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Proceedings
2021 Annual Meeting
Topical Conference: Applications of Data Science to Molecules and Materials
Applications of Data Science in Catalysis and Reaction Engineering II
2021 Annual Meeting
Session: Applications of Data Science in Catalysis and Reaction Engineering II
Chair
Ulissi, Z.
, Carnegie Mellon University
Co-Chairs
Senftle, T.
Goldsmith, B.
Presentations
12:30 PM
(290a) Building Catalytic Descriptors with Iterative Bayesian Additive Regression Trees (iBART)
Liu, C. Y.
,
Ye, S.
,
Li, M.
,
Senftle, T.
12:45 PM
(290b) Unsupervised Machine Learning to Extract the Electronic and Chemical Properties of Alloy and Metal Oxide Surfaces
Esterhuizen, J.
,
Goldsmith, B.
,
Linic, S.