相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。The surface tension of TIP4P/2005 water model using the Ewald sums for the dispersion interactions
Jose Alejandre et al.
JOURNAL OF CHEMICAL PHYSICS (2010)
Monte Carlo calculation of the methane-water interfacial tension at high pressures
F. Biscay et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Calculation of the surface tension from Monte Carlo simulations: Does the model impact on the finite-size effects?
F. Biscay et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Dependence of the liquid-vapor surface tension on the range of interaction: A test of the law of corresponding states
Patrick Grosfils et al.
JOURNAL OF CHEMICAL PHYSICS (2009)
Monte Carlo Simulations of the Pressure Dependence of the Water-Acid Gas Interfacial Tensions
F. Biscay et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Transferable Force Field for Alcohols and Polyalcohols
Nicolas Ferrando et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Calculation of the long-range interactions for interfacial properties
Florent Goujon et al.
MOLECULAR SIMULATION (2009)
Calculation of the surface tension of cyclic and aromatic hydrocarbons from Monte Carlo simulations using an anisotropic united atom model (AUA)
F. Biscay et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Surface tension of water and acid gases from Monte Carlo simulations
A. Ghoufi et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Multiple histogram reweighting method for the surface tension calculation
A. Ghoufi et al.
JOURNAL OF CHEMICAL PHYSICS (2008)
Surface Tensions of Linear and Branched Alkanes from Monte Carlo Simulations Using the Anisotropic United Atom Model
F. Biscay et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2008)
Expressions for local contributions to the surface tension from the virial route
A. Ghoufi et al.
PHYSICAL REVIEW E (2008)
Calculation of surface tension via area sampling
Jeffrey R. Errington et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Anisotropic united atom model including the electrostatic interactions of methylbenzenes. I. Thermodynamic and structural properties
Carlos Nieto-Draghi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Anisotropic united atom model including the electrostatic interactions of methylbenzenes. II. Transport properties
Carlos Nieto-Draghi et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2007)
Comparative study of the effect of tail corrections on surface tension determined by molecular simulation
Vincent K. Shen et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Molecular simulations of the n-alkane liquid-vapor interface:: Interfacial properties and their long range corrections
C. Ibergay et al.
PHYSICAL REVIEW E (2007)
Surface tension of the most popular models of water by using the test-area simulation method
C. Vega et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Anisotropic united atom model including the electrostatic interactions of benzene
Patrick Bonnaud et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
A general purpose model for the condensed phases of water: TIP4P/2005
JLF Abascal et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Structure, thermodynamics, and liquid-vapor equilibrium of ethanol from molecular-dynamics simulations using nonadditive interactions
S Patel et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Test-area simulation method for the direct determination of the interfacial tension of systems with continuous or discontinuous potentials
GJ Gloor et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Oscillatory surface tension due to finite-size effects -: art. no. 114702
P Orea et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Liquid-vapor interface of methanol-water mixtures: A molecular dynamics study
TM Chang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Molecular dynamics simulations of the surface tension of ionic liquids -: art. no. 104710
M González-Melchor et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Stress anisotropy induced by periodic boundary conditions -: art. no. 094503
M González-Melchor et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Optimized intermolecular potential for aromatic hydrocarbons based on anisotropic united atoms. III. Polyaromatic and naphthenoaromatic hydrocarbons
MG Ahunbay et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Optimized intermolecular potential for aromatic hydrocarbons based on anisotropic united atoms. 1. Benzene
RO Contreras-Camacho et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Optimized intermolecular potential for aromatic hydrocarbons based on anisotropic united atoms. 2. Alkylbenzenes and styrene
RO Contreras-Camacho et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Monte Carlo versus molecular dynamics simulations in heterogeneous systems: An application to the n-pentane liquid-vapor interface
F Goujon et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Transferable potentials for phase equilibria. 6. United-atom description for ethers, glycols, ketones, and aldehydes
JM Stubbs et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2004)
Many-body interactions in liquid methanol and its liquid/vapor interface: A molecular dynamics study
LX Dang et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Molecular dynamics study of mass accommodation of methanol at liquid-vapor interfaces of methanol/water binary solutions of various concentrations
A Morita
CHEMICAL PHYSICS LETTERS (2003)
New optimization method for intermolecular potentials: Optimization of a new anisotropic united atoms potential for olefins: Prediction of equilibrium properties
E Bourasseau et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Molecular simulations of liquid-liquid interfacial properties: Water-n-alkane and water-methanol-n-alkane systems
JL Rivera et al.
PHYSICAL REVIEW E (2003)
Thermodynamic and transport properties of simple fluids using lattice sums:: bulk phases and liquid-vapour interface
J López-Lemus et al.
MOLECULAR PHYSICS (2002)
Direct Monte Carlo simulations of the equilibrium properties of n-pentane liquid-vapor interface
F Goujon et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Monte Carlo simulation of branched alkanes and long chain N-alkanes with anisotropic united atoms intermolecular potential
E Bourasseau et al.
MOLECULAR SIMULATION (2002)
Monte Carlo calculations for alcohols and their mixtures with alkanes. Transferable potentials for phase equilibria. 5. United-atom description of primary, secondary, and tertiary alcohols
B Chen et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2001)
Vapour-liquid phase equilibria of n-alkanes by direct Monte Carlo simulations
F Goujon et al.
MOLECULAR SIMULATION (2001)
Optimization of the anisotropic united atoms intermolecular potential for n-alkanes
P Ungerer et al.
JOURNAL OF CHEMICAL PHYSICS (2000)