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Chinese Academy of Sciences Institutional Repositories Grid
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  • 化学研究所 [40]
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  • 2011 [40]
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Synthesis, structures and spectroscopic properties of new 1,2-bis[2-(4-methyl-7-acetylamino-1,8-naphthyridine)]ethylene ligand and its binuclear copper(I) complexes 期刊论文  OAI收割
INORGANICA CHIMICA ACTA, 2011, 卷号: 379, 期号: 1, 页码: 7-15
作者:  Li Zhan-Xian;  Li Cong;  Mu Wei-Hua;  Xiong Shao-Xiang;  Fu Wen-Fu
  |  收藏  |  浏览/下载：11/0  |  提交时间：2019/04/09
Reaction Mechanism of Cl-2 and 1-Alkyl-3-methylimidazolium Chloride Ionic Liquids 期刊论文  OAI收割
JOURNAL OF PHYSICAL CHEMISTRY A, 2011, 卷号: 115, 期号: 46, 页码: 13452-13466
作者:  Hu, Shao-Wen;  Wang, Zhu-Xiang;  Qu, Feng;  Chu, Tai-Wei;  Wang, Xiang-Yun
  |  收藏  |  浏览/下载：7/0  |  提交时间：2019/04/09
Linear-Scaling Time-Dependent Density Functional Theory Based on the Idea of "From Fragments to Molecule" 期刊论文  OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2011, 卷号: 7, 期号: 11, 页码: 3643-3660
作者:  Wu, Fangqin;  Liu, Wenjian;  Zhang, Yong;  Li, Zhendong
  |  收藏  |  浏览/下载：10/0  |  提交时间：2019/04/09
Living Regioselective Copolymerization of Ethylene with Nonconjugated Bicyclic Dienes Using (Salicylaldiminato)(beta-enaminoketonato) Titanium Catalysts 期刊论文  OAI收割
JOURNAL OF POLYMER SCIENCE PART A-POLYMER CHEMISTRY, 2011, 卷号: 49, 期号: 21, 页码: 4626-4638
作者:  Long, Ying-Yun;  Wang, Yong-Xia;  Liu, Jing-Yu
  |  收藏  |  浏览/下载：13/0  |  提交时间：2019/04/09
Charge Delocalization in a Cyclometalated Bisruthenium Complex Bridged by a Noninnocent 1,2,4,5-Tetra(2-pyridyl)benzene Ligand 期刊论文  OAI收割
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2011, 卷号: 133, 期号: 39, 页码: 15697-15706
作者:  Yao, Chang-Jiang;  Zhong, Yu-Wu;  Yao, Jiannian
  |  收藏  |  浏览/下载：8/0  |  提交时间：2019/04/09
Perferryl Fe-v-Oxo Nonheme Complexes: Do They Have High-Spin or Low-Spin Ground States? 期刊论文  OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2011, 卷号: 7, 期号: 10, 页码: 3049-3053
作者:  Chen, Hui;  Lai, Wenzhen;  Yao, Jiannian;  Shaik, Sason
  |  收藏  |  浏览/下载：13/0  |  提交时间：2019/04/09
DESIGNING NANO-STRUCTURES OF BLOCK COPOLYMERS VIA COMPUTER SIMULATION 期刊论文  OAI收割
ACTA POLYMERICA SINICA, 2011, 期号: 9, 页码: 973-984
作者:  Li Zhanwei;  Jia Xiaoxi;  Zhang Jing;  Sun Zhaoyan;  Lu Zhongyuan
  |  收藏  |  浏览/下载：22/0  |  提交时间：2019/04/09
Theoretical study of substitution effects on molecular reorganization energy in organic semiconductors 期刊论文  OAI收割
JOURNAL OF CHEMICAL PHYSICS, 2011, 卷号: 135, 期号: 10
作者:  Geng, Hua;  Niu, Yingli;  Peng, Qian;  Shuai, Zhigang;  Coropceanu, Veaceslav
  |  收藏  |  浏览/下载：13/0  |  提交时间：2019/04/09
Intra- and Interatomic Spin Interactions by the Density Functional Theory plus U Approach: A Critical Assessment 期刊论文  OAI收割
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2011, 卷号: 7, 期号: 9, 页码: 2795-2803
作者:  Zhang, Yachao;  Jiang, Hong
  |  收藏  |  浏览/下载：8/0  |  提交时间：2019/04/09
Theoretical investigation on sum-frequency vibrational spectroscopy off electronic resonance for limonene chiral liquids: The second-order Herzberg-Teller effect 期刊论文  OAI收割
CHEMICAL PHYSICS LETTERS, 2011, 卷号: 512, 期号: 4-6, 页码: 269-272
作者:  Zheng, Ren-hui;  Wei, Wen-mei;  Li, Hui-xue;  Shi, Qiang
  |  收藏  |  浏览/下载：12/0  |  提交时间：2019/04/09