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中国物理学会期刊

类锂体系激发态1s2 nd(n=3,4,5)精细结构和项能的理论计算

CSTR: 32037.14.aps.51.2733

Theoretical calculation of the fine-structure and term energy of the excited states 1s~2 nd(n=3,4,5 of lithium-like systems

CSTR: 32037.14.aps.51.2733
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  • 使用全实加关联(fullcorepluscorrelation缩写为FCPC)和里兹(Ritz)变分方法计算了类锂体系(Z=11—20)激发态1s2nd(n=3,4,5)的非相对论能量和波函数;包括动能修正、电子电子接触项、轨道轨道相互作用项以及Darwin项的相对论修正和质量极化项由全实加关联波函数的一阶微扰给出,量子电动力学(quantumelectronicdynamics缩写为QED)修正由有效核电荷方法和类氢公式计算;给出了高电离类锂体系激发态的激发能、精细结构和项能(termenergy),并

     

    The fullcore plus correlation (FCPC) and the minimiziation of the expectation value of the Hamiltonian method is extended to calculate the nonreltivistic energies and the wave functions of 1s~2 nd(n=3,4,5) states for the lithium like systems from Z=11 to 20. The mass-polarization and the relativistic correction including the kinetic-energy correction, the Darwin term, the electron-electron contact term, and the orbitorbit interaction are calculated perturbatively as the first-order correction. The contribution from quantum electrodynamics (QED) is also included by using the effective nuclear charge formula. The excited energies, finestructure, and the termenergy are given and compared with other theoretical calculation and experimental results. It is shown that the correlative wave in the FCPC method embodies very well the strong correlation effect between the 1s~2 core and the valence electron.

     

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