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2018
78.
Molecular Thermodynamics of a Quantum Lennard-Jones fluid using an
effective Mie potential and the SAFT-VR-Mie approach
S. Contreras, C. Serna and A. Gil-Villegas
Molecular Physics 116, 3425 (2018)
77.
Semiclassical SAFT-VR-2D modeling of adsorption selectivities for binary mixtures of hydrogen and methane adsorbed onto MOF's
V. M. Trejos, A. Martínez and A. Gil-Villegas
Fluid Phase Equilibria 462, 153 (2018)
76.
Microcanonical-ensemble computer simulation of the high-temperature expansion coefficients of the Helmholtz free energy of a Square-Well fluid
F. Sastre, E. Moreno-Hilario, M. G. Sotelo-Serna and A. Gil-Villegas
Molecular Physics 116, 351 (2018)
2017
75.
Predicting adsorption isotherms for methanol and water onto different surfaces using the SAFT-VR-2D approach and molecular simulation
A. Martínez, V. M. Trejos and A. Gil-Villegas
Fluid Phase Equilibria 449, 207 (2017)
74.
Assessment by Monte Carlo computer simulations of the phase behavior of hard spherocylinders confined within cylindrical cavities
P. X. Viveros-Méndez, A. Gil-Villegas and S. Aranda-Espinoza
Journal of Chemical Physics 147, 234902 (2017)
73.
Computer simulation of effective potentials for generalized Boltzmann-Gibbs statistics
A. Gil-Villegas, J. Torres and O. Obregón
Journal of Molecular Liquids 248, 364 (2017)
2016
72.
Molecular Thermodynamics of Quantum Square-Well fluids using a Path-Integral Perturbation Theory
C. Serna and A. Gil-Villegas
Molecular Physics 114, 2700 (2016)
71.
Monte Carlo characterization of the GammaMed HDR Plus Ir-192 brachytherapy source
E. Reyes, M. Sosa, A. Gil-Villegas and E. Monzón
Biomedical Physics and Engineering Express 2, 015017 (2016)
2015
70.
Microcanonical ensemble simulation method applied to discrete potential fluids
F. Sastre, A. L. Benavides, J. Torres and A. Gil-Villegas
Physical Review E 92, 033303 (2015)
2014
69.
Monte Carlo computer simulation of sedimentation of charged hard spherocylinders
P. X. Viveros-Méndez, A. Gil-Villegas and S. Aranda-Espinoza
Journal of Chemical Physics 141, 044905 (2014)
68.
Theoretical modeling of adsorption of hydrogen onto graphene, MOF's and other carbon-based substrates
V. M. Trejos, M. Becerra, S. Figueroa-Gerstenmaier and A. Gil-Villegas
Molecular Physics 112, 2330 (2014)
2013
67.
Monte Carlo simulation of flexible trimers: from square-well chains to amphiphilic primitive models
G. Jiménez-Serratos, A. Gil-Villegas, C. Vega and F. J. Blas
Journal of Chemical Physics 139, 114901 (2013)
66.
Computer Simulation of Liquid-Vapor Coexistence of Confined Quantum Fluids
V. M. Trejos, A. Gil-Villegas and A. Martínez
Journal of Chemical Physics 139, 184505 (2013)
65.
Predicting Reactive Equilibria of Biodiesel's Fatty-Acid-Methyl-Esthers Compounds
F. Perdomo-Hurtado, B. Millán-Malo, G. Mendoza and A. Gil-Villegas
Journal of Molecular Liquids 185, 8 (2013)
64.
Generalized information entropies depending only on the probability distribution
O. Obregón and A. Gil-Villegas
Physical Review E 88, 062146 (2013)
2012
63.
Evaluation of the pressure tensor and surface tension for molecular fluids with
discontinuous potentials using the volume perturbation method
G. Jiménez-Serratos, C. Vega and A. Gil-Villegas
Journal of Chemical Physics 137, 204104 (2012)
62.
Semiclassical approach to model quantum fluids using the Statistical Associating Fluid Theory for systems
with potentials of variable range
V. M. Trejos-Montoya and A. Gil-Villegas
Journal of Chemical Physics 136, 184506 (2012)
61.
Computer simulation of sedimentation using the Wolf method
P. X. Viveros-Méndez and A. Gil-Villegas
Journal of Chemical Physics 136, 154507 (2012)
60.
Anomalous columnar order of charged colloidal platelets
L. Morales, H. Wensink, A. Galindo and A. Gil-Villegas
Journal of Chemical Physics , 034901 (2012)
2011
59.
