| Bonding of the chain structure for novel boranes B_(3k+)H_(5k+p+3)~- |
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| 引用本文： | ZHONG,Shi-Jun WANG,Yin-Gui ZHANG,Qian-ErState Key Laboratory of Structural Chemistry,Fujian Institute of Research on the Structure of Matter,Chinese Academy of Science,Fuzhou,Fujian 350002,China.Department of Chemistry,and Institute of Physical Chemistry,Xiamen University,Xiamen,Fujian 361005,China. Bonding of the chain structure for novel boranes B_(3k+)H_(5k+p+3)~-[J]. 中国化学, 1994, 0(4) |
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| 作者姓名： | ZHONG Shi-Jun WANG Yin-Gui ZHANG Qian-ErState Key Laboratory of Structural Chemistry Fujian Institute of Research on the Structure of Matter Chinese Academy of Science Fuzhou Fujian 350002 China.Department of Chemistry and Institute of Physical Chemistry Xiamen University Xiamen Fujian 361005 China |
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| 作者单位： | ZHONG，Shi-Jun WANG，Yin-Gui ZHANG，Qian-ErState Key Laboratory of Structural Chemistry，Fujian Institute of Research on the Structure of Matter，Chinese Academy of Science，Fuzhou，Fujian 350002，China.Department of Chemistry，and Institute of Physical Chemistry，Xiamen University，Xiamen，Fujian 361005，China |
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| 基金项目： | Project supported financially by the National Natural Science Foundation of China. |
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| 摘 要： | The molecular orbitals obtained from conventional quantum chemistry calculations, are expressed in terms of symmetrized valence bond functions of fragment, and a direct picture of chemical bonding can be drawn easily. This method is utilized, together with extended Huckel calculations, to interpret the bonding properties of a centipede-like chain structure for novel laser-producing boranes B3k+pH5k+p+3- which is constructed from the repeated unit B3H5 linked to each other by three B-H-B bonds.
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Bonding of the chain structure for novel boranes B_(3k+)H_(5k+p+3)~- |
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| ZHONG,Shi-Jun WANG,Yin-Gui ZHANG,Qian-ErState Key Laboratory of Structural Chemistry,Fujian Institute of Research on the Structure of Matter,Chinese Academy of Science,Fuzhou,Fujian ,China. Bonding of the chain structure for novel boranes B_(3k+)H_(5k+p+3)~-[J]. Chinese Journal of Chemistry, 1994, 0(4) |
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| Authors: | ZHONG Shi-Jun WANG Yin-Gui ZHANG Qian-ErState Key Laboratory of Structural Chemistry Fujian Institute of Research on the Structure of Matter Chinese Academy of Science Fuzhou Fujian China |
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| Affiliation: | ZHONG,Shi-Jun WANG,Yin-Gui ZHANG,Qian-ErState Key Laboratory of Structural Chemistry,Fujian Institute of Research on the Structure of Matter,Chinese Academy of Science,Fuzhou,Fujian 350002,China.Department of Chemistry,and Institute of Physical Chemistry,Xiamen University,Xiamen,Fujian 361005,China |
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| Abstract: | The molecular orbitals obtained from conventional quantum chemistry calculations, are expressed in terms of symmetrized valence bond functions of fragment, and a direct picture of chemical bonding can be drawn easily. This method is utilized, together with extended Huckel calculations, to interpret the bonding properties of a centipede-like chain structure for novel laser-producing boranes B3k+pH5k+p+3- which is constructed from the repeated unit B3H5 linked to each other by three B-H-B bonds. |
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| Keywords: | Symmetrized valence bond function bridge bond novel boranes. |
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