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CAS IR Grid
机构
大连化学物理研究所 [14]
采集方式
OAI收割 [14]
内容类型
期刊论文 [12]
会议论文 [2]
发表日期
2015 [1]
2014 [2]
2013 [3]
2012 [4]
2011 [3]
2008 [1]
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学科主题
物理化学 [14]
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Early Stage Solvation of Protonated Methanol by Carbon Dioxide
期刊论文
OAI收割
chinese journal of chemical physics, 2015, 卷号: 28, 期号: 4, 页码: 501-508
作者:
Zhao, Zhi
;
Kong, Xiang-tao
;
Lei, Xin
;
Zhang, Bing-bing
;
Zhao, Ji-jun
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2015/11/16
Methanol
Carbon dioxide
Solvation
Infrared photodissociation spectroscopy
Quantum chemical calculation
Efficient Fourth-Order Split Operator for Solving the Triatomic Reactive Schrodinger Equation in the Time-Dependent Wavepacket Approach
期刊论文
OAI收割
journal of physical chemistry a, 2014, 卷号: 118, 期号: 42, 页码: 9801-9810
作者:
Li, Wentao
;
Zhang, Dong H.
;
Sun, Zhigang
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2015/11/16
Isotope-Dependent Rotational States Distributions Enhanced by Dynamic Resonance States: A Comparison Study of the F plus HD -> HF(V-HF=2) + D and F + H-2 -> HF(V-HF=2) + H Reaction
期刊论文
OAI收割
journal of physical chemistry letters, 2014, 卷号: 5, 期号: 17, 页码: 3049-3055
作者:
Wang, Tao
;
Yang, Tiangang
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2015/11/16
Band-Gap States of TiO2(110): Major Contribution from Surface Defects
期刊论文
OAI收割
journal of physical chemistry letters, 2013, 卷号: 4, 期号: 22, 页码: 3839-3844
作者:
Mao, Xinchun
;
Lang, Xiufeng
;
Wang, Zhiqiang
;
Hao, Qunqing
;
Wen, Bo
收藏
  |  
浏览/下载:24/0
  |  
提交时间:2014/09/11
Initial Processes of Proton Transfer in Salicylideneaniline Studied by Time-Resolved Photoelectron Spectroscopy
期刊论文
OAI收割
journal of physical chemistry a, 2013, 卷号: 117, 期号: 14, 页码: 2971-2979
作者:
Sekikawa, Taro
;
Schalk, Oliver
;
Wu, Guorong
;
Boguslavskiy, Andrey E.
;
Stolow, Albert
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2014/09/11
Effects of surface modification on photocatalytic activity of CdS nanocrystals studied by photoluminescence spectroscopy
期刊论文
OAI收割
physical chemistry chemical physics, 2013, 卷号: 15, 期号: 2, 页码: 553-560
作者:
Huang, Lei
;
Yang, Jinhui
;
Wang, Xiuli
;
Han, Jingfeng
;
Han, Hongxian
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2013/10/11
Nonadiabatic ab initio molecular dynamics of photoisomerization in bridged azobenzene
期刊论文
OAI收割
journal of chemical physics, 2012, 卷号: 137, 期号: 20, 页码: 2043051
作者:
Gao, Ai-Hua
;
Li, Bin
;
Zhang, Pei-Yu
;
Han, Ke-Li
收藏
  |  
浏览/下载:10/0
  |  
提交时间:2013/10/11
Surface Photocatalysis-TPD Spectrometer for Photochemical Kinetics
期刊论文
OAI收割
chinese journal of chemical physics, 2012, 卷号: 25, 期号: 5, 页码: 507-512
作者:
Ren, Ze-feng
;
Guo, Qing
;
Xu, Chen-biao
;
Yang, Wen-shao
;
Xiao, Chun-lei
收藏
  |  
浏览/下载:21/0
  |  
提交时间:2013/10/11
Temperature programmed desorption
Time of flight spectrum
Surface photochemical kinetics
Molecular dynamics simulation exploration of unfolding and refolding of a ten-amino acid miniprotein
期刊论文
OAI收割
amino acids, 2012, 卷号: 43, 期号: 2, 页码: 557-565
作者:
Zhao, Guang-Jiu
;
Cheng, Chang-Li
收藏
  |  
浏览/下载:19/0
  |  
提交时间:2013/10/11
Protein folding
Protein unfolding
Hydrogen bond
Beta-hairpin
Steered molecular dynamics
Theoretical studies of ground and excited electronic states in a series of heteroleptic iridium complexes using density functional theory
期刊论文
OAI收割
international journal of quantum chemistry, 2012, 卷号: 112, 期号: 11, 页码: 2422-2428
作者:
Su, Yan
;
Kang, Li-Hua
收藏
  |  
浏览/下载:54/0
  |  
提交时间:2013/10/11
absorption spectrum
emission properties
charge transfer
density functional calculations