机构

• 化学研究所 [67]

采集方式

• OAI收割 [67]

内容类型

• 期刊论文 [67]

发表日期

• 2017 [2]
• 2016 [3]
• 2014 [5]
• 2013 [7]
• 2012 [4]
• 2011 [5]
• 更多

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浏览/检索结果: 共67条，第1-10条 帮助 限定条件 专题：化学研究所    第一署名单位    第一作者单位    通讯作者单位     条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序发表日期升序发表日期降序题名升序题名降序作者升序作者降序 Ionization spectroscopies and theoretical calculations of cis and trans 3-fluoro-N-methylaniline-Ar-n(n=1,2) van der Waals clusters: Structures and binding energies 期刊论文  OAI收割 SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2017, 卷号: 183, 页码: 177-186 作者:  Zhang, Lijuan;  Li, Dazhi;  Cheng, Min;  Du, Yikui;  Zhu, Qihe   |  收藏  |  浏览/下载：20/0  |  提交时间：2018/04/10 3-fluoro-n-methylaniline  Ar Cluster  Rempi  Mati  Binding Energy  Dft-d   Designing Air-Stable O3-Type Cathode Materials by Combined Structure Modulation for Na-Ion Batteries 期刊论文  OAI收割 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2017, 卷号: 139, 期号: 25, 页码: 8440-8443 作者:  Yao, Hu-Rong;  Wang, Peng-Fei;  Gong, Yue;  Zhang, Jienan;  Yu, Xiqian   |  收藏  |  浏览/下载：28/0  |  提交时间：2018/04/13 Theoretical Study on Mechanism and Kinetics of Reaction of O(P-3) with Propane 期刊论文  OAI收割 CHINESE JOURNAL OF CHEMICAL PHYSICS, 2016, 卷号: 29, 期号: 4, 页码: 430-436 作者:  Jing, Fu-qiang;  Cao, Jian-wei;  Liu, Xiao-jun;  Hu, Yu-feng;  Ma, Hai-tao 收藏  |  浏览/下载：23/0  |  提交时间：2016/12/29 Reaction mechanism  Thermal rate constant  Variational transition state theory  Isotope effect   Transition from a Metal-Localized Mixed-Valence Compound to a Fully Delocalized and Bridge-Biased Electrophore in a Ruthenium-Amine-Ruthenium Tricenter System 期刊论文  OAI收割 CHEMISTRY-A EUROPEAN JOURNAL, 2016, 卷号: 22, 期号: 30, 页码: 10341-10345 作者:  Tang, Jian-Hong;  Shao, Jiang-Yang;  He, Yan-Qin;  Wu, Si-Hai;  Yao, Jiannian 收藏  |  浏览/下载：18/0  |  提交时间：2016/12/29 density functional calculations  electrochemistry  electron transfer  mixed-valence compounds  ruthenium   Two-State Reactivity in Low-Valent Iron-Mediated C-H Activation and the Implications for Other First-Row Transition Metals 期刊论文  OAI收割 JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2016, 卷号: 138, 期号: 11, 页码: 3715-3730 作者:  Sun, Yihua;  Tang, Hao;  Chen, Kejuan;  Hu, Lianrui;  Yao, Jiannian 收藏  |  浏览/下载：19/0  |  提交时间：2017/01/23 Ethylene Polymerization by 2-Methyl-8-(benzimidazol)quinolyliron(II) Pre-Catalyst: a DFT Understanding its Chain Propagation and Transfer 期刊论文  OAI收割 JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY, 2014, 卷号: 25, 期号: 12, 页码: 2244-2250 作者:  Yang, Wenhong;  Taniike, Toshiaki;  Terano, Minoru;  Chen, Yan;  Sun, Wen-Hua 收藏  |  浏览/下载：16/0  |  提交时间：2015/11/03 density functional theory  iron complex pre-catalyst  ethylene polymerization  chain propagation  chain transfer   Dynamics of Concentrated Polymer Solutions Revisited: Isomonomeric Friction Adjustment and Its Consequences 期刊论文  OAI收割 MACROMOLECULES, 2014, 卷号: 47, 期号: 13, 页码: 4460-4470 作者:  Yan, Zhi-Chao   |  收藏  |  浏览/下载：11/0  |  提交时间：2019/04/09 Relativistic GVVPT2 Multireference Perturbation Theory Description of the Electronic States of Y-2 and Tc-2 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY A, 2014, 卷号: 118, 期号: 8, 页码: 1489-1501 作者:  Tamukong, Patrick K.;  Hoffmann, Mark R.;  Li, Zhendong;  Liu, Wenjian   |  收藏  |  浏览/下载：8/0  |  提交时间：2019/04/09 REMPI spectroscopy and theoretical calculations of cis and trans 3-fluoro-N-methylaniline 期刊论文  OAI收割 JOURNAL OF MOLECULAR SPECTROSCOPY, 2014, 卷号: 296, 页码: 28-35 作者:  Zhang, Lijuan;  Liu, Sheng;  Dong, Changwu;  Cheng, Min;  Du, Yikui   |  收藏  |  浏览/下载：17/0  |  提交时间：2019/04/09 3-fluoro-n-methylaniline  Rotamer  R2pi  Pie  Quantum Chemical Calculations  Conformation Effect   Aggregation induced blue-shifted emission - the molecular picture from a QM/MM study 期刊论文  OAI收割 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2014, 卷号: 16, 期号: 12, 页码: 5545-5552 作者:  Wu, Qunyan;  Zhang, Tian;  Peng, Qian;  Wang, Dong;  Shuai, Zhigang   |  收藏  |  浏览/下载：29/0  |  提交时间：2019/04/09