Shannon entropies and Fisher information of K-shell electrons of neutral atoms

DOI10.1016/J.PHYSLETA.2017.12.005MaRDI QIDQ1700541zbMATH OpenOpenAlexFDO

Authors Golam Ali Sekh, Aparna Saha, B. Talukdar

Publication date 6 March 2018

Published in Physics Letters. A (Search for Journal in Brave)

Full work available at URL https://arxiv.org/abs/1710.05510

zbMATH Keywords

correlated wave functioncorrelation effectFisher informationK-shell electronsShannon entropy

Mathematics Subject Classification ID

Atomic physics (81V45) Molecular physics (81V55) Measures of information, entropy (94A17)

Abstract: We represent the two K-shell electrons of neutral atoms by Hylleraas-type wave function which fulfils the exact behavior at the electron-electron and electron-nucleus coalescence points and, derive a simple method to construct expressions for single-particle position- and momentum-space charge densities, $ho(vecr)$ and $gamma(vecp)$ respectively. We make use of the results for $ho(vecr)$ and $gamma(vecp)$ to critically examine the effect of correlation on bare (uncorrelated) values of Shannon information entropies ($S$) and of Fisher information ($F$) for the K-shell electrons of atoms from helium to neon. Due to inter-electronic repulsion the values of the uncorrelated Shannon position-space entropies are augmented while those of the momentum-space entropies are reduced. The corresponding Fisher information are found to exhibit opposite behavior in respect of this. Attempts are made to provide some plausible explanation for the observed response of $S$ and $F$ to electronic correlation.

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• Shannon and Fisher entropies for a hydrogen atom under soft spherical confinement
• Calculation of von Neumann entropy for hydrogen and positronium negative ions
• Shannon information entropy for a one-dimensional ionic crystal
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• Insights from intracules and Coulomb holes
• FISHER-SHANNON ENTROPIC UNCERTAINTY RELATIONS AND THEIR POWER-PRODUCTS AS A MEASURE OF ELECTRONIC CORRELATION
• Net Fisher information measure versus ionization potential and dipole polarizability in atoms
• The Fisher-Shannon information plane for atoms
• Statistical complexity and Fisher-Shannon information in the H-atom
• Characterization of the Chandrasekhar correlated two-electron wavefunction using Fisher, Shannon and statistical complexity information measures
• Effects of global monopole on thermodynamic properties and Shannon entropy under a Mie-type potential
• Rényi information of atoms
• Electron density and Fisher information of Dirac-Fock atoms

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