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科研机构
大连化学物理研究所 [60]
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期刊论文 [58]
会议论文 [2]
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2019 [5]
2018 [6]
2017 [9]
2016 [3]
2015 [5]
2014 [6]
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物理化学 [4]
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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
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
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浏览/下载:82/0
  |  
提交时间:2019/12/02
charge density differences
charge redistribution
ESIPT
frontier molecular orbital
intramolecular hydrogen bond
The investigation of proton transfer and fluorescence-sensing mechanisms of [2-(2-hydroxy-phenyl)-1H-benzoimidazol-5-yl]-phenyl-methanone
期刊论文
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
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浏览/下载:186/0
  |  
提交时间:2019/12/02
deprotonation
fluoride-triggered fluorescence response
intra and interhydrogen bonds
potential energy curves
Notable effect of water on excess electron attachment to aqueous DNA deoxyribonucleosides
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2019, 卷号: 21, 期号: 17, 页码: 8925-8932
作者:
Zhang, Yan
;
Wang, Jiayue
;
Yang, Songqiu
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浏览/下载:53/0
  |  
提交时间:2019/12/02
Pyrolytic behavior of coal-related model compounds connected with C-C bridged linkages by in-situ pyrolysis vacuum ultraviolet photoionization mass spectrometry
期刊论文
FUEL, 2019, 卷号: 241, 页码: 533-541
作者:
Shi, Zhiwei
;
Hu, Haoquan
;
Zhou, Yang
;
Li, Lu
;
Jin, Lijun
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  |  
浏览/下载:48/0
  |  
提交时间:2019/06/20
Coal-related model compounds
Pyrolysis
C-C bridged bond
Py-VUV-PIMS
Pyrolytic behavior of coal-related model compounds connected with c-c bridged linkages by in-situ pyrolysis vacuum ultraviolet photoionization mass spectrometry
期刊论文
Fuel, 2019, 卷号: 241, 页码: 533-541
作者:
Zhou, Yang
;
Li, Lu
;
Jin, Lijun
;
Zhou, Jian
;
Shi, Zhiwei
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  |  
浏览/下载:97/0
  |  
提交时间:2019/05/08
Coal-related model compounds
Pyrolysis
C-c bridged bond
Py-vuv-pims
Nonadiabatic dynamics simulation of photoisomerization mechanism of photoswitch azodicarboxamide: Hydrogen bonding effects
期刊论文
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY, 2018, 卷号: 367, 页码: 236-239
作者:
Luo, Jian
;
Liu, Yan
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浏览/下载:33/0
  |  
提交时间:2019/06/20
Azobenzenes
Trans-cis
Light-driven
Advanced material
Surface hopping
Nonadiabatic dynamics simulation of photoisomerization mechanism of photoswitch azodicarboxamide: hydrogen bonding effects
期刊论文
Journal of photochemistry and photobiology a-chemistry, 2018, 卷号: 367, 页码: 236-239
作者:
Liu, Yan
;
Luo, Jian
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浏览/下载:28/0
  |  
提交时间:2019/05/08
Azobenzenes
Trans-cis
Light-driven
Advanced material
Surface hopping
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
作者:
Ma, Xiaoguang
;
Bao, Dongshuai
;
Zhao, Yanliang
;
Wang, Meishan
;
Zhou, Panwang
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  |  
浏览/下载:29/0
  |  
提交时间:2019/06/20
Electronic Spectra
Excited-state Proton Transfer
Hydrogen Bond
Transition State
Excited-State Proton Transfer Mechanism of 2,6-Diazaindoles-(H2O)(n) (n=2-4) Clusters
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY B, 2018, 卷号: 122, 期号: 14, 页码: 3988-3995
作者:
Zhou, Panwang
;
Fei, Xu
;
Tang, Zhe
;
Qi, Yutai
;
Wang, Yi
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  |  
浏览/下载:19/0
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提交时间:2019/06/20
Elaborating the excited state behavior of 2-(4-N,N-dimethylaminophenyl)-imidazo[4,5-c]pyridine coupling with methanol solvent
期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2018, 卷号: 31, 期号: 3
作者:
Yang, Dapeng
;
Jia, Min
;
Song, Xiaoyan
;
Zhang, Qiaoli
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  |  
浏览/下载:11/0
  |  
提交时间:2019/06/20
Electronic Spectra
Hydrogen Bond
Ir Spectra
Potential Energy Curves
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