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Yu Zhang
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Non-adiabatic excited-state molecular dynamics: Theory and applications for modeling photophysics in extended molecular materials
TR Nelson, AJ White, JA Bjorgaard, AE Sifain, Y Zhang, B Nebgen, ...
Chemical reviews 120 (4), 2215-2287, 2020
2802020
Plasmonic hot-carrier-mediated tunable photochemical reactions
Y Zhang, T Nelson, S Tretiak, H Guo, GC Schatz
Acs Nano 12 (8), 8415-8422, 2018
822018
Fundamental limitations to plasmonic hot-carrier solar cells
Y Zhang, CY Yam, GC Schatz
The Journal of Physical Chemistry Letters 7 (10), 1852-1858, 2016
782016
NEXMD software package for nonadiabatic excited state molecular dynamics simulations
W Malone, B Nebgen, A White, Y Zhang, H Song, JA Bjorgaard, AE Sifain, ...
Journal of Chemical Theory and Computation 16 (9), 5771-5783, 2020
672020
First-principles time-dependent quantum transport theory
Y Zhang, S Chen, GH Chen
Physical Review B 87 (8), 085110, 2013
632013
Correlation-informed permutation of qubits for reducing ansatz depth in the variational quantum eigensolver
NV Tkachenko, J Sud, Y Zhang, S Tretiak, PM Anisimov, AT Arrasmith, ...
PRX Quantum 2 (2), 020337, 2021
572021
Mechanistic Insights into Photocatalyzed H2 Dissociation on Au Clusters
Q Wu, L Zhou, GC Schatz, Y Zhang, H Guo
Journal of the American Chemical Society 142 (30), 13090-13101, 2020
522020
Conical nanopores for efficient ion pumping and desalination
Y Zhang, GC Schatz
The journal of physical chemistry letters 8 (13), 2842-2848, 2017
522017
Interlayer-decoupled Sc-based MXene with high carrier mobility and strong light-harvesting ability
L Zhou, Y Zhang, Z Zhuo, AJ Neukirch, S Tretiak
The Journal of Physical Chemistry Letters 9 (23), 6915-6920, 2018
502018
Interference and Molecular Transport A Dynamical View: Time-Dependent Analysis of Disubstituted Benzenes
SG Chen, Y Zhang, SK Koo, H Tian, CY Yam, GH Chen, MA Ratner
The Journal of Physical Chemistry Letters 5 (15), 2748-2752, 2014
452014
Supramolecular double-helix formation by diastereoisomeric conformations of configurationally enantiomeric macrocycles
A Samanta, Z Liu, SKM Nalluri, Y Zhang, GC Schatz, JF Stoddart
Journal of the American Chemical Society 138 (43), 14469-14480, 2016
432016
Stark control of electrons along nanojunctions
L Chen, Y Zhang, GH Chen, I Franco
Nature Communications 9 (1), 1-12, 2018
402018
Quantum-mechanical prediction of nanoscale photovoltaics
Y Zhang, LY Meng, CY Yam, GH Chen
The journal of physical chemistry letters 5 (7), 1272-1277, 2014
392014
Variational quantum eigensolver with reduced circuit complexity
Y Zhang, L Cincio, CFA Negre, P Czarnik, PJ Coles, PM Anisimov, ...
npj Quantum Information 8 (1), 96, 2022
352022
Supramolecular Gelation of Rigid Triangular Macrocycles through Rings of Multiple C–H··· O Interactions Acting Cooperatively
Z Liu, J Sun, Y Zhou, Y Zhang, Y Wu, SKM Nalluri, Y Wang, A Samanta, ...
The Journal of organic chemistry 81 (6), 2581-2588, 2016
332016
A multiscale quantum mechanics/electromagnetics method for device simulations
CY Yam, L Meng, Y Zhang, GH Chen
Chemical Society Reviews 44 (7), 1763-1776, 2015
312015
Quantum simulation of molecular electronic states with a transcorrelated Hamiltonian: Higher accuracy with fewer qubits
A Kumar, A Asthana, C Masteran, EF Valeev, Y Zhang, L Cincio, S Tretiak, ...
Journal of Chemical Theory and Computation 18 (9), 5312-5324, 2022
29*2022
Non-adiabatic molecular dynamics of molecules in the presence of strong light-matter interactions
Y Zhang, T Nelson, S Tretiak
The Journal of Chemical Physics 151 (15), 2019
292019
Multiscale modeling of plasmon-enhanced power conversion efficiency in nanostructured solar cells
L Meng, CY Yam, Y Zhang, R Wang, GH Chen
The Journal of Physical Chemistry Letters 6 (21), 4410-4416, 2015
292015
Dissipative time-dependent quantum transport theory
Y Zhang, CY Yam, GH Chen
The Journal of Chemical Physics 138 (16), 2013
292013
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Articles 1–20