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兰州理工大学 [5]
湖南大学 [2]
化学研究所 [1]
大连化学物理研究所 [1]
上海技术物理研究所 [1]
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期刊论文 [10]
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2021 [1]
2020 [2]
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1999 [1]
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The Halogenation Effects of Electron Acceptor ITIC for Organic Photovoltaic Nano-Heterojunctions
期刊论文
NANOMATERIALS, 2021, 卷号: 11, 期号: 12
作者:
Wang, Yu
;
Zhang, Cairong
;
Yang, Bing
;
Yuan, Lihua
;
Gong, Jijun
收藏
  |  
浏览/下载:35/0
  |  
提交时间:2022/03/01
electronic structure
excitation
acceptor halogenation
organic photovoltaic
electron transfer
Electric field effects on organic photovoltaic heterojunction interfaces: The model case of pentacene/C-60
期刊论文
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2020, 卷号: 1186
作者:
Bai, Rui-Rong
;
Zhang, Cai-Rong
;
Liu, Zi-Jiang
;
Chen, Xian-Kai
;
Wu, You-Zhi
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2022/03/01
Electric field
Electronic structure
Excitation
Heterojunction interface
Organic photovoltaic
Interface configuration effects on excitation, exciton dissociation, and charge recombination in organic photovoltaic heterojunction
期刊论文
International Journal of Quantum Chemistry, 2020, 卷号: 120, 期号: 4
作者:
Bai, Rui-Rong
;
Zhang, Cai-Rong
;
Wu, You-Zhi
;
Yuan, Li-Hua
;
Zhang, Mei-Ling
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2020/11/14
Charge transfer
Density functional theory
Dissociation
Electronic structure
Excited states
Excitons
Heterojunctions
Morphology
Photovoltaic effects
Rate constants
Charge recombinations
Donor-acceptor complex
Donor-acceptor heterojunctions
Excitation properties
Heterojunction interfaces
Interface configuration
Molecular configurations
Organic heterojunctions
Achieving Small Exciton Binding Energies in Small Molecule Acceptors for Organic Solar Cells: Effect of Molecular Packing
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 2019, 卷号: 10, 期号: 17, 页码: 4888-4894
作者:
Zhu, Lingyun
;
Tu, Zeyi
;
Yi, Yuanping
;
Wei, Zhixiang
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  |  
浏览/下载:62/0
  |  
提交时间:2019/09/30
Donor Halogenation Effects on Electronic Structures and Electron Process Rates of Donor/C60 Heterojunction Interface: A Theoretical Study on F nZnPc (n = 0, 4, 8, 16) and Cl nSubPc (n = 0, 6)
期刊论文
Journal of Physical Chemistry A, 2019, 卷号: 123, 期号: 18, 页码: 4034-4047
作者:
Bai, Rui-Rong
;
Zhang, Cai-Rong
;
Wu, You-Zhi
;
Shen, Yu-Lin
;
Liu, Zi-Jiang
收藏
  |  
浏览/下载:2/0
  |  
提交时间:2020/11/14
Binding energy
Charge transfer
Density functional theory
Electronic structure
Halogen compounds
Heterojunctions
Molecular orbitals
Monomers
Open circuit voltage
Rate constants
Structural design
Charge recombinations
Direct-charge transfers
Energy level alignment
Heterojunction interfaces
Intermolecular binding
Molecular orbital energy
Separation parameters
Spectroscopic property
Donor Halogenation Effects on Electronic Structures and Electron Process Rates of Donor/C-60 Heterojunction Interface: A Theoretical Study on FnZnPc (n=0, 4, 8, 16) and CI(n)SubPc (n=0, 6)
期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2019, 卷号: 123, 期号: 18, 页码: 4034-4047
作者:
Bai, Rui-Rong
;
Zhang, Cai-Rong
;
Wu, You-Zhi
;
Shen, Yu-Lin
;
Liu, Zi-Jiang
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  |  
浏览/下载:14/0
  |  
提交时间:2019/11/15
Crystallization, cyanamide defect and ion induction of carbon nitride: Exciton polarization dissociation, charge transfer and surface electron density for enhanced hydrogen evolution
期刊论文
APPLIED CATALYSIS B-ENVIRONMENTAL, 2019, 卷号: Vol.251, 页码: 206-212
作者:
Yuan, JL
;
Tang, YH
;
Yi, XY
;
Liu, CB
;
Li, C
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2019/12/17
Carbon nitride
Exciton polarization dissociation
Charge transfer
Surface electron density
Hydrogen evolution
Crystallization, Cyanamide Defect and Ion Induction of Carbon Nitride: Exciton Polarization Dissociation, Charge Transfer and Surface Electron Density for Enhanced Hydrogen Evolution
期刊论文
Applied Catalysis B: Environmental, 2019
作者:
Jili Yuan
;
Yanhong Tang
;
Xuanying Yi
;
Chengbin Liu
;
Can Li
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2019/12/17
Carbon nitride
Exciton polarization dissociation
Charge transfer
Surface electron density
Hydrogen evolution
Theoretical Study on the UVR8 Photoreceptor: Sensing Ultraviolet-B by Tryptophan and Dissociation of Homodimer
期刊论文
journal of chemical theory and computation, 2014, 卷号: 10, 期号: 8, 页码: 3319-3330
作者:
Li, Xin
;
Chung, Lung Wa
;
Morokuma, Keiji
;
Li, Guohui
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  |  
浏览/下载:31/0
  |  
提交时间:2015/11/17
Polarization and dissociation of exciton in luminescent polymers
期刊论文
SYNTHETIC METALS, 1999, 卷号: 101, 期号: 1--3, 页码: 263-264
作者:
Sun X
;
Li L
;
Fu RL
;
George TF
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  |  
浏览/下载:8/0
  |  
提交时间:2012/11/21
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