| Robust gold nanorods stabilized by bidentate N-heterocyclic-carbene–thiolate ligands MJ MacLeod, AJ Goodman, HZ Ye, HVT Nguyen, T Van Voorhis, ... Nature chemistry 11 (1), 57-63, 2019 | 55 | 2019 |
| σ-SCF: A direct energy-targeting method to mean-field excited states HZ Ye, M Welborn, ND Ricke, T Van Voorhis The Journal of Chemical Physics 147 (21), 214104, 2017 | 31 | 2017 |
| Polymers with side chain porosity for ultrapermeable and plasticization resistant materials for gas separations Y He, FM Benedetti, S Lin, C Liu, Y Zhao, HZ Ye, T Van Voorhis, ... Advanced Materials 31 (21), 1807871, 2019 | 28 | 2019 |
| Monte-Carlo simulations of spin-crossover phenomena based on a vibronic Ising-like model with realistic parameters HZ Ye, C Sun, H Jiang Physical Chemistry Chemical Physics 17 (10), 6801-6808, 2015 | 23 | 2015 |
| Bootstrap embedding for molecules HZ Ye, ND Ricke, HK Tran, T Van Voorhis Journal of chemical theory and computation 15 (8), 4497-4506, 2019 | 18 | 2019 |
| Half-projected σ self-consistent field for electronic excited states HZ Ye, T Van Voorhis Journal of chemical theory and computation 15 (5), 2954-2965, 2019 | 18 | 2019 |
| Performance of Bootstrap Embedding for long-range interactions and 2D systems N Ricke, M Welborn, HZ Ye, T Van Voorhis Molecular Physics 115 (17-18), 2242-2253, 2017 | 18 | 2017 |
| Photoswitchable Sol–Gel Transitions and Catalysis Mediated by Polymer Networks with Coumarin‐Decorated Cu24L24 Metal–Organic Cages as Junctions NJ Oldenhuis, KP Qin, S Wang, HZ Ye, EA Alt, AP Willard, T Van Voorhis, ... Angewandte Chemie International Edition 59 (7), 2784-2792, 2020 | 15 | 2020 |
| Incremental embedding: A density matrix embedding scheme for molecules HZ Ye, M Welborn, ND Ricke, T Van Voorhis The Journal of Chemical Physics 149 (19), 194108, 2018 | 12 | 2018 |
| Electrochemically mediated carbon dioxide separation with quinone chemistry in salt-concentrated aqueous media Y Liu, HZ Ye, KM Diederichsen, T Van Voorhis, TA Hatton Nature communications 11 (1), 1-11, 2020 | 10 | 2020 |
| Atom-based bootstrap embedding for molecules HZ Ye, T Van Voorhis The journal of physical chemistry letters 10 (20), 6368-6374, 2019 | 7 | 2019 |
| An N‐Heterocyclic‐Carbene‐Derived Distonic Radical Cation NM Gallagher, HZ Ye, S Feng, J Lopez, YG Zhu, T Van Voorhis, ... Angewandte Chemie 132 (10), 3980-3983, 2020 | 5 | 2020 |
| Bootstrap embedding for large molecular systems HZ Ye, HK Tran, T Van Voorhis Journal of Chemical Theory and Computation 16 (8), 5035-5046, 2020 | 3 | 2020 |
| Self-consistent M {\o} ller-Plesset Perturbation Theory For Excited States HZ Ye, T Van Voorhis arXiv preprint arXiv:2008.10777, 2020 | 2 | 2020 |
| Fast periodic Gaussian density fitting by range separation HZ Ye, TC Berkelbach The Journal of Chemical Physics 154 (13), 131104, 2021 | | 2021 |
| Bootstrap embedding with an unrestricted mean-field bath HK Tran, HZ Ye, T Van Voorhis The Journal of Chemical Physics 153 (21), 214101, 2020 | | 2020 |
| Innentitelbild: Photoswitchable Sol–Gel Transitions and Catalysis Mediated by Polymer Networks with Coumarin‐Decorated Cu24L24 Metal–Organic Cages as Junctions (Angew. Chem. 7 … NJ Oldenhuis, KP Qin, S Wang, HZ Ye, EA Alt, AP Willard, T Van Voorhis, ... Angewandte Chemie 132 (7), 2546-2546, 2020 | | 2020 |
| Inside Cover: Photoswitchable Sol–Gel Transitions and Catalysis Mediated by Polymer Networks with Coumarin‐Decorated Cu24L24 Metal–Organic Cages as … NJ Oldenhuis, KP Qin, S Wang, HZ Ye, EA Alt, AP Willard, T Van Voorhis, ... Angewandte Chemie International Edition 59 (7), 2526-2526, 2020 | | 2020 |
| Methods for the electronic structure of large chemical systems HZ Ye Massachusetts Institute of Technology, 2020 | | 2020 |
| Polymer Metal-Organic Cage Gels Based on Cu24L24 Cuboctahedra: Design, Synthesis, and Additive Manufacturing Enabled by Three-State Photoswitching NJ Oldenhuis, P Qin, S Wang, HZ Ye, E Alt, A Willard, T Van Voorhis, ... ChemRxiv, 2019 | | 2019 |
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