| 通过分子轨道稳定化能曲面研究d~8低自旋配合物的几何构型 |
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| 引用本文： | 汪颖军,吴殿义,王佳.通过分子轨道稳定化能曲面研究d~8低自旋配合物的几何构型[J].高师理科学刊,2001,21(2):37-39. |
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| 作者姓名： | 汪颖军 吴殿义 王佳 |
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| 作者单位： | 1. 大庆石油学院,石化系,黑龙江,安达,151400
2. 辽宁师范大学,化学系,辽宁,大连,116029 |
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| 摘 要： | 自编程序计算了d8低自旋配合物中心离子不同d电子分布时配体在不同空间方向上与中心离子配位所产生的分子轨道稳定化能 ,并首次绘制了分子轨道稳定化能曲面 ,由此阐明了该类配合物的配位数、几何构型、配体配位方向等随中心离子电子排布不同而发生的变化
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| 关 键 词： | 分子轨道稳定化能 d8低自旋配合物 几何构型 空间曲面 |
| 文章编号： | 1007-9831(2001)02-0037-03 |
| 修稿时间： | 2001年2月26日 |
Studies on gemetric configuration of d8 low-spin coordination compound by molecular orbital stabilization energy curved surface |
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| WANG Ying jun ,WU Dian yi ,WANG Jia.Studies on gemetric configuration of d8 low-spin coordination compound by molecular orbital stabilization energy curved surface[J].Journal of Science of Teachers＇College and University,2001,21(2):37-39. |
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| Authors: | WANG Ying jun WU Dian yi WANG Jia |
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| Institution: | WANG Ying jun 1,WU Dian yi 1,WANG Jia 2 |
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| Abstract: | The present paper covers the molecular orbital stabilization energy(MOSE),calculated by a self design computer program,of d 8 low spin coordination compound produced by the coordination of ligand in every space direction and central ions with certain electron distribution.The MOSE curved surface is drawn.It is expounded that the coordination number、the coordination direction of ligand and the geometric configuration of coordination compound vary with the delectron distribution of d 8 centralion. |
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| Keywords: | molecular orbital stabilization energy d 8 low spin coordination compound geometric configuration space curved surface |
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