On the public citation graph
Optimized Intermolecular Potential for Aromatic Hydrocarbons Based on Anisotropic United Atoms. III. Polyaromatic and Naphthenoaromatic Hydrocarbons
0 signed · 79 inferred · view as graph
Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.
Is this your work? Sign in with ORCID and put your name on the
claims that are yours.
Reference health. See whether every reference in this work resolves to a
known work and none has been retracted — and get a dated CiteStamped
badge you can embed.
What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1002/jcc.540140208openalex-snapshot
Monte Carlo simulations of pure liquid substituted benzenes with OPLS potential functions
inferredcites →https://doi.org/10.1016/0167-7322(88)80022-9openalex-snapshot
Computer Simulation of Liquids
inferredcites →https://doi.org/10.1016/j.fluid.2004.06.053openalex-snapshot
Prediction of thermodynamic properties of heavy hydrocarbons by Monte Carlo simulation
inferredcites →https://doi.org/10.1016/s0040-6031(03)00139-4openalex-snapshot
Measurement of the enthalpies of vaporization and sublimation of solids aromatic hydrocarbons by differential scanning calorimetry
inferredcites →https://doi.org/10.1021/ja00168a022openalex-snapshot
Aromatic-aromatic interactions: free energy profiles for the benzene dimer in water, chloroform, and liquid benzene
inferredcites →https://doi.org/10.1021/jp001044xopenalex-snapshot
Transferable Potentials for Phase Equilibria. 4. United-Atom Description of Linear and Branched Alkenes and Alkylbenzenes
inferredcites →https://doi.org/10.1021/jp014190ropenalex-snapshot
Prediction of Equilibrium Properties of Cyclic Alkanes by Monte Carlo SimulationNew Anisotropic United Atoms Intermolecular PotentialNew Transfer Bias Method
inferredcites →https://doi.org/10.1021/jp048692ropenalex-snapshot
Optimized Intermolecular Potential for Aromatic Hydrocarbons Based on Anisotropic United Atoms. 2. Alkylbenzenes and Styrene
inferredcites →https://doi.org/10.1021/jp048693jopenalex-snapshot
Optimized Intermolecular Potential for Aromatic Hydrocarbons Based on Anisotropic United Atoms. 1. Benzene
inferredcites →https://doi.org/10.1021/jp972543+openalex-snapshot
Transferable Potentials for Phase Equilibria. 1. United-Atom Description of n -Alkanes
inferredcites →https://doi.org/10.1021/jp9835061openalex-snapshot
Theoretical Studies of the Hydrolysis of the Methyl Phosphate Anion
inferredcites →https://doi.org/10.1021/jp990988nopenalex-snapshot
A New Intermolecular Potential Model for the n-Alkane Homologous Series
inferredcites →https://doi.org/10.1063/1.1537245openalex-snapshot
New optimization method for intermolecular potentials: Optimization of a new anisotropic united atoms potential for olefins: Prediction of equilibrium properties
inferredcites →https://doi.org/10.1063/1.458709openalex-snapshot
Molecular dynamics calculation of the equation of state of alkanes
inferredcites →https://doi.org/10.1063/1.469563openalex-snapshot
Computer simulations of vapor–liquid phase equilibria of n -alkanes
inferredcites →https://doi.org/10.1063/1.476429openalex-snapshot
On the simulation of vapor–liquid equilibria for alkanes
inferredcites →https://doi.org/10.1063/1.479283openalex-snapshot
Determination of potential parameters for alkanes
inferredcites →https://doi.org/10.1063/1.480282openalex-snapshot
Hyper-parallel tempering Monte Carlo: Application to the Lennard-Jones fluid and the restricted primitive model
inferredcites →https://doi.org/10.1063/1.480308openalex-snapshot
New intermolecular potential models for benzene and cyclohexane
inferredcites →https://doi.org/10.1063/1.481116openalex-snapshot
Optimization of the anisotropic united atoms intermolecular potential for n-alkanes
inferredcites →https://doi.org/10.1080/00268970110097866openalex-snapshot
Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble
inferredcites →https://doi.org/10.1080/00268977600101631openalex-snapshot
On the structure of liquid benzene
inferredcites →https://doi.org/10.1080/00268978700101491openalex-snapshot
Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble
inferredcites →https://doi.org/10.1080/00268979300100641openalex-snapshot
A concerted rotation algorithm for atomistic Monte Carlo simulation of polymer melts and glasses
inferredcites →https://doi.org/10.1080/08927020290018723openalex-snapshot
Monte Carlo simulation of branched alkanes and long chain n -alkanes with anisotropic united atoms intermolecular potential
inferredcites →https://doi.org/10.1093/oso/9780198803195.001.0001openalex-snapshot
Computer Simulation of Liquids
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
inferred← citeshttps://doi.org/10.2139/ssrn.4570324openalex-extracted
