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qzhaosdu金虫 (著名写手)
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[求助]
哪位好心人帮忙查下这篇文章是否现在能在web of science查到被SCI收录，谢谢！
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哪位好心人帮忙查下这篇文章是否现在能在web of science查到被SCI收录，谢谢！ ZHAO Qiang, FENG Da-Cheng. Influence of Transition Metal M (M=Cu, Ag, Au) on the Strength of Halogen Bonding Interaction X…Cl (X=F, Cl, Br)[J]. Acta Phys. Chim. Sin., 2012, 28(06): 1361-1367. doi: 10.3866/PKU.WHXB201203261 |
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3楼2012-11-17 14:36:14
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qzhaosdu: 金币+20, 谢谢，这个就是能查到被SCI收录了是吧？ 2012-11-17 14:34:06
感谢参与，应助指数 +1
qzhaosdu: 金币+20, 谢谢，这个就是能查到被SCI收录了是吧？ 2012-11-17 14:34:06
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Influence of Transition Metal M (M=Cu, Ag, Au) on the Strength of Halogen Bonding Interaction X center dot center dot center dot Cl (X=F, Cl, Br) 作者: Zhao, Q (Zhao Qiang)1; Feng, DC (Feng Da-Cheng)2 来源出版物: ACTA PHYSICO-CHIMICA SINICA 卷: 28 期: 6 页: 1361-1367 DOI: 10.3866/PKU.WHXB201203261 出版年: JUN 2012 被引频次: 0 (来自 Web of Science) 引用的参考文献: 34 [ 查看 Related Records ] 引证关系图引证关系图 摘要: Intermolecular complexes of MCH2X center dot center dot center dot CIF (M=Cu, Ag, Au; X = F, Cl, Br) and CH3X center dot center dot center dot CIF were investigated using by quantum chemistry method. Only one stable structure containing a halogen bond was obtained for the CH3X center dot center dot center dot CIF complexes. For the MCH2X center dot center dot center dot CIF complexes, as well as the halogen-bonded complex, another optimized structure containing both a halogen bond and M center dot center dot center dot Cl interaction was determined. The stability of the MCH2X center dot center dot center dot CIF complexes was greater than that of the CH3X center dot center dot center dot CIF complexes. Substitution with M improves the stability of the resulting complex with the order Ag>Cu>Au. The most negative molecular electrostatic potential of X in MCH2X and CH3X was calculated, and the decrease of this value is the main reason for the enhanced stability of these complexes. The characteristics of these complexes were also studied by natural bond orbital and atoms in molecules methods. The second-order perturbation energy and topological properties of the saddle points were calculated and the results were consistent with the interaction energy. 入藏号: WOS:000305035700010 文献类型: Article 语种: Chinese 作者关键词: Halogen bond; Transition metal; Enhancing effect; Stability KeyWords Plus: INTERMOLECULAR INTERACTIONS; ELECTRON-DENSITY; MOLECULES; NETWORKS; ATOMS 通讯作者地址: Zhao, Q (通讯作者),Zibo Vocat Inst, Dept Chem Engn, Zibo 255314, Shandong, Peoples R China. 地址: 1. Zibo Vocat Inst, Dept Chem Engn, Zibo 255314, Shandong, Peoples R China 2. Shandong Univ, Inst Theoret Chem, Jinan 250100, Peoples R China 电子邮件地址: qzhaochem@yahoo.cn 出版商: PEKING UNIV PRESS, PEKING UNIV, CHEMISTRY BUILDING, BEIJING 100871, PEOPLES R CHINA Web of Science 类别: Chemistry, Physical 研究方向: Chemistry IDS 号: 955QJ ISSN: 1000-6818 |
2楼2012-11-17 14:30:56
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