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Publications
Proceedings
2021 AIChE Virtual Spring Meeting and 17th Global Congress on Process Safety
Global Congress on Process Safety
Combustible Dust Hazards and Their Mitigation
(11b) The Case for Management Systems in Preventing Combustible Dust Explosions
2021 Annual Meeting
Session: Applications of Data Science in Catalysis and Reaction Engineering I
Chair
Ulissi, Z.
, Carnegie Mellon University
Co-Chairs
Goldsmith, B.
Senftle, T.
Presentations
03:30 PM
(8a) Understanding Barrierless Adsorption in Electro-Catalytic Systems Using Accelerated Transition Path Sampling
03:48 PM
(8b) Methods and Applications of Ex-Machina Molecular Dynamics to Catalytic Processes
04:06 PM
(8c) Statistical Models for Predicting Oil Composition from Hydrothermal Liquefaction of Biomass
04:24 PM
(8d) A Big Data Approach to Predict the Kinetics of Organic Chemistry Reactions
04:42 PM
(8e) Uncertainty Quantification of Catalyst Structure Effects on Kinetics
05:00 PM
(8f) Open Catalyst Project: Advancements and Challenges in Building a Flexible Machine Learning Potential
05:18 PM
(8g) Machine Learning Accelerated Scale-up for Microporous Materials
05:36 PM
(8h) Physics-Informed Neural Networks for Kinetic Parameter Estimation and Uncertainty Quantification
