Applications of Molecular Modeling to Study Interfacial Phenomena I
AIChE Annual Meeting
2022 Annual Meeting
Computational Molecular Science and Engineering Forum
Phoenix Convention Center
Sunday, November 13, 2022 - 3:30pm to 6:00pm
de Meyer, F., Totalenergies S.E.
Uche, O., Rochester Institute of Technology
We invite contributions that focus on the use of computational tools (e.g., molecular dynamics, Monte Carlo, density functional theory, data science) to study interfacial phenomena, including wetting, adsorption kinetics and equilibria, foaming, colloid stability, micelle formation, solubilization, electrolyte solution, nucleation, reactions in monolayers, fluid phase catalysis, surface rheology, flow through porous media, cellular convection, surfactants, etc.
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