Atom-centered functions in the optimized Thomas-Fermi theory

DOI10.1006/JCPH.1995.1013MaRDI QIDQ1346515zbMATH OpenOpenAlexFDO

Authors Gary G. Hoffman

Publication date 5 April 1995

Published in Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1006/jcph.1995.1013

zbMATH Keywords

exponential functionselectron densityThomas-Fermi theorynumerical integrationsatom-centred functionscondensed phase systemsspeed and accuracy

Mathematics Subject Classification ID

PDEs in connection with quantum mechanics (35Q40) Applications to the sciences (65Z05) Path integrals in quantum mechanics (81S40)

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Cited in

(4)

• Tests and applications for atoms of an optimized semiexplicit density functional method
• An upper and lower solution approach for a generalized Thomas-Fermi theory of neutral atoms
• The atomic density on the Thomas-Fermi length scale for the Chandrasekhar Hamiltonian
• Minimal realizations of atomic density functions

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