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A theoretical study of the ESIPT mechanism of 3-hydroxyflavone derivatives: solvation effect and the importance of TICT for its dual fluorescence properties 期刊论文
ORGANIC CHEMISTRY FRONTIERS, 2019, 卷号: 6, 期号: 17, 页码: 3136-3143
Authors:  Qi, Yutai;  Lu, Meiheng;  Wang, Yi;  Tang, Zhe;  Gao, Ziqing;  Tian, Jing;  Fei, Xu;  Li, Yao;  Liu, Jianyong
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Theoretical insights into the sensing mechanism of a series of terpyridine-based chemosensors for TNP 期刊论文
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 725, 页码: 45-51
Authors:  Lu, Meiheng;  Zhang, Xuexiang;  Zhou, Panwang;  Tang, Zhe;  Qiao, Yan;  Yang, Yanqiang;  Liu, Jianyong
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Sensing mechanism  Fluorescent sensor  PET  DFT  Nitroaromatics  
New perspective on the fluorescence and sensing mechanism of TNP chemosensor 2-(4,5-bis(4-chlorophenyl)-1H-imidazol-2-yl)-4-chlorolphenol 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 213, 页码: 309-317
Authors:  Liu, Runze;  Ma, Yinhua;  Liu, Jianyong;  Yang, Yanqiang;  Chu, Tianshu
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Fluorescence emission  Fluorescence quenching  Dynamical sensing mechanism  pi-pi stacking interaction  Hydrogen-bonding interaction  Photo-induced electron transfer  
Does the wavelength dependent photoisomerization process of the p-coumaric acid come out from the electronic state dependent pathways? 期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 211, 页码: 203-211
Authors:  Zhao, Li;  Liu, Jianyong;  Zhou, Panwang
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Fluorescent protein  Wavelength dependent  Nonadiabatic process  Photoisomerization  
Theoretical perspective on the reaction mechanism from arylpentazenes to arylpentazoles: new insights into the enhancement of cyclo-N-5 production 期刊论文
CHEMICAL COMMUNICATIONS, 2019, 卷号: 55, 期号: 18, 页码: 2628-2631
Authors:  Ren, Guanghua;  Liu, Runze;  Zhou, Panwang;  Zhang, Chaoyang;  Liu, Jianyong;  Han, Keli
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A binding model study on TNP fluorescent sensor 4,40-(9,9 dimethylfluorene-2,7-diy1)dibenzoic acid 期刊论文
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2018, 卷号: 367, 页码: 282-289
Authors:  Ma, Yinhua;  Zhao, Jinfeng;  Liu, Jianyong;  Yang, Yanqiang;  Chu, Tianshu
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Binding model  Time-dependent density functional theory  Weak interactions  TNP sensing  Photoinduced electron transfer  Binding energy  
New insights into the sensing mechanism of a phosphonate pyrene chemosensor for TNT 期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2018, 卷号: 20, 期号: 29, 页码: 19539-19545
Authors:  Lu, Meiheng;  Zhou, Panwang;  Li, Zhongwei;  Liu, Jianyong;  Yang, Yandiang;  Han, Keli
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Reaction mechanisms of 3-amino-4-nitro-furoxan formation by 3-amide-4-nitro-furoxan and sodium hypochlorite in water and benzene solvents 期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2018, 卷号: 1125, 页码: 69-76
Authors:  Peng, Yajing;  Sun, Shuang;  Ye, Yuqing;  Liu, Jianyong
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Dehydration  Chlorination  Furoxan  Hydrolysis  Formation Mechanism  
Effect of Methylation on the Photodynamical Behavior of Arylazoimidazoles: New Insight from Theoretical ab Initio Potential Energy Calculations and Molecular Dynamics Simulations 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2017, 卷号: 121, 期号: 1, 页码: 141-150
Authors:  Zhao, Li;  Liu, Jianyong;  Zhou, Panwang
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New Insight into the Photoisomerization Process of the Salicylidene Methylamine under Vacuum 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2016, 卷号: 120, 期号: 38, 页码: 7419-7426
Authors:  Zhao, Li;  Liu, Jianyong;  Zhou, Panwang
Favorite  |  View/Download:6/0  |  Submit date:2019/06/20