| H+H_2交换反应的一点探讨 |
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| 引用本文： | 杨忠志,孙仁安.H+H_2交换反应的一点探讨[J].辽宁师范大学学报(自然科学版),1987(3). |
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| 作者姓名： | 杨忠志 孙仁安 |
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| 作者单位： | 吉林大学理论化学研究所，辽宁师范大学化学系 |
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| 摘 要： | 应用HMO理论,在确定一组基函数后,Hamilton算子表示为一个矩阵。它所对应行列式数值有无具体的物理意义是值得讨论的。本文采用HMO方法,对Halllilton算子的矩阵元做了近似表示。通过初步探讨指出,对于H+H_2交换反应,其直线性进攻路线(经由过渡态)恰好对应Hamilton矩阵行列式的极值线。所得结果有待进一步研究。
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| 关 键 词： | 交换反应 |
Study About the H+H_2 Exchange Reaction |
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| Yang Zhongzi.Study About the H+H_2 Exchange Reaction[J].Journal of Liaoning Normal University(Natural Science Edition),1987(3). |
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| Authors: | Yang Zhongzi |
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| Abstract: | Because a set of base function is selected, the Hamilton operator can be represented by a matrix under the HMO theory, It is worth studying the physical significance implied in the value of the determinant corresponding to the matrix.
In this paper, the elements of the Hamilton matrix are approximately expresented by means of the HMO method. And it is found that the attack line for the H+H_2 exchange reaction corresponds to the line of the extreme value of the determinant corresponding to the Hamilton matrix.
It is neccesary to examine the result further. |
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| Keywords: | Exchange Rea ction |
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