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大连化学物理研究... [184]
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期刊论文 [180]
会议论文 [4]
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物理化学 [16]
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专题:大连化学物理研究所
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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
作者:
Qi, Yutai
;
Lu, Meiheng
;
Wang, Yi
;
Tang, Zhe
;
Gao, Ziqing
收藏
  |  
浏览/下载:103/0
  |  
提交时间:2019/12/02
A theoretical exploration and regulating about the excited state process for 2-(4-(diphenylamino)phenyl)-3-hydroxy-4H-chromen-4-one system
期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 页码: 8
作者:
Wang, Yusheng
;
Zhang, Qiaoli
;
Xu, Kai
;
Jiang, Weifen
;
Yang, Dapeng
收藏
  |  
浏览/下载:212/0
  |  
提交时间:2019/12/02
charge transfer
ESIPT
intramolecular hydrogen bond
solvent polarity
A TD-DFT investigation of the photo-induced excited state intramolecular proton transfer dynamics for the novel 5,5 '-(9,9-dihexyl-9H-fluorene-2,7-diyl)bis(2-benzo[d]thiazol-2-yl)phenol) system
期刊论文
JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 页码: 7
作者:
Yang, Dapeng
;
Song, Xiaoyan
;
Zhang, Tianjie
;
Gao, Haiyan
收藏
  |  
浏览/下载:55/0
  |  
提交时间:2019/12/02
charge density difference
dual hydrogen bonds
electronic densities
infrared vibrational spectra
potential energy surfaces
The effects of the heteroatom and position on excited-state intramolecular proton transfer of new hydroxyphenyl benzoxazole derivatives: a time-dependent density functional theory study
期刊论文
ORGANIC CHEMISTRY FRONTIERS, 2019, 卷号: 6, 期号: 11, 页码: 1807-1815
作者:
Li, Changming
;
Guo, Wei
;
Zhou, Panwang
;
Tang, Zhe
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  |  
浏览/下载:45/0
  |  
提交时间:2019/07/26
Dynamic Excited-State Intramolecular Proton Transfer Mechanisms of Two Novel 3-Hydroxyflavone-Based Chromophores in Two Different Surroundings
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2019, 卷号: 123, 期号: 18, 页码: 3937-3948
作者:
Hao, Jiaojiao
;
Yang, Yang
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  |  
浏览/下载:37/0
  |  
提交时间:2019/06/25
Colorimetric sensor based on 4-mercaptophenylboronic modified gold nanoparticles for rapid and selective detection of fluoride anion
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 214, 页码: 393-398
作者:
Wu, Haocheng
;
Li, Yijun
;
He, Xiwen
;
Chen, Langxing
;
Zhang, Yukui
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  |  
浏览/下载:59/0
  |  
提交时间:2019/12/02
Fluoride anion
Colorimetric sensor
Gold nanoparticles
Boronic acid
Syntheses, Structural Characterizations and Spectroscopic Properties of Two Copper(I) Complexes Based on Diphosphine Ligands and [2,3-f]pyrazino[1,10]phenanthroline
期刊论文
CHINESE JOURNAL OF INORGANIC CHEMISTRY, 2019, 卷号: 35, 期号: 4, 页码: 720-728
作者:
Lu Yan-Lei
;
Zhu Ning
;
Zhao Yu-Meng
;
Lin Sen
;
Kuang Xiao-Nan
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  |  
浏览/下载:118/0
  |  
提交时间:2019/06/20
[2,3-f]pyrazino[1,10]phenanthroline
Cu(I) complexes
fluorescence
terahertz (THz) time-domain absorption spectroscopy
Theoretical exploration about excited state proton transfer mechanism for a series of phenol-quinoline compounds
期刊论文
JOURNAL OF THE CHINESE CHEMICAL SOCIETY, 2019, 卷号: 66, 期号: 4, 页码: 371-376
作者:
Zhang, Tianjie
;
Yang, Guang
;
Jia, Min
;
Song, Xiaoyan
;
Yang, Dapeng
收藏
  |  
浏览/下载:55/0
  |  
提交时间:2019/06/25
ESIPT
intramolecular hydrogen bond
IR spectra
MOs
potential energy curves
Excited state hydrogen bond and proton transfer mechanism for (2-hydroxy-4-methoxyphenyl)(phenyl)-methanone azine: A theoretical investigation
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 210, 页码: 159-164
作者:
Song, Xiaoyan
;
Zhang, Tianjie
;
Zhang, Qiaoli
;
Yang, Dapeng
;
Yang, Guang
收藏
  |  
浏览/下载:51/0
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提交时间:2019/06/20
Dual intramolecular hydrogen bonds
Steady state spectra
Infrared vibrational spectra
Frontier molecular orbital
Charge density difference
Potential energy surface
Excited state hydrogen bond and proton transfer mechanism for (2-hydroxy-4-methoxyphenyl)(phenyl)-methanone azine: a theoretical investigation
期刊论文
Spectrochimica acta part a-molecular and biomolecular spectroscopy, 2019, 卷号: 210, 页码: 159-164
作者:
Yang, Dapeng
;
Yang, Guang
;
Jia, Min
;
Song, Xiaoyan
;
Zhang, Qiaoli
收藏
  |  
浏览/下载:67/0
  |  
提交时间:2019/05/08
Dual intramolecular hydrogen bonds
Steady state spectra
Infrared vibrational spectra
Frontier molecular orbital
Charge density difference
Potential energy surface
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