On the public citation graph

Calculation of Partition Functions and Free Energies of a Binary Mixture Using the Energy Partitioning Method: Application to Carbon Dioxide and Methane

https://doi.org/10.1021/jp212168f
0 signed · 72 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.
Claim with ORCID
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 See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/jcc.21337openalex-snapshot
Absolute free energies estimated by combining precalculated molecular fragment libraries
inferredcites →https://doi.org/10.1007/s002140050345openalex-snapshot
Calculating Gibbs free energies of transfer from Gibbs ensemble Monte Carlo simulations
inferredcites →https://doi.org/10.1016/0021-9991(77)90121-8openalex-snapshot
Nonphysical sampling distributions in Monte Carlo free-energy estimation: Umbrella sampling
inferredcites →https://doi.org/10.1016/0370-2693(91)91256-uopenalex-snapshot
Multicanonical algorithms for first order phase transitions
inferredcites →https://doi.org/10.1016/b978-0-12-267351-1.x5000-7openalex-snapshot
Understanding Molecular Simulation: From Algorithms to Applications
inferredcites →https://doi.org/10.1016/j.fluid.2009.11.011openalex-snapshot
First principles models of the interactions of methane and carbon dioxide
inferredcites →https://doi.org/10.1016/s0378-3812(00)00315-0openalex-snapshot
Vapor+liquid equilibrium of water, carbon dioxide, and the binary system, water+carbon dioxide, from molecular simulation
inferredcites →https://doi.org/10.1021/j100031a034openalex-snapshot
Carbon Dioxide's Liquid-Vapor Coexistence Curve And Critical Properties as Predicted by a Simple Molecular Model
inferredcites →https://doi.org/10.1021/ja964218qopenalex-snapshot
Predicting Multicomponent Phase Equilibria and Free Energies of Transfer for Alkanes by Molecular Simulation
inferredcites →https://doi.org/10.1021/je00020a002openalex-snapshot
Vapor + Liquid Equilibria for the Ternary System Methane + Ethane + Carbon Dioxide at 230 K and Its Constituent Binaries at Temperatures from 207 to 270 K
inferredcites →https://doi.org/10.1021/jp060734jopenalex-snapshot
An Efficient, Path-Independent Method for Free-Energy Calculations
inferredcites →https://doi.org/10.1021/jp072357wopenalex-snapshot
Absolute Free-Energy Calculations of Liquids Using a Harmonic Reference State
inferredcites →https://doi.org/10.1021/jp108647popenalex-snapshot
Structural and Dynamic Properties of the New Alternative Refrigerant 2,3,3,3-Tetrafluoro-1-propene (HFO-1234yf) in the Liquid State
inferredcites →https://doi.org/10.1021/jp201520uopenalex-snapshot
Monte Carlo Simulations of High-Pressure Phase Equilibria of CO2–H2O Mixtures
inferredcites →https://doi.org/10.1021/jp909769copenalex-snapshot
Gibbs Ensemble Monte Carlo Simulations of Binary Mixtures of Methane, Difluoromethane, and Carbon Dioxide
inferredcites →https://doi.org/10.1021/jp990822mopenalex-snapshot
Transferable Potentials for Phase Equilibria. 3. Explicit-Hydrogen Description of Normal Alkanes
inferredcites →https://doi.org/10.1038/35084292openalex-snapshot
Phenomenal fluids
inferredcites →https://doi.org/10.1039/c0cp00620copenalex-snapshot
Microscopic structure of liquid 1-1-1-2-tetrafluoroethane (R134a) from Monte Carlo simulation
inferredcites →https://doi.org/10.1039/c1cp21419eopenalex-snapshot
Molecular simulation of the binary mixture of 1–1–1–2–tetrafluoroethane and carbon dioxide
inferredcites →https://doi.org/10.1063/1.1463055openalex-snapshot
Density-of-states Monte Carlo method for simulation of fluids
inferredcites →https://doi.org/10.1063/1.1517606openalex-snapshot
Free energy disconnectivity graphs: Application to peptide models
inferredcites →https://doi.org/10.1063/1.1615966openalex-snapshot
An improved Monte Carlo method for direct calculation of the density of states
inferredcites →https://doi.org/10.1063/1.1616515openalex-snapshot
The free energy landscape and dynamics of met-enkephalin
inferredcites →https://doi.org/10.1063/1.1625920openalex-snapshot
Absolute entropy and free energy of fluids using the hypothetical scanning method. II. Transition probabilities from canonical Monte Carlo simulations of partial systems
inferredcites →https://doi.org/10.1063/1.1734110openalex-snapshot
Some Topics in the Theory of Fluids
inferredcites →https://doi.org/10.1063/1.1740409openalex-snapshot
High-Temperature Equation of State by a Perturbation Method. I. Nonpolar Gases