Selectivity of Dodecylamine Hydrochloride on the Surface of Gypsum and Quartz: Mechanism and Application
inferred← citeshttps://doi.org/10.1002/minf.201700028openalex-snapshot
Chemoinformatics at IFP Energies Nouvelles: Applications in the Fields of Energy, Transport, and Environment
inferred← citeshttps://doi.org/10.1002/sia.7320openalex-snapshot
Selective flotation separation of gypsum and quartz using dodecyl amine hydrochloride as collector: Mechanism and application
inferred← citeshttps://doi.org/10.1007/s00894-008-0301-4openalex-snapshot
Optimized intermolecular potential for nitriles based on Anisotropic United Atoms model
inferred← citeshttps://doi.org/10.1016/j.carbon.2006.02.029openalex-snapshot
Analysis of the evolution of the pore size distribution and the pore network connectivity of a porous carbon during activation
inferred← citeshttps://doi.org/10.1016/j.ces.2011.11.001openalex-snapshot
Multilayer adsorption of benzene on graphitised thermal carbon black—The importance of quadrupole and explicit hydrogen in the potential model
inferred← citeshttps://doi.org/10.1016/j.fluid.2005.06.009openalex-snapshot
Extension of the anisotropic united atoms intermolecular potential to amines, amides and alkanols
inferred← citeshttps://doi.org/10.1016/j.fluid.2007.03.016openalex-snapshot
Hydrogen/hydrocarbon phase equilibrium modelling with a cubic equation of state and a Monte Carlo method
inferred← citeshttps://doi.org/10.1016/j.fluid.2010.09.020openalex-snapshot
Ethanoled gasoline bubble pressure determination: Experimental and Monte Carlo modeling
inferred← citeshttps://doi.org/10.1016/j.fluid.2011.02.008openalex-snapshot
Thermodynamic study of binary systems containing sulphur dioxide: Measurements and molecular modelling
inferred← citeshttps://doi.org/10.1016/j.fluid.2012.03.011openalex-snapshot
Equilibrium and transport properties of CO2+N2O and CO2+NO mixtures: Molecular simulation and equation of state modelling study
inferred← citeshttps://doi.org/10.1016/j.fluid.2012.03.012openalex-snapshot
Prediction of critical properties for Naphthacene, Triphenylene and Chrysene by Wang–Landau simulations
inferred← citeshttps://doi.org/10.1016/j.fluid.2018.01.035openalex-snapshot
Guaiacol and its mixtures: New data and predictive models part 1: Phase equilibrium
inferred← citeshttps://doi.org/10.1016/j.fluid.2018.11.030openalex-snapshot
Prediction of the boiling and critical points of polycyclic aromatic hydrocarbons via Wang-Landau simulations and machine learning
inferred← citeshttps://doi.org/10.1016/j.micromeso.2009.01.031openalex-snapshot
Structure, energetics and diffusion properties of isomers of trimethyl benzene in β zeolite: Uptake and Monte Carlo simulation study
inferred← citeshttps://doi.org/10.1016/j.molliq.2006.12.019openalex-snapshot
Molecular simulation of the thermophysical properties of fluids: From understanding toward quantitative predictions
inferred← citeshttps://doi.org/10.1016/j.molliq.2026.129514openalex-snapshot
Density, viscosity and self-diffusion coefficient of ethylene glycol oligomers conforming to PEG200 with AUA4 force field
inferred← citeshttps://doi.org/10.1021/acs.energyfuels.4c03921openalex-snapshot
Application of the SAFT-γ Mie Equation of State for Reservoir-Fluid Modeling in the Petroleum Industry
inferred← citeshttps://doi.org/10.1021/acs.jced.2c00063openalex-snapshot
Molecular Simulation of Benzene Adsorption in Graphitic and Amorphous Carbon Slit Pores
inferred← citeshttps://doi.org/10.1021/acs.jpca.2c08335openalex-snapshot
Comprehensive Automated Routine Implementation, Validation, and Benchmark of the Anisotropic Force Field (AUA4) Using Python and GROMACS
inferred← citeshttps://doi.org/10.1021/ef300106zopenalex-snapshot
Composition Analysis and Viscosity Prediction of Complex Fuel Mixtures Using a Molecular-Based Approach
inferred← citeshttps://doi.org/10.1021/ie051302iopenalex-snapshot
Phase Behavior of Binary Stockmayer and Polarizable Lennard-Jones Fluid Mixtures Using Adiabatic Nuclear and Electronic Sampling
inferred← citeshttps://doi.org/10.1021/jp060326fopenalex-snapshot
Low-Temperature Vapor−Liquid Equilibria from Parallelized Molecular Dynamics Simulations. Application to 1- and 2-Methylnaphthalene
inferred← citeshttps://doi.org/10.1021/jp067695wopenalex-snapshot
Anisotropic United Atom Model Including the Electrostatic Interactions of Benzene
inferred← citeshttps://doi.org/10.1021/jp068570uopenalex-snapshot
An Anisotropic United Atoms (AUA) Potential for Thiophenes
inferred← citeshttps://doi.org/10.1021/jp073715yopenalex-snapshot
Anisotropic United Atom Model Including the Electrostatic Interactions of Methylbenzenes. II. Transport Properties
