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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
大连化学物理研究所 [34]
中国科学院大学 [1]
采集方式
OAI收割 [29]
iSwitch采集 [6]
内容类型
期刊论文 [35]
发表日期
2019 [8]
2018 [9]
2017 [2]
2016 [5]
2015 [1]
2014 [2]
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学科主题
物理化学 [4]
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浏览/检索结果:
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Theoretical insights into the sensing mechanism of a series of terpyridine-based chemosensors for TNP
期刊论文
OAI收割
CHEMICAL PHYSICS LETTERS, 2019, 卷号: 725, 页码: 45-51
作者:
Lu, Meiheng
;
Zhang, Xuexiang
;
Zhou, Panwang
;
Tang, Zhe
;
Qiao, Yan
  |  
收藏
  |  
浏览/下载:104/0
  |  
提交时间:2019/06/20
Sensing mechanism
Fluorescent sensor
PET
DFT
Nitroaromatics
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
OAI收割
ORGANIC CHEMISTRY FRONTIERS, 2019, 卷号: 6, 期号: 11, 页码: 1807-1815
作者:
Li, Changming
;
Guo, Wei
;
Zhou, Panwang
;
Tang, Zhe
  |  
收藏
  |  
浏览/下载:44/0
  |  
提交时间:2019/07/26
Does the wavelength dependent photoisomerization process of the p-coumaric acid come out from the electronic state dependent pathways?
期刊论文
OAI收割
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2019, 卷号: 211, 页码: 203-211
作者:
Liu, Jianyong
;
Zhao, Li
;
Zhou, Panwang
  |  
收藏
  |  
浏览/下载:66/0
  |  
提交时间:2019/06/20
Fluorescent protein
Wavelength dependent
Nonadiabatic process
Photoisomerization
Does the wavelength dependent photoisomerization process of the p-coumaric acid come out from the electronic state dependent pathways?
期刊论文
iSwitch采集
Spectrochimica acta part a-molecular and biomolecular spectroscopy, 2019, 卷号: 211, 页码: 203-211
作者:
Zhao, Li
;
Liu, Jianyong
;
Zhou, Panwang
收藏
  |  
浏览/下载:70/0
  |  
提交时间:2019/05/08
Fluorescent protein
Wavelength dependent
Nonadiabatic process
Photoisomerization
Theoretical perspective on the reaction mechanism from arylpentazenes to arylpentazoles: new insights into the enhancement of cyclo-N-5 production
期刊论文
OAI收割
CHEMICAL COMMUNICATIONS, 2019, 卷号: 55, 期号: 18, 页码: 2628-2631
作者:
Zhang, Chaoyang
;
Han, Keli
;
Ren, Guanghua
;
Liu, Runze
;
Zhou, Panwang
  |  
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2019/06/20
Theoretical perspective on the reaction mechanism from arylpentazenes to arylpentazoles: new insights into the enhancement of cyclo-n-5 production
期刊论文
iSwitch采集
Chemical communications, 2019, 卷号: 55, 期号: 18, 页码: 2628-2631
作者:
Ren, Guanghua
;
Liu, Runze
;
Zhou, Panwang
;
Zhang, Chaoyang
;
Liu, Jianyong
收藏
  |  
浏览/下载:38/0
  |  
提交时间:2019/05/08
How Does the O-6-Methylation Regulate the Excited-State Decay of Guanine Monomers
期刊论文
OAI收割
JOURNAL OF PHYSICAL CHEMISTRY B, 2019, 卷号: 123, 期号: 1, 页码: 201-206
作者:
Zhou, Panwang
;
Zhao, Li
  |  
收藏
  |  
浏览/下载:37/0
  |  
提交时间:2019/06/20
How does the o-6-methylation regulate the excited-state decay of guanine monomers
期刊论文
iSwitch采集
Journal of physical chemistry b, 2019, 卷号: 123, 期号: 1, 页码: 201-206
作者:
Zhou, Panwang
;
Zhao, Li
收藏
  |  
浏览/下载:51/0
  |  
提交时间:2019/05/08
Why the lowest electronic excitations of rhodamines are overestimated by time-dependent density functional theory
期刊论文
OAI收割
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2018, 卷号: 118, 期号: 23, 页码: 11
作者:
Zhou, Panwang
  |  
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2019/06/20
ADC(2)
cyanine dyes
rhodamine dyes
TDDFT
XMCQDPT2
Why the lowest electronic excitations of rhodamines are overestimated by time-dependent density functional theory
期刊论文
iSwitch采集
International journal of quantum chemistry, 2018, 卷号: 118, 期号: 23, 页码: 11
作者:
Zhou, Panwang
收藏
  |  
浏览/下载:40/0
  |  
提交时间:2019/05/08
Adc(2)
Cyanine dyes
Rhodamine dyes
Tddft
Xmcqdpt2