inferredcites →https://doi.org/10.1063/1.2174008openalex-snapshot
Simple estimation of absolute free energies for biomolecules
inferredcites →https://doi.org/10.1063/1.2794042openalex-snapshot
Applications of Wang-Landau sampling to determine phase equilibria in complex fluids
inferredcites →https://doi.org/10.1063/1.3059008openalex-snapshot
Additive and nonadditive models of vapor-liquid equilibrium in CO2 from first principles
inferredcites →https://doi.org/10.1063/1.3269674openalex-snapshot
Absolute free energies and equilibrium ensembles of dense fluids computed from a nondynamic growth method
inferredcites →https://doi.org/10.1063/1.3567308openalex-snapshot
First principles predictions of thermophysical properties of refrigerant mixtures
inferredcites →https://doi.org/10.1063/1.3656296openalex-snapshot
Rapid calculation of partition functions and free energies of fluids
inferredcites →https://doi.org/10.1063/1.477787openalex-snapshot
Critical point and phase behavior of the pure fluid and a Lennard-Jones mixture
inferredcites →https://doi.org/10.1063/1.480050openalex-snapshot
Simulation of a free energy upper bound, based on the anticorrelation between an approximate free energy functional and its fluctuation
inferredcites →https://doi.org/10.1073/pnas.0308197101openalex-snapshot
A simulation method for calculating the absolute entropy and free energy of fluids: Application to liquid argon and water
inferredcites →https://doi.org/10.1080/00268978900102641openalex-snapshot
Computer simulations in the Gibbs ensemble
inferredcites →https://doi.org/10.1088/0953-8984/4/12/006openalex-snapshot
Novel scheme to study structural and thermal properties of continuously deformable molecules
inferredcites →https://doi.org/10.1103/physrev.184.151openalex-snapshot
Phase Transitions of the Lennard-Jones System
inferredcites →https://doi.org/10.1103/physreva.1.1266openalex-snapshot
Perturbation Theory of Fluids at High Temperatures
inferredcites →https://doi.org/10.1103/physreva.32.3709openalex-snapshot
Computer simulation of the free energy of polymer chains with excluded volume and with finite interactions
inferredcites →https://doi.org/10.1103/physrevb.44.5081openalex-snapshot
Critical behavior of the three-dimensional Ising model: A high-resolution Monte Carlo study
inferredcites →https://doi.org/10.1103/physreve.52.602openalex-snapshot
Critical-point and coexistence-curve properties of the Lennard-Jones fluid: A finite-size scaling study
inferredcites →https://doi.org/10.1103/physreve.55.6624openalex-snapshot
Critical end point behavior in a binary fluid mixture
inferredcites →https://doi.org/10.1103/physreve.66.056703openalex-snapshot
Generalization of the Wang-Landau method for off-lattice simulations
inferredcites →https://doi.org/10.1103/physrevlett.48.630openalex-snapshot
Unbiased Estimation of Corrections to Scaling by Partial Differential Approximants
inferredcites →https://doi.org/10.1103/physrevlett.61.2635openalex-snapshot
New Monte Carlo technique for studying phase transitions
inferredcites →https://doi.org/10.1103/physrevlett.63.1195openalex-snapshot
Optimized Monte Carlo data analysis
inferredcites →https://doi.org/10.1103/physrevlett.82.476openalex-snapshot
Transition Matrix Monte Carlo Reweighting and Dynamics
inferredcites →https://doi.org/10.1103/physrevlett.86.2050openalex-snapshot
Efficient, Multiple-Range Random Walk Algorithm to Calculate the Density of States

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.4773676openalex-extracted
The Phase Diagram of Mercedes Benz Model of Water Using Nested Sampling Algorithm and Molecular Dynamics Simulations
inferred← citeshttps://doi.org/10.1016/j.commatsci.2018.04.028openalex-snapshot
A self-contained algorithm for determination of solid-liquid equilibria in an alloy system
inferred← citeshttps://doi.org/10.1016/j.cpc.2015.12.005openalex-snapshot
Exploiting molecular dynamics in Nested Sampling simulations of small peptides
inferred← citeshttps://doi.org/10.1016/j.cplett.2015.08.056openalex-snapshot
Spectroscopic and structural analysis of mixed carbon dioxide and fluorinated methane clusters
inferred← citeshttps://doi.org/10.1016/j.fluid.2024.114192openalex-snapshot
The phase diagram of Mercedes Benz model of water using nested sampling algorithm and molecular dynamics simulations
inferred← citeshttps://doi.org/10.1021/acs.jctc.8b01142openalex-snapshot
Potential Mean Force from Umbrella Sampling Simulations: What Can We Learn and What Is Missed?
