A thermodynamically consistent pseudo-potential lattice Boltzmann model for multi-component, multiphase, partially miscible mixtures

TL;DR

This paper develops a thermodynamically consistent pseudo-potential lattice Boltzmann model for multi-component, multiphase mixtures, accurately predicting phase behavior of partially miscible hydrocarbons by ensuring proper force splitting and mass transfer.

Contribution

It introduces a novel force splitting method based on component volatility to achieve thermodynamic consistency in multi-component lattice Boltzmann simulations.

Findings

Accurately predicts phase behavior of hydrocarbon mixtures

Ensures thermodynamic consistency via force splitting

Allows mass transfer across phase interfaces

Abstract

Current multi-component, multiphase pseudo-potential lattice Boltzmann models have thermodynamic inconsistencies that prevent them to correctly predict the thermodynamic phase behavior of partially miscible multi-component mixtures, such as hydrocarbon mixtures. This paper identifies these inconsistencies and attempts to design a thermodynamically consistent multi-component, multiphase pseudo-potential lattice Boltzmann model that allows mass transfer across the phase interfaces and is capable to predict the phase behavior of typically partially miscible hydrocarbon mixtures. The designed model defines the total interaction force for the entire phase and split the force into individual components. Through a properly derived force split factor associated with the volatility of each component, the model can achieve precise thermodynamic consistency in multi-component hydrocarbon mixtures, which is described by the iso-fugacity rule.