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科研机构
大连化学物理研究所 [32]
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期刊论文 [31]
会议论文 [1]
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2019 [2]
2018 [3]
2017 [3]
2016 [5]
2015 [2]
2014 [4]
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物理化学 [4]
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Theoretical insights into elaborating and regulating excited state dynamics for the novel 6-cyano-2-(2 '-hydroxyphenyl)imidazo[1,2a]pyridine system in polar and nonpolar solvents
期刊论文
MOLECULAR PHYSICS, 2019, 页码: 9
作者:
Xu, Lei
;
Zhang, Qiaoli
;
Zhang, Tianjie
;
Yang, Dapeng
收藏
  |  
浏览/下载:87/0
  |  
提交时间:2019/12/02
Intramolecular hydrogen bond
ESIPT
charge density difference
charge redistribution
solvent polarity
Fundamentals of TiO2 Photocatalysis: Concepts, Mechanisms, and Challenges
期刊论文
ADVANCED MATERIALS, 2019, 页码: 26
作者:
Guo, Qing
;
Zhou, Chuanyao
;
Ma, Zhibo
;
Yang, Xueming
收藏
  |  
浏览/下载:63/0
  |  
提交时间:2019/12/02
charge carriers
nonadiabatic processes
reaction mechanisms
TiO2 photocatalysis
Development of Novel Perovskite-Like Oxide Photocatalyst LiCuTa3O9 with Dual Functions of Water Reduction and Oxidation under Visible Light Irradiation
期刊论文
ADVANCED ENERGY MATERIALS, 2018, 卷号: 8, 期号: 35, 页码: 7
作者:
Li, Can
;
Zhang, Fuxiang
;
Dong, Beibei
;
Cui, Junyan
;
Liu, Taifeng
收藏
  |  
浏览/下载:41/0
  |  
提交时间:2019/06/20
hydrogen
oxide
photocatalysis
solar energy conversion
water splitting
Development of novel perovskite-like oxide photocatalyst licuta3o9 with dual functions of water reduction and oxidation under visible light irradiation
期刊论文
Advanced energy materials, 2018, 卷号: 8, 期号: 35, 页码: 7
作者:
Dong, Beibei
;
Cui, Junyan
;
Liu, Taifeng
;
Gao, Yuying
;
Qi, Yu
收藏
  |  
浏览/下载:56/0
  |  
提交时间:2019/05/08
Hydrogen
Oxide
Photocatalysis
Solar energy conversion
Water splitting
The sensing mechanism studies of the fluorescent probes with electronically excited state calculations
期刊论文
WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE, 2018, 卷号: 8, 期号: 2
作者:
Li, Guang-Yue
;
Han, Ke-Li
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  |  
浏览/下载:15/0
  |  
提交时间:2019/06/20
On the mechanism of non-radiative decay of blue fluorescent protein chromophore: New insight from the excited-state molecular dynamics simulations and potential energy calculations
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 186, 页码: 52-58
作者:
Zhao, Li
;
Liu, Jian-Yong
;
Zhou, Pan-Wang
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2017/12/20
Nonadiabatic
Fluorescent proteins
Excited state
Dynamics simulation
On the mechanism of non-radiative decay of blue fluorescent protein chromophore: New insight from the excited-state molecular dynamics simulations and potential energy calculations
期刊论文
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 186, 页码: 52-58
作者:
Zhao, Li
;
Liu, Jian-Yong
;
Zhou, Pan-Wang
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2017/12/20
Nonadiabatic
Fluorescent proteins
Excited state
Dynamics simulation
A Theoretical Investigation on Intramolecular Hydrogen Bond: The ESIPT Mechanism of dmahf Sensor
期刊论文
JOURNAL OF CLUSTER SCIENCE, 2017, 卷号: 28, 页码: 937-947
作者:
Yang, Dapeng
;
Zheng, Rui
;
Wang, Yusheng
;
Lv, Jian
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  |  
浏览/下载:16/0
  |  
提交时间:2017/10/29
Hydrogen Bond
Esipt
Electronic Spectra
Potential Energy Curve
Theoretical and experimental investigations of rate coefficients of O(D-1) + CH4 at low temperature
期刊论文
PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 卷号: 18, 期号: 42, 页码: 29286-29292
作者:
Hickson, Kevin M.
;
Zhang, Dong H.
;
Loisonc, Jean-Christophe
;
Meng, Qingyong
;
Shao, Kejie
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/06/20
Dual Extraction of Photogenerated Electrons and Holes from a Ferroelectric Sr0.5Ba0.5Nb2O6 Semiconductor
期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2016, 卷号: 8, 期号: 22, 页码: 13857-13864
作者:
Fan, Dayong
;
Zhu, Jian
;
Wang, Xiuli
;
Wang, Shengyang
;
Liu, Yong
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2019/06/20
Ferroelectric Semiconductor
Sbn
Apv
Photocatalysis
Charge Separation
Kpfm
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