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Zhi-Qiang You
Zhi-Qiang You
Ohio Supercomputer Center
Verified email at osc.edu - Homepage
Title
Cited by
Cited by
Year
Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Y Shao, Z Gan, E Epifanovsky, ATB Gilbert, M Wormit, J Kussmann, ...
Molecular Physics 113 (2), 184-215, 2015
30732015
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package
E Epifanovsky, ATB Gilbert, X Feng, J Lee, Y Mao, N Mardirossian, ...
The Journal of chemical physics 155 (8), 2021
6912021
Charge transport properties of tris (8-hydroxyquinolinato) aluminum (III): Why it is an electron transporter
BC Lin, CP Cheng, ZQ You, CP Hsu
Journal of the American Chemical Society 127 (1), 66-67, 2005
3882005
vConTACT: an iVirus tool to classify double-stranded DNA viruses that infect Archaea and Bacteria
B Bolduc, HB Jang, G Doulcier, ZQ You, S Roux, MB Sullivan
PeerJ 5, e3243, 2017
2482017
Characterization of the short-range couplings in excitation energy transfer
CP Hsu, ZQ You, HC Chen
The Journal of Physical Chemistry C 112 (4), 1204-1212, 2008
2142008
Triplet-triplet energy-transfer coupling: Theory and calculation
ZQ You, CP Hsu, GR Fleming
The Journal of chemical physics 124 (4), 2006
1622006
Experimental Benchmark Data and Systematic Evaluation of Two a Posteriori, Polarizable-Continuum Corrections for Vertical Excitation Energies in Solution
JM Mewes, ZQ You, M Wormit, T Kriesche, JM Herbert, A Dreuw
The Journal of Physical Chemistry A 119 (21), 5446-5464, 2015
1422015
Theory and calculation for the electronic coupling in excitation energy transfer
ZQ You, CP Hsu
International Journal of Quantum Chemistry 114 (2), 102-115, 2014
1382014
Ab initio implementation of the Frenkel–Davydov exciton model: A naturally parallelizable approach to computing collective excitations in crystals and aggregates
AF Morrison, ZQ You, JM Herbert
Journal of Chemical Theory and Computation 10 (12), 5366-5376, 2014
872014
The fragment spin difference scheme for triplet-triplet energy transfer coupling
ZQ You, CP Hsu
The Journal of chemical physics 133 (7), 2010
852010
The hydrated electron at the surface of neat liquid water appears to be indistinguishable from the bulk species
MP Coons, ZQ You, JM Herbert
Journal of the American Chemical Society 138 (34), 10879-10886, 2016
642016
Comparison of the Marcus and Pekar partitions in the context of non-equilibrium, polarizable-continuum solvation models
ZQ You, JM Mewes, A Dreuw, JM Herbert
The Journal of Chemical Physics 143 (20), 2015
642015
The mediated excitation energy transfer: Effects of bridge polarizability
HC Chen, ZQ You, CP Hsu
The Journal of chemical physics 129 (8), 2008
572008
Calculating electron transfer couplings by the Spin-Flip approach: energy splitting and dynamical correlation effects
ZQ You, Y Shao, CP Hsu
Chemical physics letters 390 (1-3), 116-123, 2004
512004
Q-Chem, version 3.0. Q-chem
Y Shao, L Fusti-Molnar, Y Jung, J Kussmann, C Ochsenfeld, ST Brown, ...
Inc.: Pittsburgh, PA, 2007
492007
vCon-TACT: an iVirus tool to classify double-stranded DNA viruses that infect Archaea and Bacteria. PeerJ 5: e3243
B Bolduc, HB Jang, G Doulcier, ZQ You, S Roux, MB Sullivan
462017
Ab inito study on triplet excitation energy transfer in photosynthetic light-harvesting complexes
ZQ You, CP Hsu
The Journal of Physical Chemistry A 115 (16), 4092-4100, 2011
382011
Calculating electron-transfer coupling with density functional theory: The long-range-corrected density functionals
ZQ You, YC Hung, CP Hsu
The Journal of Physical Chemistry B 119 (24), 7480-7490, 2015
342015
A structural model for a self-assembled nanotube provides insight into its exciton dynamics
M Gao, S Paul, CD Schwieters, ZQ You, H Shao, JM Herbert, ...
The Journal of Physical Chemistry C 119 (24), 13948-13956, 2015
302015
Theoretical characterization of photoinduced electron transfer in rigidly linked donor–acceptor molecules: the fragment charge difference and the generalized Mulliken–Hush schemes
SJ Lee, HC Chen, ZQ You, KL Liu, TJ Chow, IC Chen, CP Hsu
Molecular Physics 108 (19-20), 2775-2789, 2010
262010
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Articles 1–20