Heat transfer and phase change phenomena, particularly diffusion-driven droplet evaporation, play pivotal roles in various industrial applications and natural processes. Despite advancements in computational fluid dynamics, modeling multiphase flows with large density ratios remains challenging. In this study, we developed a robust and stable conservative Allen–Cahn-based phase-field lattice Boltzmann method to solve the flow field equations. This method is coupled with the finite difference discretization of vapor species transport equation and the energy equation. The coupling between the vapor concentration and temperature field at the interface is modeled by the well-known Clausius–Clapeyron correlation. Our approach is capable of simulations under real physical conditions and is compatible with graphics processing unit architecture, making it ideal for large-scale industrial simulations. Three validation test cases are conducted to demonstrate the consistency of the presented model, including simulations of Stefan flow, the evaporation of suspended droplets containing water, acetone, and ethanol in the air, and the evaporation of a water sessile droplet on a flat surface. The results show that the model is able to predict the behavior and characteristics of each case accurately. Notably, our numerical results exhibit a maximum relative error of approximately 1% in simulations of Stefan flow. In the case of suspended droplet evaporation, the observed maximum difference between the calculated wet bulb temperatures and those derived from psychrometric charts is approximately 0.9 K. Moreover, our analysis of the sessile droplet reveals a good agreement between the results obtained by our model for the evaporative mass flux and those obtained from the existing models in the literature for different contact angles.
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