Atom-centered functions in the optimized Thomas-Fermi theory

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DOI10.1006/JCPH.1995.1013zbMath0817.65130OpenAlexW1970985058MaRDI QIDQ1346515

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 functions electron density Thomas-Fermi theory numerical integrations atom-centred functions condensed phase systems speed and accuracy

Mathematics Subject Classification ID

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

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