| Predicting CO2 adsorption and reactivity on transition metal surfaces using popular density functional theory methods O Mohan, QT Trinh, A Banerjee, SH Mushrif Molecular Simulation 45 (14-15), 1163-1172, 2019 | 40 | 2019 |
| A combined experimental and DFT investigation of selective hydrodeoxygenation of guaiacol over bimetallic carbides CC Tran, O Mohan, A Banerjee, SH Mushrif, S Kaliaguine Energy & Fuels 34 (12), 16265-16273, 2020 | 39 | 2020 |
| Investigating CO2 Methanation on Ni and Ru: DFT Assisted Microkinetic Analysis O Mohan, S Shambhawi, R Xu, AA Lapkin, SH Mushrif ChemCatChem 13 (10), 2420-2433, 2021 | 31 | 2021 |
| Investigating methane dry reforming on Ni and B promoted Ni surfaces: DFT assisted microkinetic analysis and addressing the coking problem O Mohan, AA Lapkin, SH Mushrif Catalysis Science & Technology 10 (19), 6628-6643, 2020 | 27 | 2020 |
| Novel Nickel-Based Single-Atom Alloy Catalyst for CO2 Conversion Reactions: Computational Screening and Reaction Mechanism Analysis O Mohan, R Xu, SH Mushrif The Journal of Physical Chemistry C 125 (7), 4041-4055, 2021 | 24 | 2021 |
| The design and optimization of heterogeneous catalysts using computational methods O Mohan, TS Choksi, AA Lapkin Catalysis Science & Technology 14 (3), 515-532, 2024 | 13 | 2024 |
| Molecular insights into the activity and stability of popular methane reforming catalysts using quantum mechanical tools K Hassan-Legault, O Mohan, SH Mushrif Current Opinion in Chemical Engineering 26, 38-45, 2019 | 12 | 2019 |
| Shambhawi; Lapkin, AA; Mushrif, SH Investigating methane dry reforming on Ni and B promoted Ni surfaces: DFT assisted microkinetic analysis and addressing the coking problem O Mohan Catal. Sci. Technol 10 (19), 6628-6643, 2020 | 6 | 2020 |
| Design of fluidized bed reactor for conversion of biomass energy in to concentrated gaseous fuel O Mohan, S Rupesh, C Muraleedharan, P Arun 2015 IEEE International Conference on Signal Processing, Informatics …, 2015 | 1 | 2015 |
| Tuning the electronic structure and SMSI by integrating trimetallic sites with defective ceria for the CO2 reduction reaction C Singhvi, G Sharma, R Verma, VK Paidi, P Glatzel, P Paciok, VB Patel, ... Proceedings of the National Academy of Sciences 122 (3), e2411406122, 2025 | | 2025 |
| Hydrogen Production and C2 Product Formation in Metal-Dispersed Molten Salt Systems Via Methane Pyrolysis: An Ab Initio Molecular Dynamics Study P Rudra, O Mohan, SH Mushrif 2024 AIChE Annual Meeting, 2024 | | 2024 |
| Role of Non‐Covalent Interactions on Acid Strength Measurement of Liquid Acids using Phosphine Oxide NMR Probe G Narayan Tumulu, K Kotak, P Goyal, S Pagaria, SM Mahajani, O Mohan ChemistrySelect 9 (5), e202304804, 2024 | | 2024 |
| Catalytic conversion of carbon dioxide to hydrocarbons O Mohan PhD Thesis, 2021 | | 2021 |
| A Comparative Multiscale Computational Study of Methane Dry and Tri Reforming on Nickel Catalysts K Hassan-Legault, O Mohan, S Mushrif 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Combined DFT and Microkinetic Investigation of CO2 Conversion Reaction Mechanisms and Addressing the Coking Problem: On Ni, Nib and Nib Based Single … O Mohan, S Shambhawi, AA Lapkin, S Mushrif 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Combined DFT and Microkinetic Study of Dry Reforming of Methane on Ni and B Promoted Ni Surfaces O Mohan, S Shambhawi, AA Lapkin, SH Mushrif 2019 AIChE Annual Meeting, 2019 | | 2019 |
| Performance and benchmarking of Density Functional Theory (DFT) methods via CO and CO2 adsorption on Ni (110) surface O Mohan, A Banerjee, Q Thang Trinh, S H Mushrif 25th Canadian Symposium on Catalysis, 2018 | | 2018 |
| A benchmarking study using CO and CO2 adsorption energies on Ni surface O Mohan, A Banerjee, Q Thang Trinh, S H Mushrif SouthEast Asia Catalysis Conference (SACC), 2017 | | 2017 |
| One Dimensional Steady State Modeling And Simulation Of Fluidized Bed Biomass Gasification With Carbon Dioxie Desorption O Mohan, R Shanmughom, C Muraleedharan, P Arun International Journal of Modern Research in Engineering and Technology 1 (1 …, 2016 | | 2016 |
Samir H. MushrifProfessor, Chemical & Materials Engineering, University of Alberta, CanadaVerified email at ualberta.ca
