Hong-Zhou Ye
Hong-Zhou Ye
Department of Chemistry, Columbia University
Verifierad e-postadress på columbia.edu
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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
562019
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
322017
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
292019
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
232015
Bootstrap embedding for molecules
HZ Ye, ND Ricke, HK Tran, T Van Voorhis
Journal of chemical theory and computation 15 (8), 4497-4506, 2019
192019
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
192019
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
192017
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
172020
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
132020
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
132018
Atom-based bootstrap embedding for molecules
HZ Ye, T Van Voorhis
The journal of physical chemistry letters 10 (20), 6368-6374, 2019
82019
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
52020
Bootstrap embedding for large molecular systems
HZ Ye, HK Tran, T Van Voorhis
Journal of Chemical Theory and Computation 16 (8), 5035-5046, 2020
42020
Self-consistent M {\o} ller-Plesset Perturbation Theory For Excited States
HZ Ye, T Van Voorhis
arXiv preprint arXiv:2008.10777, 2020
32020
Bootstrap embedding with an unrestricted mean-field bath
HK Tran, HZ Ye, T Van Voorhis
The Journal of Chemical Physics 153 (21), 214101, 2020
12020
Accurate Electronic Excitation Energies in Full-Valence Active Space via Bootstrap Embedding
HZ Ye, HK Tran, T Van Voorhis
Journal of Chemical Theory and Computation, 2021
2021
Fast periodic Gaussian density fitting by range separation
HZ Ye, TC Berkelbach
The Journal of Chemical Physics 154 (13), 131104, 2021
2021
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
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Artiklar 1–20