Modeling adsorption isotherms of binary mixtures of Carbon Dioxide, Methane and Nitrogen
M. Castro, A. Martínez and A. Gil-Villegas
Adsorption Science and Technology 29, 59 (2011)
58.
Properties of a hard-core Yukawa fluid in a uniform gravitational field obtained by a hybrid DFT-Monte Carlo method
J. Torrres-Arenas, C. Avendaño, L. Morales and A. Gil-Villegas
Molecular Physics 109, 1467 (2011)
57.
Predicting thermophysical properties of biofuel blends using the SAFT-VR approach
F. Perdomo and A. Gil-Villegas
Fluid Phase Equil. 306, 124 (2011)
56.
Computer simulation of charged hard spherocylinders at low temperatures
G. Jiménez-Serratos, C. Avendaño, A. Gil-Villegas and E. González-Tovar
Mol. Phys. 109, 27 (2011)
2010
55.
Molecular Thermodynamics of Biodiesel Fuel Compounds
F. Perdomo and A. Gil-Villegas
Fluid Phase Equilibria 293, 182 (2010)
54.
Phase transitions of granular disks with magnetic dipoles
P. Coutino, N. Ibarra-Avalos and A. Gil-Villegas
Revista Mexicana de Física, 56, 435 (2009)
2009
53.
A Monte Carlo computer simulation study of mixtures of charged hard spherocylinders and charged hard spheres
C. Avendaño, A. Gil-Villegas and E. González Tovar
Chemical Physics Letters 470, 67 (2009)
52.
Predicting adsorption isotherms of asphaltenes in porous materials
M. Castro, J. L. Mendoza, E. Buenrostro, S. López and A. Gil-Villegas
Fluid Phase Equilibria, 286, 113 (2009)
2008
51.
Magnetic properties of synthetic eumelanin: preliminary results
M. E. Cano, R. Castañeda-Priego, A. Gil-Villegas, M. Sosa, P. Schio, A. J. A de Oliveira, F. Chen, O. Baffa y C. F. O Graeff.
Photochemistry and Photobiology, 84, 627 (2008)
50.
Molecular Thermodynamics of Adsorption using Systems with Discrete Potentials
G. Jiménez-Serratos, S. Santillán, C. Avendaño, M. Castro and A. Gil-Villegas
Oil & Gas Science and Technology, 63, 329 (2008)
49.
Computer simulation of charged hard spherocylinders
C. Avendaño, A. Gil-Villegas and E. González-Tovar
The Journal of Chemical Physics 128, 044506 (2008)
2007
48.
Excluded volume of hard cylinders of variable aspect ratio. Molecular Simulation
N. Ibarra-Ávalos, A. Gil-Villegas and A. Martínez-Richa
Molecular Simulation, 33, 505 (2007)
47.
Predicting adsorption isotherms using a two-dimensional Statistical Associating Fluid Theory
A. Martínez, M. Castro, C. M. McCabe and A. Gil-Villegas
The Journal of Chemical Physics, 126, 074707 (2007)
2006
46.
Thermodynamic and structural properties of confined discrete-potential fluids
A. L. Benavides, L. A. del Pino, A. Gil-Villegas and F. Sastre
J. Chem. Phys. 125, 204715 (2006)
45.
Monte Carlo simulations of primitive models for ionic systems using the Wolf method
C. Avendaño and A. Gil-Villegas
Molecular Physics, 104, 1475 (2006)
44.
Molecular Thermodynamics of Primitive Models of Complex Fluids
C. Avendaño, N. Ibarra-Ávalos, C. M, Quezada, J. Medina and A. Gil-Villegas
Revista Mexicana de Física S52, 85 (2006)
43.
Computer simulation of magnetic properties of human blood
M. E. Cano, A. Gil-Villegas, M. Sosa, J. L. Villagómez and O. Baffa
Chemical Physics Letters, 432, 548 (2006)
42.
On the phase behavior of Nitrogen+ n-Alkanes from the SAFT-VR approach: incorporating the effect of the
quadrupole moment
H. Zhao, P. Morgado, A. Gil-Villegas and C. McCabe
The Journal of Physical Chemistry B, 110, 24083 (2006).
41.
Predicting the phase diagram of 2D colloidal systems with long-range interactions
S. Mejía, A. Gil-Villegas, B. Ivlev and J. Ruíz-García
The Journal of Physical Chemistry B, 110 22230 (2006).
2004
40.
Asphaltene precipitation in crude oils: Theory and Experiments
E. Buenrostro- González, C. Lira, A. Gil-Villegas and J. Wu
American Institute of Chemical Engineers Journal 50, 2552 (2004)
2003
39.
