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首页> 外文期刊>The Journal of Chemical Physics >BOUNDS TO INFORMATION ENTROPIES FOR ATOMIC SYSTEMS
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BOUNDS TO INFORMATION ENTROPIES FOR ATOMIC SYSTEMS

机译:原子系统信息熵的束缚

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Bounds to atomic information entropies and their sum in position and momentum spaces have been derived in terms of radial and momentum expectation values [r(n)] and [p(n)]. Numerical studies on atomic systems show that the bounds presented in terms of [r] and [p], the first moments of the position and momentum space densities are sharper than those given by Gadre and Bendale in terms of [r(2)] and [p(2)], the second moments of the position and momentum space densities, Within the BKCM procedure due to Burkhardt, Konya, Coulson, and March, several relationships between the information entropies and the average electron densities [rho] and [gamma] in position and momentum spaces have been established. (C) 1997 American Institute of Physics. [References: 34]
机译:已经根据径向和动量期望值[r(n)]和[p(n)]导出了原子信息熵的界限及其位置和动量空间的总和。原子系统的数值研究表明,以[r]和[p]表示的边界,位置和动量空间密度的第一刻比[[r(2)]和Gadre和Bendale给出的边界更尖锐。 [p(2)],位置和动量空间密度的第二阶矩,在Burkhardt,Konya,Coulson和March的BKCM程序中,信息熵与平均电子密度ρ和γ之间存在几种关系在位置和动量空间中已建立。 (C)1997美国物理研究所。 [参考:34]

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