| Toward Sabatier optimal for ammonia synthesis with paramagnetic phase of ferromagnetic transition metal catalysts G Xu, C Cai, T Wang Journal of the American Chemical Society 144 (50), 23089-23095, 2022 | 38 | 2022 |
| Toward carbon monoxide methanation at mild conditions on dual-site catalysts W Zhao, G Xu, Z He, C Cai, F Abild-Pedersen, T Wang Journal of the American Chemical Society 145 (15), 8726-8733, 2023 | 6 | 2023 |
| Rational design of catalysts with earth‐abundant elements G Xu, C Cai, W Zhao, Y Liu, T Wang Wiley Interdisciplinary Reviews: Computational Molecular Science, e1654, 2022 | 6 | 2022 |
| Theoretical Approach toward a Mild Condition Haber–Bosch Process on the Zeolite Catalyst with Confined Dual Active Sites C Liu, G Xu, T Wang JACS Au 3 (12), 3374-3380, 2023 | 3 | 2023 |
| Demagnetizing Ferromagnetic Catalysts to the Sabatier Optimal of Haber–Bosch Process G Xu, L Sun, T Wang JACS Au 4 (4), 1405-1412, 2024 | 2 | 2024 |
| Size-dependent Magneto-catalytic Effect in Ferromagnetic Nanoparticles G Xu, T Wang | | 2024 |
| Diverse Effects of Ferromagnetic-Paramagnetic Phase Transition on the Activity and Selectivity of Ferromagnetic Catalysts Y Chen, Y Liu, G Xu, T Wang | | 2024 |
| Associative-Distal Mechanism of the Haber–Bosch Process on a Ferrierite Catalyst with Spatially Isolated Dual Molybdenum Sites C Liu, Y Liu, G Xu, T Wang The Journal of Physical Chemistry C 128 (16), 6711-6718, 2024 | | 2024 |
| Fewer false positives in electrocatalytic nitrogen reduction by synergizing theory and experiment G Xu, T Wang Nature Computational Science 3 (12), 994-997, 2023 | | 2023 |
