Modeling morphology and catalytic activity of nanoparticle ensembles under reaction conditions R Cheula, M Maestri, G Mpourmpakis Acs Catalysis 10 (11), 6149-6158, 2020 | 45 | 2020 |
Quo vadis multiscale modeling in reaction engineering?–A perspective GD Wehinger, M Ambrosetti, R Cheula, ZB Ding, M Isoz, B Kreitz, ... Chemical Engineering Research and Design 184, 39-58, 2022 | 42 | 2022 |
Mechanistic and multiscale aspects of thermo-catalytic CO 2 conversion to C 1 products MI Alam, R Cheula, G Moroni, L Nardi, M Maestri Catalysis Science & Technology 11 (20), 6601-6629, 2021 | 42 | 2021 |
Prediction of morphological changes of catalyst materials under reaction conditions by combined ab initio thermodynamics and microkinetic modelling R Cheula, A Soon, M Maestri Catalysis Science & Technology 8 (14), 3493-3503, 2018 | 31 | 2018 |
Nature and identity of the active site via structure-dependent microkinetic modeling: An application to WGS and reverse WGS reactions on Rh R Cheula, M Maestri Catalysis Today 387, 159-171, 2022 | 11 | 2022 |
Local Ordering of Molten Salts at NiO Crystal Interfaces Promotes High‐Index Faceting R Cheula, MD Susman, DH West, S Chinta, JD Rimer, M Maestri Angewandte Chemie 133 (48), 25595-25600, 2021 | 8 | 2021 |
The Role of Cu‐oxide and Cu adatoms in the Reactivity of CO2 on Cu (110) S Jensen, R Cheula, M Hedevang, M Andersen, JV Lauritsen Angewandte Chemie, e202405554, 2024 | | 2024 |
Modeling and Design of Single-Atom Alloy Catalysts for CO2 Hydrogenation Reactions M Andersen, R Cheula 2023 AIChE Annual Meeting, 2023 | | 2023 |
Cross-Talking of Ni Metal Nanoparticle Facets Explains the Structuresensitivity of the CO2 Methanation Reaction M Ferri, R Cheula, M Monai, BM Weckhuysen, M Maestri The 28th North American Catalysis Society Meeting, 2023 | | 2023 |
Oxidative Coupling of Methane Catalysts: Developing Structure-Property Relationships for High-Performance Metal Oxide Systems MD Susman, M Ferri, R Cheula, HN Pham, AK Datye, S Chinta, D West, ... 2022 AIChE Annual Meeting, 2022 | | 2022 |
Crystallization of NiO Exposing High-Index Facets By Molten Salt Synthesis MD Susman, HN Pham, X Zhao, R Cheula, D West, S Chinta, M Maestri, ... 2022 AIChE Annual Meeting, 2022 | | 2022 |
Explaining the Shape Selectivity of High-Index NiO Particles Produced By Molten Salts Synthesis R Cheula, MD Susman, D West, S Chinta, JD Rimer, M Maestri The 27th North American Catalysis Society Meeting, 2022 | | 2022 |
Inside Cover: Local Ordering of Molten Salts at NiO Crystal Interfaces Promotes High‐Index Faceting (Angew. Chem. Int. Ed. 48/2021) R Cheula, MD Susman, DH West, S Chinta, JD Rimer, M Maestri Angewandte Chemie International Edition 60 (48), 25166-25166, 2021 | | 2021 |
Innentitelbild: Local Ordering of Molten Salts at NiO Crystal Interfaces Promotes High‐Index Faceting (Angew. Chem. 48/2021). R Cheula, MD Susman, DH West, S Chinta, JD Rimer, M Maestri Angewandte Chemie 133 (48), 2021 | | 2021 |
Molten Salt Synthesis of NiO, MgO, and Their Mixed Oxides: Designing New Methods to Control Crystal Morphology MD Susman, HN Pham, X Zhao, R Cheula, D West, S Chinta, M Maestri, ... 2021 AIChE Annual Meeting, 2021 | | 2021 |
Modelling Nanocatalyst Morphology Under Reaction Conditions By Density Functional Theory and Boltzmann Statistics R Cheula, M Maestri, G Mpourmpakis 2019 North American Catalysis Society Meeting, 2019 | | 2019 |
Unraveling Identity and Nature of the Active Sites in Heterogeneous Catalytic Processes By Structure-Dependent Microkinetic Analysis R Cheula, A Stucchi, M Bracconi, M Maestri 2019 North American Catalysis Society Meeting, 2019 | | 2019 |
First principles modeling of structure and activity of nanoparticle catalysts under reaction conditions for structure-dependent microkinetic analyses R CHEULA Politecnico di Milano, 2019 | | 2019 |
Modelling of the dynamic behavior of catalyst materials in reacting conditions: An application to the catalytic partial oxidation of methane on rhodium R Cheula, A Soon, M Maestri Catalysis and Reaction Engineering Division 2018-Core Programming Area at …, 2018 | | 2018 |
Morphological Changes of Catalyst Materials in Reacting Conditions By Combined Ab-Initio Thermodynamics and Microkinetic Modeling R Cheula, A Soon, M Maestri 25th North American Catalysis Society Meeting, 2017 | | 2017 |