributions in a SAFT-type equation of state for square-well chain fluids

Molecular physics, 2018-07, Vol.116 (13), p.1706-1721

2018

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Excess energy and equation of state of fluids with hard-core potential models from a second-order Monte Carlo perturbation theory

Fluid phase equilibria, 2010-11, Vol.298 (2), p.262-269

2010

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Thermodynamic Properties of Model Solids with Short-Ranged Potentials from Monte Carlo Simulations and Perturbation Theory

The journal of physical chemistry. B, 2007-08, Vol.111 (34), p.10194-10201

2007

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Performance of equations of state for additive hard-disk fluid mixtures for extreme diameter ratios

Fluid phase equilibria, 2006-01, Vol.239 (1), p.46-51

2006

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Thermodynamic properties of double square-well fluids:Computer simulations and theory

The Journal of chemical physics, 2008-12, Vol.129 (24), p.244502-244502-10

Solana, J. R.

2008

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Inquiry into thermodynamic behavior of hard sphere plus repulsive barrier of finite height

The Journal of chemical physics, 2009-11, Vol.131 (20), p.204503-204503-13

2009

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Comprehensive investigation about the second order term of thermodynamic perturbation expansion

The Journal of chemical physics, 2009-10, Vol.131 (13), p.134106-134106

2009

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Liquid-liquid transition in a simple model fluid with competitive interactions

Molecular physics, 2024-05

2024

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Coupling parameter series expansion for fluid with square-well plus repulsive-square-barrier potential

AIP advances, 2013-10, Vol.3 (10), p.102103-102103-15

2013

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Pair correlation function of short-ranged square-well fluids

The Journal of chemical physics, 2005-02, Vol.122 (8), p.84510-84510

2005

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Perturbation Theories for the Thermodynamic Properties of Fluids and Solids

Progress in the Perturbation Approach in Fluid and Fluid-Related Theories

The First Three Coefficients in the High Temperature Series Expansion of Free Energy for Simple Potential Models with Hard-Sphere Cores and Continuous Tails

Thermodynamic properties of a hard-core Lennard-Jones fluid from computer simulation and the coupling parameter series expansion

Integral equation theories for fluid with very short-range screened Coulomb plus power series interactions

Thermodynamic properties of fluids with Lennard-Jones-Gauss potential from computer simulation and the coupling parameter series expansion

On the choice of the effective diameter in the high-temperature expansion for the Lennard-Jones fluid

Thermodynamic properties of fluids with Mie n − m potentials and application to tune effective Mie potentials for simple real fluids

Monte Carlo and theoretical calculations of the first four perturbation coefficients in the high temperature series expansion of the free energy for discrete and core-softened potential models

Low temperature behavior of thermodynamic perturbation theory

Equilibrium thermodynamic properties of Lennard-Jones fluid mixtures from a single-component effective fluid model

Monte Carlo simulation and theoretical calculation of the thermodynamic properties of binary hard-core Lennard-Jones fluid mixtures

Equations of state of hard-body fluids: a new proposal

Square-well mixtures revisited: computer simulation, mixing rules and one-fluid theory

Excellence of numerical differentiation method in calculating the coefficients of high temperature series expansion of the free energy and convergence problem of the expansion

The role of higher-order terms in perturbation approaches to the monomer and bonding contributions in a SAFT-type equation of state for square-well chain fluids

Excess energy and equation of state of fluids with hard-core potential models from a second-order Monte Carlo perturbation theory

Thermodynamic Properties of Model Solids with Short-Ranged Potentials from Monte Carlo Simulations and Perturbation Theory

Performance of equations of state for additive hard-disk fluid mixtures for extreme diameter ratios

Thermodynamic properties of double square-well fluids:Computer simulations and theory

Inquiry into thermodynamic behavior of hard sphere plus repulsive barrier of finite height

Comprehensive investigation about the second order term of thermodynamic perturbation expansion

Liquid-liquid transition in a simple model fluid with competitive interactions

Coupling parameter series expansion for fluid with square-well plus repulsive-square-barrier potential

Pair correlation function of short-ranged square-well fluids

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