2021 Annual Meeting

Session: Undergraduate Student Poster Session: Computing and Process Control

Presentations

10:00 AM

Simulating the Resonant Soft X-Ray Scattering of Realistic Multiblock Copolymer Morphologies
Modeling Electrode Geometry Changes in Zinc-Based Batteries Using Comsol Multiphysics®
Ufmin: A Local Optimization Algorithm for Atomic Structures Using Machine Learning Potentials
A Data-Driven Optimization Approach and Software Toolkit for Modular Process Intensification Synthesis
Modeling of Solar and Wind Power Plants in West Virginia Using System Advisor Model (SAM)
Application of Machine Learning for in-Situ Analysis of Catalyst Quality
Mathematical Models to Compare Shale Gas Utilization Processes.
Molecular Dynamics Simulations to Investigate Stability of Lysozyme Under Different Freezing Rates
Extracting Anisotropy Strength and Interfacial Free Energy of Al-Zr Alloy Under Rapid Cooling Conditions Using Molecular Dynamics Simulations
Improve Detection of Pulmonary Hypertension Using Binary Classification
Optimal Therapy Design Using Artificial Neural Network Surrogate Models of Fluid and Solute Transport in Tumors
Validation of a Fast Solvent Evaluation and Selection Model for Extractive Distillation
Analysis of Velocity and Pressure Gradients to Predict Stroke Using Carotid Artery Simulations
Effect of Nanoporous Confinement on the Compressibility of Water: A Molecular Simulation Study
A Metabolic Flux and Free Energy Analysis Software for Interpreting 13c, 2h, 18o, and 15n Isotope Tracing Data
Towards Practical Matrix Completion Methods for Transition State Theory
CFD and PBM of Latex Particle Aggregation in Mixing Tanks
Modeling and Optimization of a Membrane Reactor for the Steam Methane Reforming Process
Development of a Computational Tool for Solvent Recovery from Process Waste Streams
Optimization of Fructose Dehydration over Zeolite Catalysts Using Machine Learning
Simulation of Colloidal Diffusiophoresis in a Microfluidic Flow Cell
Prediction of Theoretical Carbide Crystal Structures Using Computational Modeling
Renewable Energy Data Mapping and Integration for the P J M Region
Open Catalyst Project: Finding Similarity Among Adslabs
Modeling and Design of Carbon Molecular Sieve Membranes for CO2 Capture from Combined Cycle Flue Gas
CFD Investigations of Industrial Mixing in the Transition Region
Modeling Exothermic Reactions for Pharmaceutical Intermediates in a Tubular Reactor with a Static Mixer Using Comsol Multiphysics
Automatic Process Synthesis for Olefin Production from Shale Gas