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TDDFT study on aluminum and fluoride dual-sensing mechanism of a Schiff-Base sensor 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 211, 页码: 44-51
Authors:  Liu, Dong;  Wang, Jie-Ping;  Li, Guang-Yue;  Zhou, Can-Hua
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Sensor  Fluorescence  Excited state  TICT  ESPT  
Different types of hydrogen-bonded complexes would accelerate or delay the excited state proton transfer in 3-hydroxyflavone 期刊论文
JOURNAL OF LUMINESCENCE, 2019, 卷号: 206, 页码: 46-52
Authors:  Yang, Songqiu;  Zhang, Yan;  Han, Keli
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Excited state proton transfer  Hydrogen-bonded complex  Time-resolved spectroscopy  Cam-b3lyp  Dual emission  
Glutathione sensing mechanism of a fluorescent probe: Excited state intramolecular proton transfer and photoinduced electron transfer 期刊论文
JOURNAL OF LUMINESCENCE, 2018, 卷号: 204, 页码: 642-648
Authors:  Li, Yang;  Zhao, Jin-Feng;  Chu, Tian-Shu
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Fluorescent probe  Density functional theory  Excited state intramolecular proton transfer  Photoinduced electron transfer  Intramolecular charge transfer  
Exploring and elaborating the excited state mechanism of a novel AIE material 2-(5-(4-carboxyphenyl)-2-hydroxyphenyl)benzothiazole 期刊论文
STRUCTURAL CHEMISTRY, 2018, 卷号: 29, 期号: 6, 页码: 1767-1773
Authors:  Zhang, Qiaoli;  Yang, Guang;  Jia, Min;  Song, Xiaoyan;  Zhao, Jinfeng
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Intramolecular hydrogen bond  Frontier molecular orbital  Charge density difference  Excited state proton transfer  Transition state  
The effect of benzo-annelation on intermolecular hydrogen bond and proton transfer of 2-methyl-3-hydroxy-4(1H)-quinolone in methanol: A TD-DFT study 期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 5
Authors:  Zhao, Yanliang;  Wang, Meishan;  Zhou, Panwang;  Yang, Chuanlu;  Ma, Xiaoguang;  Tang, Zhe;  Bao, Dongshuai
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Electronic Spectra  Excited-state Proton Transfer  Hydrogen Bond  Transition State  
Theoretical investigation of twisted charge-transfer-promoted intramolecular proton transfer in the excited state of 4 '-dimethylaminoflavonol in a highly polar solvent 期刊论文
JOURNAL OF LUMINESCENCE, 2018, 卷号: 194, 页码: 785-790
Authors:  Tang, Zhe;  Yang, Yunfan;  Yang, Yi;  Wang, Yi;  Tian, Jing;  Fei, Xu
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Excited-state Intramolecular Proton Transfer  Hydrogen Bond  Twisted Intramolecular Charge Transfer  Reduced Density Gradient  Potential-energy Curve  
Solvent controlling excited state proton transfer reaction in quinoline/isoquinoline-pyrazole isomer QP-I: A theoretical study 期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 1
Authors:  Yang, Dapeng;  Yang, Guang;  Zhao, Jinfeng;  Song, Nahong;  Zheng, Rui;  Wang, Yusheng
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Excited State Proton Transfer  Frontier Molecular Orbitals  Intramolecular Hydrogen Bond  Potential Energy Curves  
A DFT/TDDFT Investigation of Excited State Dynamical Mechanism of (E)-1-((2,2-Diphenylhydrazono)methyl)naphthalen-2-ol 期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2017, 卷号: 64, 期号: 12, 页码: 1385-1391
Authors:  Yang, Dapeng;  Wu, Jingyuan;  Jia, Min;  Song, Xiaoyan
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Electronic Spectra  Frontier Molecular Orbitals  Excited-state Intramolecular Proton Transfer  Potential Energy Surface  
Crossed Molecular Beam Study of H-ECH4 and H+CD4 Reactions: Vibrationally Excited CH3/CD3 Product Channelst 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 30, 期号: 6, 页码: 609-613
Authors:  Chen, Wen-tao;  Yu, Sheng-rui;  Yuan, Dao-fu;  Xie, Ting;  Yang, Jia-yue;  Wang, Si-wen;  Luo, Chang;  Tan, Yu-xin;  Miao, Yue;  Zhang, Wei-qing;  Wu, Guo-rong;  Yang, Xue-ming;  Wang, Xing-an
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Velocity Map Ion Imaging  Crossed Molecular Beam  Angular Distribution  Vibrationally Excited State  
Long-lived Single Excitons, Trions, and Biexcitons in CdSe/CdTe Type-II Colloidal Quantum WeIls 期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2017, 卷号: 30, 期号: 6, 页码: 649-656
Authors:  Wang, Jun-hui;  Liang, Gui-jie;  Wu, Kai-feng
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Solar Energy  Excited State Lifetime  Exciton  Trion  Biexciton  Type-ii Quantum Wells  Nanoplatelets  Auger Recombination