Analytical equation of state with three-body forces: Application to noble gases
We developed an explicit equation of state (EOS) for small non polar molecules by means of
an effective two-body potential. The average effect of three-body forces was incorporated as …
an effective two-body potential. The average effect of three-body forces was incorporated as …
Analytic equation of state for Mie (α, β) fluids based on an improved Ross variation perturbation theory
H Guérin - Journal of Molecular Liquids, 2021 - Elsevier
The analytic expressions of thermodynamic properties obtained by Sun for multi-Yukawa
fluids from the Ross variation perturbation theory (Mol. Phys. 105 (2007) 3139) can be used …
fluids from the Ross variation perturbation theory (Mol. Phys. 105 (2007) 3139) can be used …
Analytical molecular-based equation of state applied to dense supercritical Buckingham Exp (α, m) fluids modelled by two-Yukawa potentials and application to the N2 …
H Guérin - Journal of Molecular Liquids, 2024 - Elsevier
Abstract In this Short Communication an efficient procedure to fit closely the repulsive part of
a given spherical intermolecular potential ϕ (r) with a two-Yukawa function is introduced and …
a given spherical intermolecular potential ϕ (r) with a two-Yukawa function is introduced and …
Математическое моделирование термодинамических свойств жидкости на основе двойного потенциала Юкавы. Аналитические результаты
ИК Локтионов - Теплофизика высоких температур, 2019 - mathnet.ru
ВВЕДЕНИЕ В статистической механике задача описания равновесных
термодинамических свойств может быть решена в рамках одного из следующих …
термодинамических свойств может быть решена в рамках одного из следующих …
Structure and thermodynamics of a short-range Lennard-Jones fluid reference
V Hordiichuk, J Škvára, A Trokhymchuk… - Journal of Molecular …, 2023 - Elsevier
As an attempt to develop a 'realistic', and yet theoretically tractable reference fluid for the
development of a perturbed molecular-base equation of state for non-associating fluids, a …
development of a perturbed molecular-base equation of state for non-associating fluids, a …
First-order mean spherical approximation (FMSA) for the Buckingham Exp (αE, m) potential
H Guérin - Journal of Molecular Liquids, 2020 - Elsevier
The first-order mean spherical approximation (FMSA) is applied to the Buckingham Exp (α E,
m) fluids by using a simple mapping between the Buckingham and two-Yukawa potentials …
m) fluids by using a simple mapping between the Buckingham and two-Yukawa potentials …
Molecular thermodynamic modeling of ionic liquids using the perturbation-based linear Yukawa isotherm regularity
MS Mahboub, H Farrokhpour - Journal of Physics: Condensed …, 2016 - iopscience.iop.org
In this paper, we present the results of an extensive study on a novel approach to the
molecular modeling of pure ionic liquids (ILs) that incorporates the perturbed …
molecular modeling of pure ionic liquids (ILs) that incorporates the perturbed …
Equation of state and critical point behavior of hard-core double-Yukawa fluids
J Montes, M Robles, M López de Haro - The Journal of Chemical …, 2016 - pubs.aip.org
A theoretical study on the equation of state and the critical point behavior of hard-core
double-Yukawa fluids is presented. Thermodynamic perturbation theory, restricted to first …
double-Yukawa fluids is presented. Thermodynamic perturbation theory, restricted to first …
Mathematical modeling of thermodynamic properties of a fluid based on the Yukawa double potential: Analytical results
IK Loktionov - High Temperature, 2019 - Springer
The equilibrium thermodynamic properties of a simple fluid with an interatomic potential in
the form of a superposition of double Yukawa potentials is calculated. The proposed …
the form of a superposition of double Yukawa potentials is calculated. The proposed …
Vapour/liquid coexistence in long-range Yukawa fluids determined by means of an augmented van der Waals approach
The vapour–liquid phase diagram of long-range Yukawa fluids with the decay parameter z
σ≤ 1 is calculated by means of an augmented van der Waals theory based on the reference …
σ≤ 1 is calculated by means of an augmented van der Waals theory based on the reference …