| 一种新的自相互作用修正势 |
| |
| 引用本文： | 袁建民.一种新的自相互作用修正势[J].国防科技大学学报,1988,10(1):87-92. |
| |
| 作者姓名： | 袁建民 |
| |
| 作者单位： | 国防科技大学应用物理系 |
| |
| 摘 要： | 本文提出一种对具有相同角量子数的壳层取平均的自相互作用修正势,保证了单电子波函数之间的正交性,计算结果好于x_a方法和作者本人及其他作者提出的单一平均自相互作用修正势的计算结果。
|
| 关 键 词： | 自相互作用修正 势函数 x_a方法 |
| 收稿时间： | 1987/8/5 0:00:00 |
A New Scheme For the Self-Interaction-Correction |
| |
| Yuan Jianmin.A New Scheme For the Self-Interaction-Correction[J].Journal of National University of Defense Technology,1988,10(1):87-92. |
| |
| Authors: | Yuan Jianmin |
| |
| Institution: | Yuan Jianmin |
| |
| Abstract: | A new self-interaction-correction method is presented in which the shellsof the same angular quantum number l share one self-interaction-correctedpotential. The described method keeps the one-electron eigenfunctions of thesame 1 in orthogonal to each other. The results of the practical calculationsare better than that of the x_a method and the single averaged self-interaction-correction method. |
| |
| Keywords: | Self-interaction-correction Potential funetion X_a methoh |
| 本文献已被 CNKI 等数据库收录！ |
| 点击此处可从《国防科技大学学报》浏览原始摘要信息 |
| 点击此处可从《国防科技大学学报》下载免费的PDF全文 |
