| Preparation of Congo red functionalized Fe3O4@ SiO2 nanoparticle and its application for the removal of methylene blue D Yimin, Z Jiaqi, L Danyang, N Lanli, Z Liling, Z Yi, Z Xiaohong Colloids and surfaces a: Physicochemical and engineering aspects 550, 90-98, 2018 | 89 | 2018 |
| Novel highly efficient alumina-supported cobalt nitride catalyst for preferential CO oxidation at high temperatures Z Yao, X Zhang, F Peng, H Yu, H Wang, J Yang International journal of hydrogen energy 36 (3), 1955-1959, 2011 | 53 | 2011 |
| Free energies of catalytic species adsorbed to Pt (111) surfaces under liquid solvent calculated using classical and quantum approaches X Zhang, RS DeFever, S Sarupria, RB Getman Journal of chemical information and modeling 59 (5), 2190-2198, 2019 | 52 | 2019 |
| Hydrothermal depolymerization of lignin: Understanding the structural evolution J Long, Y Xu, T Wang, R Shu, Q Zhang, X Zhang, J Fu, L Ma BioResources 9 (4), 7162-7175, 2014 | 46 | 2014 |
| On the water structure at hydrophobic interfaces and the roles of water on transition-metal catalyzed reactions: A short review X Zhang, TE Sewell, B Glatz, S Sarupria, RB Getman Catalysis Today 285, 57-64, 2017 | 45 | 2017 |
| A Novel Carbothermal Synthesis Route for Carbon Nanotube Supported Fe2P Nanoparticles Z Yao, H Hai, Z Lai, X Zhang, F Peng, C Yan Topics in catalysis 55, 1040-1045, 2012 | 28 | 2012 |
| Structural stability and mutual transformations of molybdenum carbide, nitride and phosphide Z Yao, Z Lai, X Zhang, F Peng, H Yu, H Wang Materials Research Bulletin 46 (11), 1938-1941, 2011 | 24 | 2011 |
| A Method for Obtaining Liquid–Solid Adsorption Rates from Molecular Dynamics Simulations: Applied to Methanol on Pt(111) in H2O X Zhang, A Savara, RB Getman Journal of chemical theory and computation 16 (4), 2680-2691, 2020 | 22 | 2020 |
| A novel carbothermal reduction nitridation route to MoN nanoparticles on CNTs support Z Yao, X Zhang, F Peng, H Yu, H Wang, J Yang Journal of Materials Chemistry 21 (19), 6898-6902, 2011 | 20 | 2011 |
| Insights into how the aqueous environment influences the kinetics and mechanisms of heterogeneously-catalyzed COH* and CH 3 OH* dehydrogenation reactions on Pt (111) CJ Bodenschatz, T Xie, X Zhang, RB Getman Physical Chemistry Chemical Physics 21 (19), 9895-9904, 2019 | 19 | 2019 |
| Multiscale sampling of a heterogeneous water/metal catalyst interface using density functional theory and force-field molecular dynamics CJ Bodenschatz, X Zhang, T Xie, J Arvay, S Sarupria, RB Getman JoVE (Journal of Visualized Experiments), e59284, 2019 | 10 | 2019 |
| Combining HPC and Big Data Infrastructures in Large-Scale Post-Processing of Simulation Data: A Case Study Y Li, X Zhang, A Srinath, RB Getman, LB Ngo Proceedings of the Practice and Experience on Advanced Research Computing, 1-7, 2018 | 5 | 2018 |
| Unsupervised hierarchical graph representation learning by mutual information maximization F Ding, X Zhang, J Sybrandt, I Safro arXiv preprint arXiv:2003.08420, 2020 | 4 | 2020 |
| Differences in solvation thermodynamics of oxygenates at Pt/Al2O3 perimeter versus Pt (111) terrace sites RAG Carcamo, X Zhang, A Estejab, J Zhou, BJ Hare, C Sievers, ... Iscience 26 (2), 2023 | 3 | 2023 |
| Transient response study of NO reduction with H2 on Co4N/γ-Al2O3 catalyst Z Yao, X Zhang Reaction Kinetics, Mechanisms and Catalysis 109, 461-473, 2013 | 3 | 2013 |
| Differences in Solvation Thermodynamics of Oxygenates at Pt/Al 2O 3 Perimeter Versus Pt(111) Terrace Sites Calculated Under Explicit Liquid Water RA García Cárcamo, X Zhang, A Estejab, J Zhou, BJ Hare, C Sievers, ... Al, 2022 | 1 | 2022 |
| Development of Improved Models for Simulating Adsorption Kinetics and Solvation Free Energies of Catalytic Species at Pt (111)/Liquid Water Interfaces X Zhang Clemson University, 2021 | 1 | 2021 |
| Molecular-Level Insights into How Liquid Water Influences Thermodynamics at Water/Heterogeneous Catalyst Interfaces X Zhang, A Estejab, T Xie, RB Getman 2020 Virtual AIChE Annual Meeting, 2020 | | 2020 |
| Force Field for CH3oh-Pt(111) Interaction: Development and Assessment P Meza-Morales, I Ruohoniemi, X Zhang, A Hardymon, R Getman 2019 North American Catalysis Society Meeting, 2019 | | 2019 |
| Molecular simulations for calculating the free energies of adsorption and reaction in aqueous phase heterogeneous catalysis X Zhang, T Xie, R Getman ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 256, 2018 | | 2018 |
