2022 Annual Meeting

Session: Applications of Molecular Modeling to Study Interfacial Phenomena II

Chair

Uche, O., Rochester Institute of Technology

Co-Chair

Presentations

08:00 AM

(46a) Characteristics of Droplet Explosions Studied with Non-Equilibrium Molecular Dynamics Simulations

08:15 AM

(46b) Bubble Nucleation in the Surfactant Stabilized Polyol-CO2 Mixtures:Insights from a Classical Density Function Theory Study

08:30 AM

(46c) Interfacial Thermodynamics of Cryogenic Fluids: The Effect of Non-Condensable Gas on Fluid Storage

08:45 AM

(46d) Energy Optimization of Nanochannel Fluid Extraction with Various Channel Geometries

09:15 AM

(46f) Free-Energy of Monomeric Species in Uio-66 Metal-Organic Framework

09:30 AM

(46g) Structural Origin of Multiple Alkylated Cyclopentane As an Effective Lubricant

09:45 AM

(46h) Extracting Anisotropy Strength and Interfacial Free Energy of Al-Mg Alloy Under Rapidcooling Conditions Using Molecular Dynamics Simulations

10:00 AM

(46i) Dynamic Evolution of Atomically Dispersed Catalysts

10:15 AM

(46j) Molecular Simulations Study of Calcium Carbonate-Amino Acid-Dentin Interactions