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Chinese Academy of Sciences Institutional Repositories Grid
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大连化学物理研究所 [38]
西北高原生物研究所 [9]
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期刊论文 [61]
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Investigation on the excited state intramolecular proton transfer process for the novel 2-(3,5-dichloro-2-hydroxy-phenyl)-benzooxazole-5-carboxylicacid system
期刊论文
OAI收割
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 卷号: 32, 期号: 10, 页码: 9
作者:
Gao, Haiyan
;
Yang, Xiaohui
;
Zhang, Tianjie
;
Yang, Dapeng
  |  
收藏
  |  
浏览/下载:79/0
  |  
提交时间:2019/12/02
charge density differences
charge redistribution
ESIPT
frontier molecular orbital
intramolecular hydrogen bond
Structures, energetics, and infrared spectra of the cationic monomethylamine clusters
期刊论文
OAI收割
CHEMICAL PHYSICS, 2019, 卷号: 523, 页码: 7-11
作者:
Jiang, Shuai
;
Zhang, Xiaoli
;
Zheng, Xiucheng
;
Kong, Xiangtao
  |  
收藏
  |  
浏览/下载:61/0
  |  
提交时间:2019/06/25
Monomethylamine
Structure
Energetics
Infrared photodissociation
Spectroscopy
Quantum chemical calculation
The investigation of proton transfer and fluorescence-sensing mechanisms of [2-(2-hydroxy-phenyl)-1H-benzoimidazol-5-yl]-phenyl-methanone
期刊论文
OAI收割
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 卷号: 66, 期号: 6, 页码: 583-588
作者:
Yang, Dapeng
;
Zhao, Zhongjian
;
Jia, Min
;
Song, Xiaoyan
;
Zhang, Qiaoli
  |  
收藏
  |  
浏览/下载:182/0
  |  
提交时间:2019/12/02
deprotonation
fluoride-triggered fluorescence response
intra and interhydrogen bonds
potential energy curves
Different types of hydrogen-bonded complexes would accelerate or delay the excited state proton transfer in 3-hydroxyflavone
期刊论文
OAI收割
JOURNAL OF LUMINESCENCE, 2019, 卷号: 206, 页码: 46-52
作者:
Yang, Songqiu
;
Zhang, Yan
;
Han, Keli
  |  
收藏
  |  
浏览/下载:39/0
  |  
提交时间:2019/06/20
Excited state proton transfer
Hydrogen-bonded complex
Time-resolved spectroscopy
Cam-b3lyp
Dual emission
Different types of hydrogen-bonded complexes would accelerate or delay the excited state proton transfer in 3-hydroxyflavone
期刊论文
iSwitch采集
Journal of luminescence, 2019, 卷号: 206, 页码: 46-52
作者:
Yang, Songqiu
;
Zhang, Yan
;
Han, Keli
收藏
  |  
浏览/下载:47/0
  |  
提交时间:2019/05/08
Excited state proton transfer
Hydrogen-bonded complex
Time-resolved spectroscopy
Cam-b3lyp
Dual emission
Theoretical insights into excited-state intramolecular and multiple intermolecular hydrogen bonds in 2-(2-Hydroxy-phenyl)-4(3H)-quinazolinone
期刊论文
OAI收割
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 207, 页码: 61-67
作者:
Liu, Li-Yan
;
Wu, Shuai-Shuai
;
Yu, Jie
;
Chai, Shuo
;
Cong, Shu-Lin
  |  
收藏
  |  
浏览/下载:47/0
  |  
提交时间:2019/06/20
Hydrogen bonds
ESIPT
Configuration twisting
Potential energy curves
Fluorescence
Theoretical insights into excited-state intramolecular and multiple intermolecular hydrogen bonds in 2-(2-hydroxy-phenyl)-4(3h)-quinazolinone
期刊论文
iSwitch采集
Spectrochimica acta part a-molecular and biomolecular spectroscopy, 2019, 卷号: 207, 页码: 61-67
作者:
Liu, Li-Yan
;
Wu, Shuai-Shuai
;
Yu, Jie
;
Chai, Shuo
;
Cong, Shu-Lin
收藏
  |  
浏览/下载:104/0
  |  
提交时间:2019/05/08
Hydrogen bonds
Esipt
Configuration twisting
Potential energy curves
Fluorescence
Damaging Intermolecular Energy and Proton Transfer Processes in Alpha-Particle-Irradiated Hydrogen-Bonded Systems
期刊论文
OAI收割
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2018, 卷号: 57, 页码: 17023-17027
作者:
Xu, Shenyue
;
Guo, Dalong
;
Ma, Xinwen
;
Zhu, Xiaolong
;
Feng, Wentian
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收藏
  |  
浏览/下载:99/0
  |  
提交时间:2019/03/27
charged particles
energy transfer
proton transfer
radiation damage
Theoretical study of charge-transport and optical properties of indeno[1,2-b] fluorene-6,12-dione-based semiconducting materials
期刊论文
OAI收割
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS, 2018, 卷号: 74, 页码: 705-711
作者:
Cheng, Shi-Bo
;
Huang, Jin-Dou
  |  
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2019/06/20
indeno[1,2-b] fluorene-6,12-dione-based molecules
intrinsic hole mobility
intrinsic electron mobility
electronic spectra
density functional theory (DFT)
structure-function relationship
Theoretical study of charge-transport and optical properties of indeno[1,2-b] fluorene-6,12-dione-based semiconducting materials
期刊论文
iSwitch采集
Acta crystallographica section b-structural science crystal engineering and materials, 2018, 卷号: 74, 页码: 705-711
作者:
Huang, Jin-Dou
;
Zhao, Jinfeng
;
Yu, Kun
;
Huang, Xiaohua
;
Cheng, Shi-Bo
收藏
  |  
浏览/下载:64/0
  |  
提交时间:2019/05/08
Indeno[1,2-b] fluorene-6,12-dione-based molecules
Intrinsic hole mobility
Intrinsic electron mobility
Electronic spectra
Density functional theory (dft)
Structure-function relationship