共查询到20条相似文献,搜索用时 15 毫秒
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利用塞曼哈密顿的球张量形式,采用将微扰理论与里兹变分方法相结合的方式,导出了氦原子1snp组态塞曼哈密顿矩阵元的一般形式,给出了氦原子1s3p组态塞曼效应之解,并绘出了不同磁场强度下氦原子1s3p组态的塞曼能级分裂图. 相似文献
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He原子非相对论基态能量的变分计算 总被引:1,自引:0,他引:1
本文指出了一种现象:当忽略原子核的运动时,He原子非相对论基态变分能量的计算值将会低于实验值.考虑对原子核运动的修正后,通过使用一个带松弛坐标参数k的变分波函数对He原子的非相对论基态能量进行了变分计算,得到比较满意的结果.此计算与变分原理一致. 相似文献
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四参数法计算氦原子基态能级研究 总被引:3,自引:0,他引:3
在求解氦原子径向Schr dinger方程时,设计了含有四参数的基态波函数,推导出含有四参数的氦原子基态能级表达式,分别采用Matlab 7.0最优化运算和Monte-Carlo法,计算了氦原子的基态能量,得到了相应的波函数.将计算结果与其它文献采用变分法所得计算值及实验值进行了比较,结果表明:这种方法不仅计算简便有效,准确性较高,而且所得氦原子基态空间波函数自动满足空间对称性的要求. 相似文献
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1 INTRODUCTIONThephenomenonofnon sequentialdoubleionizationofatomsthatareexposedtointenselaserfieldshasattractedextensiveattentionbothintheoriesandinexperiments .The pioneeringworkbeganwiththeobservationofa“knee”or“shoulder”structureontheXe2 ionsignalve… 相似文献
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《Physics letters. A》2014,378(7-8):644-645
The study of Gál and March (2009) [1] is utilized to derive a third-order differential equation for the ground-state electron density of two-electron model atoms having inverse-square repulsion, but arbitrary external potential. The result offers hope of progress on He-like atomic ions. 相似文献
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Persistent efforts in both theory and experiment have yielded increasingly precise understanding of the helium atom. Because
of its simplicity, the helium atom has long been a testing ground for relativistic and quantum electrodynamic effects in few-body
atomic systems theoretically and experimentally. Comparison between theory and experiment of the helium spectroscopy in 1s2p3P
J
can potentially extract a very precise value of the fine structure constant á. The helium atom can also be used to explore
exotic nuclear structures. In this paper, we provide a brief review of the recent advances in precision calculations and measurements
of the helium atom.
相似文献
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用变分微扰论计算了氦原子1S2S态两个能级的能量.先用单参数变分法计算,再进行二级微扰计算,改进了纯微扰论的结果,得到的能量值与实验数据较好相符. 相似文献
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根据微扰论,在动量表象中讨论了三维和二维氦原子两电子体系基态能级一级修正的表达式.对于推广的两电子二体作用势,给出了基态能级一级修正的值. 相似文献
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以相对论修正哈密顿(包括质量修正、单体和双体达尔文修正、自旋-自旋接触相互作用)的球张量形式为基础, 借助不可约张量理论导出了类氩体系基态能量的相对论修正的解析表达式. 在斯莱特表象中完成了所有的角向积分和自旋求和计算, 能量的相对论修正式用径向矩阵元的线性组合来表示.对类氩体系基态能量的相对论修正值进行了具体计算,相对误差均小于0.0459% 相似文献
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借助不可约张量理论,导出了氦原子2^3P态自旋-其他轨道相互作用能的理论计算式,在推导过程中完成了所有角向积分和自旋求和计算. 相似文献
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使用相对论的和非相对论的赝势在HF ,MP2 ,CCSD和CCSD(T)水平上计算了M2 Te(M =Cu ,Ag ,Au)的平衡几何和振动频率。计算的结果表明 ,这些化合物的基态 (单态 ) ,弯曲结构是稳定的 ,线性结构是不稳定的。在MP2水平上研究了电子相关对这些化合物的几何结构的修正。电子相关对键角的修正是非常明显的 ,对于M =Cu ,Ag ,Au ,角∠M Te M分别减少了 2 3.3°,2 1.8°和 2 1.8°。电子相关对键长的修正是微小的。相对论效应轻微地缩短了Au2 Te的键长。比较这三个化合物 ,Au2 Te相对稳定。 相似文献
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The 1 1 0 +,1 1 (-1) + and 1 1 (-2) + states of the helium atom in the magnetic field regime between 0 and 100 a.u.are studied using a full configuration-interaction (CI) approach.The total energies,derivatives of the total energy with respect to the magnetic field and ionisation energies are calculated with Hylleraas-like functions in spherical coordinates in low to intermediate fields and Hylleraas-Gaussian functions in cylindrical coordinates in intermediate to high fields,respectively.In intermediate fields,the total energies and ionisation energies are determined in terms of Hermite interpolation,based on the results obtained with the two above-mentioned basis functions.Calculations show that the current method can produce lower total energies and larger ionisation energies,and make the two ionisation energy curves obtained with the two above-mentioned basis functions join smoothly in intermediate fields.Comparisons are also made with previous works. 相似文献
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An analysis of the analyticity properties of the quadratic Zeeman energy shifts in the hydrogen atom leads us to once-subtracted dispersion relations for the energy levels. These relations (i) provide a compact representation of the general properties of the energy shifts, (ii) allow us to calculate energy levels for a wide range of values of the field. 相似文献