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dc.date.accessioned2021-03-15T20:43:20Z
dc.date.available2021-03-15T20:43:20Z
dc.date.created2020-09-22T09:59:25Z
dc.date.issued2020
dc.identifier.citationLaestadius, Andre Faulstich, Fabian Maximilian . One-dimensional Lieb–Oxford bounds. Journal of Chemical Physics. 2020, 152(23), 234112
dc.identifier.urihttp://hdl.handle.net/10852/84100
dc.description.abstractWe investigate and prove Lieb–Oxford bounds in one dimension by studying convex potentials that approximate the ill-defined Coulomb potential. A Lieb–Oxford inequality establishes a bound of the indirect interaction energy for electrons in terms of the one-body particle density ρψ of a wave function ψ. Our results include modified soft Coulomb potential and regularized Coulomb potential. For these potentials, we establish Lieb–Oxford-type bounds utilizing logarithmic expressions of the particle density. Furthermore, a previous conjectured form Ixc(ψ)≥−C1∫ℝρψ(x)2dx is discussed for different convex potentials.
dc.languageEN
dc.titleOne-dimensional Lieb–Oxford bounds
dc.typeJournal article
dc.creator.authorLaestadius, Andre
dc.creator.authorFaulstich, Fabian Maximilian
cristin.unitcode185,15,12,70
cristin.unitnameHylleraas-senteret
cristin.ispublishedtrue
cristin.fulltextpostprint
cristin.qualitycode1
dc.identifier.cristin1831984
dc.identifier.bibliographiccitationinfo:ofi/fmt:kev:mtx:ctx&ctx_ver=Z39.88-2004&rft_val_fmt=info:ofi/fmt:kev:mtx:journal&rft.jtitle=Journal of Chemical Physics&rft.volume=152&rft.spage=234112&rft.date=2020
dc.identifier.jtitleJournal of Chemical Physics
dc.identifier.volume152
dc.identifier.issue23
dc.identifier.doihttps://doi.org/10.1063/5.0009419
dc.identifier.urnURN:NBN:no-86847
dc.type.documentTidsskriftartikkel
dc.type.peerreviewedPeer reviewed
dc.source.issn0021-9606
dc.identifier.fulltextFulltext https://www.duo.uio.no/bitstream/handle/10852/84100/2/LO-bound-Laestadius-Faulstich-post-print.pdf
dc.type.versionAcceptedVersion
cristin.articleid234112
dc.relation.projectNFR/262695
dc.relation.projectNFR/287906
dc.relation.projectEU/639508


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