inferred← citeshttps://doi.org/10.1021/ct3007056openalex-snapshot
Density of States Partitioning Method for Calculating the Free Energy of Solids
inferred← citeshttps://doi.org/10.1039/d4cc05615aopenalex-snapshot
Accelerated interfacial hole transfer over Au/TiO 2 photocatalysts for highly efficient oxidative coupling of methane
inferred← citeshttps://doi.org/10.1063/1.4867498openalex-snapshot
Evaluation of the grand-canonical partition function using expanded Wang-Landau simulations. III. Impact of combining rules on mixtures properties
inferred← citeshttps://doi.org/10.1063/1.4933309openalex-snapshot
Nested sampling of isobaric phase space for the direct evaluation of the isothermal-isobaric partition function of atomic systems
inferred← citeshttps://doi.org/10.1063/1.4944619openalex-snapshot
Evaluation of the grand-canonical partition function using expanded Wang-Landau simulations. IV. Performance of many-body force fields and tight-binding schemes for the fluid phases of silicon
inferred← citeshttps://doi.org/10.1063/1.4961386openalex-snapshot
Reverse energy partitioning—An efficient algorithm for computing the density of states, partition functions, and free energy of solids
inferred← citeshttps://doi.org/10.1080/00268976.2015.1090634openalex-snapshot
An efficientmethod to determine chemical potential of mixtures in the isothermal and isobaric bulk phase with kineticMonte Carlo simulation
inferred← citeshttps://doi.org/10.1080/08927022.2013.819102openalex-snapshot
On the inner workings of Monte Carlo codes
inferred← citeshttps://doi.org/10.1080/08927022.2017.1416113openalex-snapshot
Computing free energies using nested sampling-based approaches
inferred← citeshttps://doi.org/10.1088/1361-648x/abd33bopenalex-snapshot
Efficient approaches to solutions of partition function for condensed matters
inferred← citeshttps://doi.org/10.1101/169532openalex-snapshot
Evaluating the accuracy of the umbrella sampling plots with different dissociation paths, conformational changes, and structure preparation
inferred← citeshttps://doi.org/10.1103/physrevb.93.174108openalex-snapshot
Determining pressure-temperature phase diagrams of materials
inferred← citeshttps://doi.org/10.1103/physreve.89.022302openalex-snapshot
Nested sampling for materials: The case of hard spheres
inferred← citeshttps://doi.org/10.1103/physrevlett.120.250601openalex-snapshot
Nested Transition Path Sampling
inferred← citeshttps://doi.org/10.1140/epjb/s10051-021-00172-1openalex-snapshot
Nested sampling for materials
inferred← citeshttps://doi.org/10.3390/e21111050openalex-snapshot
Comparison of Two Efficient Methods for Calculating Partition Functions
inferred← citeshttps://doi.org/10.3390/nano9070978openalex-snapshot
A New Model to Predict Optimum Conditions for Growth of 2D Materials on a Substrate
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.