中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
化学研究所 [82]
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OAI收割 [82]
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期刊论文 [82]
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2018 [7]
2017 [5]
2016 [11]
2015 [7]
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专题:化学研究所
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The role of hydroxymethanesulfonic acid in the initial stage of new particle formation
期刊论文
OAI收割
ATMOSPHERIC ENVIRONMENT, 2018, 卷号: 189, 页码: 244-251
作者:
Li, Hao
;
Zhang, Xiuhui
;
Zhong, Jie
;
Liu, Ling
;
Zhang, Haijie
  |  
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2019/04/09
Hmsa
Potential Stabilizer
Enhancement Effect
Npf
Organosulfur Chemistry
Mechanistic insights into the iridium catalysed hydrogenation of ethyl acetate to ethanol: a DFT study
期刊论文
OAI收割
DALTON TRANSACTIONS, 2018, 卷号: 47, 期号: 30, 页码: 10172-10178
作者:
Yan, Xiuli
;
Yang, Xinzheng
  |  
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2019/04/09
Naphtho[1,2-b:4,3-b '] dithiophene-based hole transporting materials for high-performance perovskite solar cells: molecular engineering and opto-electronic properties
期刊论文
OAI收割
JOURNAL OF MATERIALS CHEMISTRY A, 2018, 卷号: 6, 期号: 21, 页码: 10057-10063
作者:
Cui, Bin-Bin
;
Yang, Ning
;
Shi, Congbo
;
Yang, Shuangshuang
;
Shao, Jiang-Yang
  |  
收藏
  |  
浏览/下载:41/0
  |  
提交时间:2019/04/09
Comparative computational study on C-C/C-N/C-Br bond formations in Rh(III)-catalyzed C-H functionalizations: Stepwise versus concerted mechanisms
期刊论文
OAI收割
JOURNAL OF ORGANOMETALLIC CHEMISTRY, 2018, 卷号: 864, 页码: 105-109
作者:
Hu, Lianrui
;
Chen, Hui
  |  
收藏
  |  
浏览/下载:25/0
  |  
提交时间:2019/04/09
C-h Functionalization
Rhodium
Dft Calculation
Reaction Mechanism
Stepwise Pathway
Concerted Pathway
Mechanistic Insights into Iridium Catalyzed Disproportionation of Formic Acid to CO2 and Methanol: A DFT Study
期刊论文
OAI收割
ORGANOMETALLICS, 2018, 卷号: 37, 期号: 10, 页码: 1519-1525
作者:
Yan, Xiuli
;
Yang, Xinzheng
  |  
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2019/04/09
A DFT study on ring-opening polymerization of epsilon-caprolactone initiated by Mg and Al complexes
期刊论文
OAI收割
INORGANICA CHIMICA ACTA, 2018, 卷号: 477, 页码: 34-39
作者:
Li, PJ
;
Xi, YX
;
Li, LF
;
Li, H
;
Sun, WH
  |  
收藏
  |  
浏览/下载:20/0
  |  
提交时间:2019/04/08
Density functional theory
Ring-opening polymerization
epsilon-Caprolactone
Mg and Al complexes
Methylation Mediated Anharmonic Vibrational Signature of Nucleobases: A Case Study of Uracil and Thymine
期刊论文
OAI收割
CHEMISTRYSELECT, 2018, 卷号: 3, 期号: 16, 页码: 4374-4381
作者:
Wang, Guixiu
;
Li, Fenghai
;
Zhao, Juan
;
Wu, Yifang
;
Wang, Jianping
  |  
收藏
  |  
浏览/下载:12/0
  |  
提交时间:2019/04/09
Anharmonicities
Ftir
Thymine
Uracil
Vibrational Coupling
Mixed Phthalocyanine-Porphyrin Fused Conjugated Pentameric Nanoarrays
期刊论文
OAI收割
CHEMISTRY-A EUROPEAN JOURNAL, 2017, 卷号: 23, 期号: 60, 页码: 15017-15021
作者:
Zhang, Yuehong
;
Xue, Zheng
;
Qi, Dongdong
;
Wang, Kang
;
Liu, Huibiao
  |  
收藏
  |  
浏览/下载:15/0
  |  
提交时间:2018/04/25
Nanorods
Phthalocyanine
Porphyrins
Saddle Conformation
Semiconductivity
The molecular structures and spectroscopic properties of the ground state and the first excited state of pVP
期刊论文
OAI收割
COMPUTATIONAL AND THEORETICAL CHEMISTRY, 2017, 卷号: 1117, 页码: 266-275
作者:
Wu, Lidan
;
Yan, Linyin
;
Xia, Andong
;
Lin, ShengHien
  |  
收藏
  |  
浏览/下载:27/0
  |  
提交时间:2018/07/02
P-vinylphenol
Td-dft
Ground State
First Excited State
Selective hydration of asymmetric internal aryl alkynes without directing groups to alpha-aryl ketones over Cu-based catalyst
期刊论文
OAI收割
NEW JOURNAL OF CHEMISTRY, 2017, 卷号: 41, 期号: 14, 页码: 6290-6295
作者:
Mei, Qingqing
;
Liu, Huizhen
;
Hou, Minqiang
;
Liu, Hangyu
;
Han, Buxing
  |  
收藏
  |  
浏览/下载:13/0
  |  
提交时间:2018/04/13