February 22, 2025

The Vapour-Liquid Phase Diagram of Pure Methane Using Temperature Dependent Interaction Parameters: A Monte Carlo Simulation

Authors: Ibrahim Suleiman and Ali Al-Matar

DOI: https://doi.org/10.48103/jjeci212019

JORDANIAN JOURNAL OF ENGINEERING AND CHEMICAL INDUSTRIES (JJECI)

Pages: 1-5

Adopting temperature-dependent interaction parameters in the Lennard-Jones potential, the vapor-liquid phase diagram of methane was produced using NVT Gibbs Ensemble Monte Carlo technique. Published second virial coefficient data were used to fit a simple two-parameter temperature-dependent model for the interaction parameters. The simulations were carried out in the temperature range 120-190 K. The critical density and temperature were evaluated using Ising-scaling model. Using the
temperature-dependent interaction parameters in the simulation has reduced the root mean square deviation by 94.7% compared to the temperature-independent interaction parameters. The evaluated critical temperature was enhanced using temperature-dependent interaction parameters, whereas the simulations using temperature-independent interaction parameters predict a better critical density value.
Keywords: Phase diagram, TDIP, TIIP, Monte Carlo Simulation, Vapor-liquid equilibrium

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