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大连化学物理研究所 [20]
武汉物理与数学研究所 [5]
长春光学精密机械与物... [1]
合肥物质科学研究院 [1]
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期刊论文 [27]
发表日期
2018 [27]
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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
作者:
Zhang, Qiaoli
;
Zhao, Jinfeng
;
Yang, Guang
;
Jia, Min
;
Song, Xiaoyan
收藏
  |  
浏览/下载:153/0
  |  
提交时间:2019/06/20
Intramolecular hydrogen bond
Frontier molecular orbital
Charge density difference
Excited state proton transfer
Transition state
Theoretical explorations about the excited state behaviors for two novel high efficient ESIPT compounds
期刊论文
STRUCTURAL CHEMISTRY, 2018, 卷号: 29, 期号: 6, 页码: 1817-1823
作者:
Wang, Yusheng
;
Yang, Guang
;
Zhang, Qiaoli
;
Song, Xiaoyan
;
Yang, Dapeng
收藏
  |  
浏览/下载:23/0
  |  
提交时间:2019/06/20
Hydrogen bond
Charge density difference
ESIPT
Potential energy curves
Solvation effect on the ESIPT mechanism of 2-(4 '-amino-2 '-hydroxyphenyl)-1H-imidazo- [4,5-c]pyridine
期刊论文
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2018, 卷号: 367, 页码: 261-269
作者:
Wang, Yi
;
Tang, Zhe
;
Lu, Meiheng
;
Liu, Kangjing
;
Zhao, Yanliang
收藏
  |  
浏览/下载:68/0
  |  
提交时间:2019/06/20
ESIPT
Molecular electrostatic potential surface
Frontier molecular orbitals
Potential-energy curves
Ultrafast Investigation of Excited-State Dynamics in Trans-4-methoxyazobenzene Studied by Femtosecond Transient Absorption Spectroscopy
期刊论文
CHINESE JOURNAL OF CHEMICAL PHYSICS, 2018, 卷号: 31, 期号: 6, 页码: 749-755
作者:
Zhang, Song
;
Qin, Chen
;
Zhang, Bing
;
Li, Chun-hua
;
Wang, Ya-ping
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2019/06/24
Photoisomerization
Trans-4-methoxyazobenzene
Femtosecond transient absorption spectroscopy
Theoretical explorations about the excited state behaviors for two novel high efficient esipt compounds
期刊论文
Structural chemistry, 2018, 卷号: 29, 期号: 6, 页码: 1817-1823
作者:
Wang, Yusheng
;
Yang, Guang
;
Zhang, Qiaoli
;
Song, Xiaoyan
;
Yang, Dapeng
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2019/05/08
Hydrogen bond
Charge density difference
Esipt
Potential energy curves
Solvation effect on the esipt mechanism of 2-(4 '-amino-2 '-hydroxyphenyl)-1h-imidazo- [4,5-c]pyridine
期刊论文
Journal of photochemistry and photobiology a-chemistry, 2018, 卷号: 367, 页码: 261-269
作者:
Tang, Zhe
;
Lu, Meiheng
;
Liu, Kangjing
;
Zhao, Yanliang
;
Qi, Yutai
收藏
  |  
浏览/下载:80/0
  |  
提交时间:2019/05/08
Esipt
Molecular electrostatic potential surface
Frontier molecular orbitals
Potential-energy curves
Excited state dynamics of molecules studied with femtosecond time-resolved mass spectrometry and photoelectron imaging
期刊论文
ACTA PHYSICA SINICA, 2018, 卷号: 67, 期号: 22, 页码: 16
作者:
Zhang Bing
;
Long Jin-You
;
Zhang Song
;
Tang Ying
;
Wang Yan-Mei
收藏
  |  
浏览/下载:36/0
  |  
提交时间:2019/06/24
femtosecond time-resolved
mass spectrometry
photoelectron imaging
dynamics in excited states
Theoretical studies for the infrared spectra of Ar-CO2 complex: Fundamental and combination bands
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2018, 卷号: 204, 页码: 308-316
作者:
Zhao, Aiqing
;
Shi, Lipeng
;
Tian, Yanshan
;
Zheng, Limin
;
Zheng, Rui
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2018/11/05
Ar-co2 Complex
Potential Energy Surfaces
Intermolecular Vibrational Modes
Fundamental Band
Combination Bands
Theoretical insights into the excited state intramolecular proton transfer mechanism for a novel 4-methoxy-3-hydroxyflavone system
期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2018, 卷号: 65, 期号: 11, 页码: 1326-1332
作者:
Wang, Yusheng
;
Yang, Guang
;
Jia, Min
;
Song, Xiaoyan
;
Yang, Dapeng
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2019/06/20
charge redistribution
ESIPT
hydrogen bond
transition state
Theoretical insights into the ESIPT process for pi-conjugated benzimidazole compounds
期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 11, 页码: 7
作者:
Wang, Yusheng
;
Yang, Guang
;
Yang, Dapeng
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2019/06/20
electronic spectra
frontier molecular orbital
potential energy curves
TDDFT
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