Theory and computation of electromagnetic transition matrix elements in the continuous spectrum of atoms

Theory and computation of electromagnetic transition matrix elements in the continuous spectrum of atoms
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原子连续谱中电磁跃迁矩阵元的理论与计算

DOI:
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发表时间:
2014
期刊:
European Physical Journal D : Atomic, Molecular and Optical Physics
影响因子:
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通讯作者:
C. Nicolaides
C. Nicolaides
中科院分区:
--
文献类型:
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作者:
Y. Komninos;T. Mercouris;C. Nicolaides

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本文研究了多极哈密顿算符OE(κ, r′)的自由-自由(f−f)矩阵元素的数学性质。κ是光子波数。在一般情况下,散射波函数在项相关(N−1)电子核的势中进行数值计算,并进行能量归一化。发现OE(κ, r′)的f−f矩阵元素在能量轴上具有一阶奇异性,即当ε′→ε时,它们表现为(ε−ε′)-1。数值应用于氢和氖的f−f跃迁,服从电偶极子和四极子选择规则。在极限κ = 0时,OE(κ, r′)简化为电偶极子近似(EDA)的长度形式。除了在点k′= k处存在k′= k±κ的波数区域外,EDA的结果与OE(κ, r′)的结果基本一致。
The present study examines the mathematical properties of the free-free (f − f) matrix elements of the full electric field operator, OE(κ, r̅), of the multipolar Hamiltonian. κ is the photon wavenumber. Special methods are developed and applied for their computation, for the general case where the scattering wavefunctions are calculated numerically in the potential of the term-dependent (N − 1) electron core, and are energy-normalized. It is found that, on the energy axis, the f − f matrix elements of OE(κ, r̅) have singularities of first order, i.e., as ε′ → ε, they behave as (ε − ε′)-1. The numerical applications are for f − f transitions in hydrogen and neon, obeying electric dipole and quadrupole selection rules. In the limit κ = 0, OE(κ, r̅) reduces to the length form of the electric dipole approximation (EDA). It is found that the results for the EDA agree with those of OE(κ, r̅), with the exception of a wave-number region k′ = k ± κ about the point k′ = k.
DOI: 10.1126/science.1189401
发表时间: 2010-06-25
期刊: SCIENCE
影响因子: 56.9
作者:
Schultze, M.;Fiess, M.;Yakovlev, V. S.
通讯作者: Yakovlev, V. S.