| Understanding the uniqueness of 2p elements in periodic tables ZL Wang, HS Hu, L von Szentpály, H Stoll, S Fritzsche, P Pyykkö, ... Chemistry–A European Journal 26 (67), 15558-15564, 2020 | 35 | 2020 |
| Relativity–Induced Bonding Pattern Change in Coinage Metal Dimers M2 (M = Cu, Ag, Au, Rg) WL Li, JB Lu, ZL Wang, HS Hu, J Li Inorganic Chemistry 57 (9), 5499-5506, 2018 | 13 | 2018 |
| The smallest 4f-metalla-aromatic molecule of cyclo-PrB 2− with Pr–B multiple bonds ZL Wang, TT Chen, WJ Chen, WL Li, J Zhao, XL Jiang, J Li, LS Wang, ... Chemical Science 13 (34), 10082-10094, 2022 | 6 | 2022 |
| Generalization of ETS-NOCV and ALMO-COVP Energy Decomposition Analysis to Connect Any Two Electronic States and Comparative Assessment H Shen, Z Wang, M Head-Gordon Journal of chemical theory and computation 18 (12), 7428-7441, 2022 | 5 | 2022 |
| Sparsity of the electron repulsion integral tensor using different localized virtual orbital representations in local second-order Møller–Plesset theory Z Wang, A Aldossary, M Head-Gordon The Journal of chemical physics 158 (6), 2023 | 4 | 2023 |
| A linear surrogate for optimising functions of an orthogonal matrix with applications in wave function theory Z Wang, M Head-Gordon Molecular Physics 121 (9-10), e2118185, 2023 | 3 | 2023 |
| Local Second-Order Møller–Plesset Theory with a Single Threshold Using Orthogonal Virtual Orbitals: Theory, Implementation, and Assessment Z Wang, A Aldossary, T Shi, Y Liu, XS Li, M Head-Gordon Journal of Chemical Theory and Computation 19 (21), 7577-7591, 2023 | 2 | 2023 |
