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Upper Estimates for Electronic Density in Heavy Atoms and Molecules

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arxiv 1906.00611 v4 pith:FEZYD544 submitted 2019-06-03 math-ph math.MPmath.SP

classification math-phmath.MPmath.SP
keywords atomsdensityelectronicestimateheavymoleculesnucleitotal
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abstract

We derive an upper estimate for electronic density $\rho_\Psi (x)$ in heavy atoms and molecules. While not sharp, on the distances $\gtrsim Z^{-1}$ from the nuclei it is still better than the known estimate $CZ^3$ ($Z$ is the total charge of the nuclei, $Z\asymp N$ the total number of electrons).

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  1. Strong Scott Conjecture

    math-ph 2019-08 conditional novelty 6.0 of 10

    Near each nucleus of a heavy atom or molecule, the true ground-state electron density is close, with explicit L^p error bounds, to the density of a single non-interacting hydrogenic atom, in both nonrelativistic and r...

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