Propane dehydrogenation on platinum catalysts: identifying the active sites through Bayesian analysis C Fricke, B Rajbanshi, EA Walker, G Terejanu, A Heyden ACS Catalysis 12 (4), 2487-2498, 2022 | 21 | 2022 |
Oxidative dehydrogenation of propane on the oxygen adsorbed edges of boron nitride nanoribbons B Rajbanshi, S Saha, C Fricke, SC Ammal, A Heyden Catalysis Science & Technology 10 (15), 5181-5195, 2020 | 13 | 2020 |
Benchmarking the accuracy of density functional theory against the random phase approximation for the ethane dehydrogenation network on Pt (111) NA Szaro, M Bello, CH Fricke, OH Bamidele, A Heyden The Journal of Physical Chemistry Letters 14 (48), 10769-10778, 2023 | 6 | 2023 |
Modeling the Effect of Surface Platinum–Tin Alloys on Propane Dehydrogenation on Platinum–Tin Catalysts CH Fricke, OH Bamidele, M Bello, J Chowdhury, G Terejanu, A Heyden ACS Catalysis 13 (16), 10627-10640, 2023 | 4 | 2023 |
Computational Investigation of the Catalytic Hydrodeoxygenation of Propanoic Acid over a Cu (111) Surface B Rajbanshi, W Yang, A Yonge, SK Kundu, C Fricke, A Heyden The Journal of Physical Chemistry C 125 (35), 19276-19293, 2021 | 4 | 2021 |
Invariant Molecular Representations for Heterogeneous Catalysis J Chowdhury, C Fricke, O Bamidele, M Bello, W Yang, A Heyden, ... Journal of Chemical Information and Modeling 64 (2), 327-339, 2024 | 2 | 2024 |
Identification of Active Site for Ethane Dehydrogenation on Platinum Catalysts Using Bayesian Analysis: Correction of DFT-Derived Enthalpy and Entropy M Bello, O Bamidele, C Fricke, G Terejanu, A Heyden 2023 AIChE Annual Meeting, 2023 | | 2023 |
Bayesian Analysis for Identifying the Active Sites for Platinum-Catalyzed Propane Dehydrogenation C Fricke, A Heyden The 27th North American Catalysis Society Meeting, 2022 | | 2022 |
From the Surface to the Reactor: Identifying the Active Sites for Propane Dehydrogenation on Platinum-Based Catalysts Through Density Functional Theory, Experimental Data, and … CH Fricke University of South Carolina, 2022 | | 2022 |
Theoretical Investigation of Pt-Catalyzed Dehydrogenation of Propane to Propylene: Applying Uncertainty Analysis to Reaction Kinetics C Fricke, A Heyden 2019 AIChE Annual Meeting, 2019 | | 2019 |
Density Functional Uncertainty for Platinum-Based Catalysts for Propane Dehydrogenation C Fricke, A Heyden 2019 North American Catalysis Society Meeting, 2019 | | 2019 |