Yi Zhao

ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 26

Top Venues

The journal of physical chemistry letters

The Journal of chemical physics

The journal of physical chemistry. A

Journal of computational chemistry

University of Science and Technology of China

This page only lists publications with an associated author ORCID identifier.

Affiliation History

University of Science and Technology of China

China

Professor :: Chemical Physics

Publications

Yu-Chen Wang, Shishi Feng, Yi Kong, Xunkun Huang, WanZhen Liang, Yi Zhao
Electronic Couplings for Singlet Fission Processes Based on the Fragment Particle-Hole Densities. Journal of chemical theory and computation (2023)
Man Lian, Yu-Chen Wang, Yi Zhao
Phonon-Mediated Ultrafast Electron Relaxation Dynamics in Monolayer Black Phosphorus: Instantaneous Coherent Delocalization. The journal of physical chemistry letters (2023)
Xin Qian, Feihong Chu, Wencai Zhou, Zilong Zheng, Xiaoqing Chen, Yi Zhao
Design of Intramolecular Dihedral Angle between Electronic Donor and Acceptor in Thermally Activated Delayed Fluorescence Molecules. The journal of physical chemistry letters (2023)
Yu-Chen Wang, Shishi Feng, WanZhen Liang, Yi Zhao
Comment on "A posteriori localization of many-body excited states through simultaneous diagonalization". Journal of computational chemistry (2023)
Xiao-Hong Ma, Yu-Bing Si, Jia-Hua Hu, Xi-Yan Dong, Guohua Xie, Fangfang Pan, Yong-Li Wei, Shuang Quan Zang, Yi Zhao
High-Efficiency Pure Blue Circularly Polarized Phosphorescence from Chiral N -Heterocyclic-Carbene-Stabilized Copper(I) Clusters. Journal of the American Chemical Society (2023)
Shishi Feng, Yu-Chen Wang, WanZhen Liang, Yi Zhao
Vibrationally resolved absorption spectra and ultrafast exciton dynamics in α-phase and β-phase zinc phthalocyanine aggregates. Physical chemistry chemical physics : PCCP 24 (5) (2022)
Shishi Feng, Yi Zhao, WanZhen Liang
Substituent Effect on Vibrationally Resolved Absorption Spectra and Exciton Dynamics of Dipyrrolonaphthyridinedione Aggregates. The journal of physical chemistry. A 126 (37) (2022)
Guo Zou, Shanrong Zhang, Shishi Feng, Qihuan Li, Bo Yang, Yi Zhao, Kaijun Luo, Ting Bin Wen
Cyclometalated Platinum(II) Metallomesogens Based on Half-Disc-Shaped β-Diketonate Ligands with Hexacatenar: Crystal Structures, Mesophase Properties, and Semiconductor Devices. Inorganic chemistry 61 (30) (2022)
Xia-Guang Zhang, Lei Zhang, Shishi Feng, Haimei Qin, De-Yin Wu, Yi Zhao
Light Driven Mechanism of Carbon Dioxide Reduction Reaction to Carbon Monoxide on Gold Nanoparticles: A Theoretical Prediction. The journal of physical chemistry letters 12 (4) (2021)
Yu-Chen Wang, Shishi Feng, WanZhen Liang, Yi Zhao
Electronic Couplings for Photoinduced Charge Transfer and Excitation Energy Transfer Based on Fragment Particle-Hole Densities. The journal of physical chemistry letters 12 (3) (2021)
Shishi Feng, Yu-Chen Wang, WanZhen Liang, Yi Zhao
Vibrationally Resolved Absorption Spectra and Exciton Dynamics in Zinc Phthalocyanine Aggregates: Effects of Aggregation Lengths and Remote Exciton Transfer. The journal of physical chemistry. A 125 (14) (2021)
Shi-Ping Peng, Xin-Yu Yang, Yi Zhao
Molecular Conditional Generation and Property Analysis of Non-Fullerene Acceptors with Deep Learning. International journal of molecular sciences 22 (16) (2021)
Xia-Guang Zhang, Shishi Feng, Chao Zhan, De-Yin Wu, Yi Zhao, Zhong-Qun Tian
Electroreduction Reaction Mechanism of Carbon Dioxide to C2 Products via Cu/Au Bimetallic Catalysis: A Theoretical Prediction. The journal of physical chemistry letters 11 (16) (2020)
Shi-Ping Peng, Yi Zhao
Convolutional Neural Networks for the Design and Analysis of Non-Fullerene Acceptors. Journal of chemical information and modeling 59 (12) (2019)
Qiong Wei, Rui Zhang, Li Liu, Xin-Xin Zhong, Lei Wang, Guang-Hua Li, Fa-Bao Li, Khalid A Alamry, Yi Zhao
From deep blue to green emitting and ultralong fluorescent copper(i) halide complexes containing dimethylthiophene diphosphine and PPh3 ligands. Dalton transactions (Cambridge, England : 2003) 48 (30) (2019)
Nan Lyu, Kai Wang, Fan Zhang, Haimei Qin, Yi Zhao, Ruibo Wu, Yu-Bing Si, Laiyou Wang
Recognition of PDL1/L2 by different induced-fit mechanisms of PD1: a comparative study of molecular dynamics simulations. Physical chemistry chemical physics : PCCP 22 (3) (2019)
Wenji Wang, Yi Zhao
The dissociation and recombination rates of CH4 through the Ni(111) surface: The effect of lattice motion. The Journal of chemical physics 147 (4) (2018)
Yaling Ke, Yi Zhao
Hierarchy of stochastic Schrödinger equation towards the calculation of absorption and circular dichroism spectra. The Journal of chemical physics 146 (17) (2018)
Yaling Ke, Yi Zhao
Calculations of coherent two-dimensional electronic spectra using forward and backward stochastic wavefunctions. The Journal of chemical physics 149 (1) (2018)
Yaling Ke, Yi Zhao
An extension of stochastic hierarchy equations of motion for the equilibrium correlation functions. The Journal of chemical physics 146 (21) (2018)
Yaling Ke, Yi Zhao
Perturbation expansions of stochastic wavefunctions for open quantum systems. The Journal of chemical physics 147 (18) (2018)
Hongwei Kang, Yu-Bing Si, Yuxiu Liu, Xiaofan Zhang, Weiwei Zhang, Yi Zhao, Baocheng Yang, Yaxuan Liu, Zhong-Yi Liu
Photophysical/Chemistry Properties of Distyryl-BODIPY Derivatives: An Experimental and Density Functional Theoretical Study. The journal of physical chemistry. A 122 (25) (2018)
ZhiYe Zhu, Yi Zhao, WanZhen Liang
Singlet/triplet exciton dissociation and charge recombination in donor-acceptor ThQs-C60 /PDIxCN2 complexes. Journal of computational chemistry 40 (9) (2018)
Yu-Chen Wang, Yi Zhao
Effect of an underdamped vibration with both diagonal and off-diagonal exciton-phonon interactions on excitation energy transfer. Journal of computational chemistry 40 (10) (2018)
Yuxiu Liu, Minsong Lin, Yi Zhao
Intersystem Crossing Rates of Isolated Fullerenes: Theoretical Calculations. The journal of physical chemistry. A 121 (5) (2017)
Hang Zang, Yi Zhao, WanZhen Liang
Quantum Interference in Singlet Fission: J- and H-Aggregate Behavior. The journal of physical chemistry letters 8 (20) (2017)

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Publication Activity (10 Years)

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Yi Zhao