用变分法数值计算2p^2位氢负离子能量本征值

IF 0.3 Q4 EDUCATION, SCIENTIFIC DISCIPLINES Jurnal Pendidikan Fisika Indonesia-Indonesian Journal of Physics Education Pub Date : 2020-06-16 DOI:10.22146/jfi.v24i1.53331
Y. R. Utomo, G. Maruto, A. Utomo, P. Nurwantoro, S. Sholihun
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引用次数: 1

摘要

用变分函数法计算了2p^2构型氢负离子(H−)的能量本征值。对氢离子的研究可以计算氢分子的电多极矩。试验函数是8个展开式项的线性组合,每个展开式项都与钱德拉塞卡基有关。这项工作产生了一系列7个能量特征值,收敛到- 0.2468,而该收敛值预计为- 0.2523。这种偏离期望值的主要原因是消除了电子间距离(u)坐标。在这项工作中使用的指数参数的值也有助于这种偏差。将这种变分方法应用于Hv2的一些能量特征函数的构造。
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Numerical Calculation of Energy Eigen-values of the Hydrogen Negative Ion in the 2p^2 Configuration by Using the Variational Method
Calculation of energy eigen value of hydrogen negative ion (H − ) in 2p^2 configuration using the method of variation functions has been done. A work on H − can lead to calculations of electric multipole moments of a hydrogen molecule. The trial function is a linear combination of 8 expansion terms each of which is related to the Chandrasekhar’s basis. This work produces a series of 7 energy eigen values which converges to a value of −0.2468 whereas the value of this convergence is expected to be −0.2523. This deviation from the expected value is mainly due to the elimination of interelectronic distance (u) coordinate. The values of the exponent parameters used in this work contribute also to this deviation. This variational method will be applied to the construction of some energy eigen functions of Hv2 .
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