Properties of confined square-well fluids using the Gibbs Ensemble simulation technique
L. A. del Pino, A. L. Benavides, and A. Gil-Villegas
Molecular Simulation, 29 (6-7), 345 (2003)
38.
Molecular view of the asphaltene aggregation behavior in asphaltene-resine mixtures
A. Ortega, S. A. Cruz, A. Gil-Villegas, F. Guevara, and C. Lira
Energy & Fuels 17, 1100, (2003)
2002
37.
Orthogonal functions invariant for the time dependent harmonic oscillator
M. Fernández-Guasti and A. Gil-Villegas
Physics Letters A, 292, 243 (2002)
36.
Orientational structure of dipolar hard-spherical colloids
O. Alarcón-Waess, E. Díaz-Herrera and A. Gil-Villegas
Physical Review E, 65, 031401 (2002)
35.
Computer simulation of two-dimensional colloidal systems
S. Mejía-Rosales, A. Gil-Villegas, B Ivlev and J. Ruíz-García
Journal of Physics: Condensed Matter 14, 4795 (2002)
34.
Predicting the phase diagram of a liquid crystal using the Convex-Peg model and the semi-empirical PM3
method
E. García, A. Martínez-Richa, A. Villegas, L. Mendoza-Huizar and A. Gil-Villegas
The Journal of Physical Chemistry A, 106, 10342 (2002)
2001
33.
Perturbation theory for mixtures of discrete potential fluids
A. Vidales, A. L. Benavides and A. Gil-Villegas
Molecular Physics 99, 703 (2001)
32.
A statistical associating fluid theory for electrolyte systems
A. Gil-Villegas, A. Galindo and G. Jackson
Molecular Physics, 99, 531 (2001)
2000
31.
Simulation study of
the phase behaviour of a primitive model for thermotropic liquid crystals: rodlike molecules with
terminal dipoles and flexible tails
J. van Duijneveldt, A. Gil-Villegas, G. Jackson and M. Allen
Journal of Chemical Physics, 112, 9092 (2000)
30.
Ermakov equation arising
from electromagnetic fields propagating in 1D inhomogeneous media
M. Fernández-Guasti, R. Diamant and A. Gil-Villegas
Revista Mexicana de Física, 46, 530 (2000)
1999
29.
The thermodynamics of molecules with discrete potentials
A. L. Benavides and A. Gil-Villegas
Molecular Physics, 97, No. 12, 1225 (1999)
28.
Gibbs ensemble computer simulation
and SAFT-VR theory of non-conformal square-well monomer dimer mixtures
C. M. McCabe, A. Gil-Villegas and G. Jackson
Chemical Physics Letters, 303, 27 (1999)
27.
The thermodynamics
of heteronuclear molecules formed from bonded square-well segments
C. M. McCabe, A. Gil-Villegas, G. Jackson and F. del Río
Molecular Physics, 97, 551 (1999)
26.
An analytical equation of state for
yukawa chain molecules
L. A. Davies, A. Gil-Villegas and G. Jackson
Journal of Chemical Physics, 111, 8659 (1999)
25.
SAFT-VRE: Phase behaviour
of electrolyte solutions with the Statistical Associating Fluid Theory for Potentials of Variable
Range
A. Galindo, A. Gil-Villegas, G. Jackson and A. N. Burgess
Journal of Physical Chemistry B, 103, 10272 (1999)
1998
24.
Computer simulation of dipolar liquid crystals
A. Gil-Villegas, S. C. McGrother and G. Jackson
Journal of Molecular Liquids, 76, 171 (1998)
23.
The thermodynamics of mixtures and the
corresponding mixing rules in the SAFT-VR approach
A. Galindo, L. A. Davies, A. Gil-Villegas and G. Jackson
Molecular Physics, 93, 241 (1998)
22.
Phase equilibria of a square-well
monomer dimer mixture: Gibbs ensemble computer simulation and the Statistical Associating Fluid Theory for potentials
of Variable Range
L. A. Davies, A. Gil-Villegas, G. Jackson, S. Calero and S. Lago
Physical Review E, 57, 2035 (1998)
21.
Predicting the high-pressure phase equilibria of
methane + n-hexane using the SAFT-VR approach
C. M. McCabe, A. Gil-Villegas and G. Jackson
Journal of Physical Chemistry B, 102, 4183 (1998)
20.
Describing the properties of chains of segments
interacting via soft-core potentials of variable range
L. Ann Davies, A. Gil-Villegas and G. Jackson
International Journal of Thermophysics, 19, 675 (1998)
19.
