Xiaoyong Zhang

Affiliations: 
Shenzhen Bay Laboratory 
Area:
Computational Catalysis, Reaction Dynamics, Molecular Modelling
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"Xiaoyong Zhang"
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Publications

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Hettich CP, Zhang X, Kemper D, et al. (2023) Multistate Energy Decomposition Analysis of Molecular Excited States. Jacs Au. 3: 1800-1819
Zhang J, Tang Z, Zhang X, et al. (2023) Target State Optimized Density Functional Theory for Electronic Excited and Diabatic States. Journal of Chemical Theory and Computation
Lan J, Li X, Yang Y, et al. (2022) New Insights and Predictions into Complex Homogeneous Reactions Enabled by Computational Chemistry in Synergy with Experiments: Isotopes and Mechanisms. Accounts of Chemical Research
Xu X, Feng H, Zhang X, et al. (2022) Pd-Catalyzed Ring Restructuring of Oxazolidines with Alkenes Leading to Fused Polycyclic Indolizines. Organic Letters. 24: 1232-1236
Zhang X, Lefebvre PL, Harvey JN. (2022) Effect of solvent motions on the dynamics of the Diels-Alder reaction. Physical Chemistry Chemical Physics : Pccp. 24: 1120-1130
Zhang X, Vázquez SA, Harvey JN. (2021) Vibrational Energy Relaxation of Deuterium Fluoride in -Dichloromethane: Insights from Different Potentials. Journal of Chemical Theory and Computation
Song L, Zhang X, Tang X, et al. (2020) Ruthenium-catalyzed cascade C-H activation/annulation of -alkoxybenzamides: reaction development and mechanistic insight. Chemical Science. 11: 11562-11569
Yang Y, Zhang X, Zhong LP, et al. (2020) Unusual KIE and dynamics effects in the Fe-catalyzed hetero-Diels-Alder reaction of unactivated aldehydes and dienes. Nature Communications. 11: 1850
Deng X, Shi LY, Lan J, et al. (2019) Enantioselective Rhodium-Catalyzed Cycloisomerization of 1,6-Allenynes to access 5/6-Fused Bicycle[4.3.0]nonadienes. Nature Communications. 10: 949
Zhang X, Harvey JN. (2019) EVB and polarizable MM study of energy relaxation in fluorine-acetonitrile reactions. Physical Chemistry Chemical Physics : Pccp
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