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首页> 外文期刊>The Journal of Chemical Physics >INTERELECTRONIC MOMENTS OF ATOMS IN POSITION AND MOMENTUM SPACES
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INTERELECTRONIC MOMENTS OF ATOMS IN POSITION AND MOMENTUM SPACES

机译:原子的电子间矩的位置和动量空间

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Two methods are presented for the calculation of interelectronic moments [u(n)] in position space and (un) in momentum space of atomic systems within the Hartree-Fock framework, where rr and v are, respectively, the position and momentum distances of any pair of electrons. The methods are applied to the neutral atoms from He to Xe in their ground state, and the moments [u(n)] with n =-2 to +4 and [v(n)] with n=-2 to +3 are reported based on the numerical Hartree-Fock calculations. Some trends of these interelectronic moments are also discussed as a function of atomic number. (C) 1997 American Institute of Physics. [S0021-9606(97)01044-1]. [References: 54]
机译:提出了两种方法来计算Hartree-Fock框架中原子系统的位置空间和动量空间中的电子间矩[u(n)],其中rr和v分别是原子的位置和动量距离。任何一对电子。该方法适用于处于基态的He至Xe的中性原子,n = -2至+4的矩[u(n)]和n = -2至+3的矩[v(n)]为报告基于数值Hartree-Fock计算。这些电子间矩的一些趋势也作为原子序数的函数进行了讨论。 (C)1997美国物理研究所。 [S0021-9606(97)01044-1]。 [参考:54]

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