inferred← citeshttps://doi.org/10.1021/jp101649gopenalex-snapshot
Extension of a Charged Anisotropic United Atoms Model to Polycyclic Aromatic Compounds
inferred← citeshttps://doi.org/10.1021/jp1117213openalex-snapshot
Prediction of the Surface Tension of the Liquid−Vapor Interface of Alcohols from Monte Carlo Simulations
inferred← citeshttps://doi.org/10.1021/jp203278topenalex-snapshot
A Transferable Force Field To Predict Phase Equilibria and Surface Tension of Ethers and Glycol Ethers
inferred← citeshttps://doi.org/10.1021/jp212060uopenalex-snapshot
Transferable Force Field for Carboxylate Esters: Application to Fatty Acid Methylic Ester Phase Equilibria Prediction
inferred← citeshttps://doi.org/10.1021/jp302972popenalex-snapshot
Transferable Force Field for Equilibrium and Transport Properties in Linear and Branched Monofunctional and Multifunctional Amines. II. Secondary and Tertiary Amines
inferred← citeshttps://doi.org/10.1021/jp307328xopenalex-snapshot
Transferable Potentials for Phase Equilibria. 10. Explicit-Hydrogen Description of Substituted Benzenes and Polycyclic Aromatic Compounds
inferred← citeshttps://doi.org/10.1021/jp401251wopenalex-snapshot
Prediction of Phase Equilibrium and Hydration Free Energy of Carboxylic Acids by Monte Carlo Simulations
inferred← citeshttps://doi.org/10.1021/jp802282popenalex-snapshot
Anisotropic United-Atoms (AUA) Potential for Alcohols
inferred← citeshttps://doi.org/10.1021/jp810915zopenalex-snapshot
Transferable Force Field for Alcohols and Polyalcohols
inferred← citeshttps://doi.org/10.1039/b823295dopenalex-snapshot
Calculation of the surface tension of cyclic and aromatic hydrocarbons from Monte Carlo simulations using an anisotropic united atom model (AUA)
inferred← citeshttps://doi.org/10.1063/1.2403855openalex-snapshot
Quantum mechanical polarizable force field (QMPFF3): Refinement and validation of the dispersion interaction for aromatic carbon
inferred← citeshttps://doi.org/10.1063/1.2714953openalex-snapshot
Optimized molecular force field for sulfur hexafluoride simulations
inferred← citeshttps://doi.org/10.1063/1.3544926openalex-snapshot
Surface tension of water–alcohol mixtures from Monte Carlo simulations
inferred← citeshttps://doi.org/10.1080/00268970903544238openalex-snapshot
Phase equilibria of polyaromatic hydrocarbons by hybrid Monte Carlo Wang–Landau simulations
inferred← citeshttps://doi.org/10.1080/08927020701209919openalex-snapshot
Effective critical point location: application to thiophenes
inferred← citeshttps://doi.org/10.1080/08927020701245509openalex-snapshot
Molecular simulation applied to fluid properties in the oil and gas industry
inferred← citeshttps://doi.org/10.1080/08927020801993370openalex-snapshot
Optimisation of the dynamical behaviour of the anisotropic united atom model of branched alkanes: application to the molecular simulation of fuel gasoline
inferred← citeshttps://doi.org/10.1080/08927021003752846openalex-snapshot
Calculation of diffusion coefficient for supercritical carbon dioxide and carbon dioxide+naphthalene system by molecular dynamics simulation using EPM2 model
inferred← citeshttps://doi.org/10.1080/08927022.2014.942660openalex-snapshot
Structure and dynamics of cumene and 1,2,4-trimethylbenzene mixture in NaY zeolite: a molecular dynamics simulation study
inferred← citeshttps://doi.org/10.2516/ogst/2012037openalex-snapshot
Influence of the Periodic Boundary Conditions on the Fluid Structure and on the Thermodynamic Properties Computed from the Molecular Simulations
inferred← citeshttps://doi.org/10.2516/ogst/2013134openalex-snapshot
Molecular Simulation of Adsorption in Microporous Materials
inferred← citeshttps://doi.org/10.2516/ogst/2013144openalex-snapshot
Equilibrium and Transport Properties of Primary, Secondary and Tertiary Amines by Molecular Simulation
inferred← citeshttps://doi.org/10.2516/ogst:2006040aopenalex-snapshot
Applications of Molecular Simulation in Oil and Gas Production and Processing
inferred← citeshttps://doi.org/10.2516/ogst:2008021openalex-snapshot
Near Critical Coexistence for an AUA Model of Thiophenes
inferred← citeshttps://doi.org/10.70675/b1aba297z87d1z4beeza916ze19a37fd87cdopenalex-snapshot
Modélisation gros-grain d'interfaces complexes polymère/polymère
inferred← citeshttps://doi.org/10.70675/d7189af6z18dez4c14zba6fz18bd43604da5openalex-snapshot
Potentiels intermoléculaires et algorithmes de monte carlo : application à l'étude des composés oxygénés
Editorial review for independent work. ICSAC — the Institute for Complexity
Science and Advanced Computing — runs a structured editorial panel for researchers
publishing outside journals, and publishes on CiteStamp rails. Submission is free
and goes through ORCID: icsacinstitute.org/submit.