Predicting the high-pressure phase
equilibria of binary mixtures of n-alkanes using the SAFT-VR approach
C. M. McCabe, A. Galindo, A. Gil-Villegas and G. Jackson
International Journal of Thermophysics, 19, 1511 (1998)
18.
Predicting the high-pressure
phase equilibria of binary mixtures of perfluoro-n-alkanes + n-alkanes using the SAFT-VR approach
C. M. McCabe, A. Galindo, A. Gil-Villegas and George Jackson
Journal of Physical Chemistry B, 102, 8060 (1998)
17.
The effect of dipolar interactions on the
liquid crystalline phase transitions of hard spherocylinders with central longitudinal dipoles
S. C. McGrother, A. Gil-Villegas and G. Jackson
Molecular Physics, 95, 657 (1998)
16.
Prediction of
phase equilibria for refrigerant mixtures of difluoromethane (HFC-32), 1,1,1,2-tetrafluoroethane
(HFC-134 a) and 1,1,1,2,2-pentafluoroethane (HFC-125 a) using the SAFT-VR approach
A. Galindo, A. Gil-Villegas, P. J. Whitehead, G. Jackson and A. Burgess
Journal of Physical Chemistry B, 102, 7632 (1998)
1997
15.
Statistical associating fluid theory for chain molecules with attractive potentials of variable range
A. Gil-Villegas, A. Galindo, P. J. Whitehead, S. Mills, G. Jackson and A. Burgess
Journal of Chemical Physics, 106, 4168 (1997).
14.
Chain and ring structures in smectic
phases of molecules with transverse dipoles
A. Gil-Villegas, S. C. McGrother and G. Jackson
Chemical Physics Letters, 269, 441 (1997)
13.
Reaction field and Ewald summation
methods in Monte Carlo simulations of dipolar liquid crystals
A. Gil-Villegas, S. C. McGrother and G. Jackson
Molecular Physics, 92, 723 (1997)
1996
12.
Deviations from
corresponding-states behavior in the vapor-liquid equilibrium of the square-well fluid
A. Gil-Villegas, F. del Río, and A. L. Benavides
Fluid Phase Equilibria, 119, 97 (1996)
11.
Themodynamics of fluids by mapping the
collision properties
A. Gil-Villegas, F. del Río and C. Vega
Physical Review E, 53, 2326 (1996)
10.
The liquid crystalline phase behaviour
of hard-spherocylinders with terminal point dipoles
S. C. McGrother, A. Gil-Villegas and G. Jackson
Journal of Physics: Condensed Matter, 8,
9649 (1996)
9.
Collision diameters, interaction
potentials, and virial coefficients of small quasi-spherical molecules
F. del Río, E. Ramos, A. Gil-Villegas and I. McLure
Journal of Physical Chemistry,
100, 9104 (1996)
1995
8.
Structure of
variable-width square-well fluids from the Reference Hypernetted Chain Equation
A. Gil-Villegas, C. Vega, F. del Río and A. Malijevsky
Molecular
Physics, 86, 857 (1995)
1993
7.
Theoretical equation of state for
classical fluids I. Test by perturbation theory
A. Gil-Villegas, M. Chávez and F. del Río
Revista Mexicana de Física, 39,
513 (1993)
6.
Properties of the square-well fluid of
variable width V. Equation of state for intermediate ranges
A. Gil-Villegas and F. del Río
Revista Mexicana de Física,
39, 526 (1993)
5.
Teoría de Sistemas Equivalentes en Termodinámica
Molecular
A. Gil-Villegas
Tesis de Doctorado en Ciencias (Física),
Universidad Autónoma Metropolitana-Iztapalapa, México
(Diciembre 1993; Examen de Grado 5 de enero de 1994)
1992
4.
Collision frequencies and mean collision
parameters in the Lennard-Jones system
F. del Río and A. Gil-Villegas
Molecular Physics, 77, 223 (1992)
1991
3.
Monolayer adsorption of the square-well
fluid of variable range
F. del Río and A. Gil-Villegas
Journal of Physical Chemistry, 95, 788 (1991)
1989
2.
Fabricación de hologramas con un láser
sinotizable pulsado
M. Fernández-Guasti, D. Iturbe-Castillo, A. Silva, A. Gil-Villegas, H.
González and R. López
Revista Mexicana de Física, 35, 410 (1989)
1988
1.
Propagation of rays in a duct with
a radially variable refractive index: first integral solutions for gaussian profiles
M. Fernández-Guasti and A. Gil-Villegas
Optics
Communications, 69, 105 (1988)
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