| A4分子的定性分子轨道处理 |
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| 引用本文： | 邬冰 班福强. A4分子的定性分子轨道处理[J]. 哈尔滨师范大学自然科学学报, 1995, 11(3): 58-62 |
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| 作者姓名： | 邬冰 班福强 |
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| 作者单位： | 哈尔滨师范大学 |
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| 摘 要： | 本文用定性分子轨道理论和碎片轨道法构造了氢原子簇Ｈ４和代表性元素磷的四原子簇合物Ｐ４的分子轨道。可得分子轨道的形状和相对能级次序与定理计算结果一致。
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| 关 键 词： | 原子族 定性分子轨道 簇状化合物 |
A QUALITATIVE MOLECULAR ORBITAL TREATMENT OF A_4 MOLECULES |
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| Wu Bing,Ban Fuqiang, Dai Baiqin. A QUALITATIVE MOLECULAR ORBITAL TREATMENT OF A_4 MOLECULES[J]. Natural Science Journal of Harbin Normal University, 1995, 11(3): 58-62 |
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| Authors: | Wu Bing Ban Fuqiang Dai Baiqin |
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| Affiliation: | Harbin Normal University |
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| Abstract: | Molecular orbitals of hydrogen cluster H_4 and homoatomic cluster P_4 of representative element phosphorous are qualitatively constructled by using fragment molecular orbital approach.The shapes and relative energy levels of these MO are consistant with the results ofquantitative calculations. |
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| Keywords: | A_4 cluster Fragment molecular orbital |
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