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On the relation between nodal structures in quantum wave functions and particle correlation

Zitieren Sie bitte immer diese URN: urn:nbn:de:bvb:20-opus-350361
  • We study the influence of nodal structures in two-dimensional quantum mechanical densities on wave packet entanglement. This is motivated by our recent study [Entropy, 25, 970 (2023)], which showed that the mutual information derived from the momentum-space probability density of a coupled two-particle system exhibits an unusual time dependence, which is not encountered if the position-space density is employed in the calculation. In studying a model density, here, we identify cases where the mutual information increases with the number ofWe study the influence of nodal structures in two-dimensional quantum mechanical densities on wave packet entanglement. This is motivated by our recent study [Entropy, 25, 970 (2023)], which showed that the mutual information derived from the momentum-space probability density of a coupled two-particle system exhibits an unusual time dependence, which is not encountered if the position-space density is employed in the calculation. In studying a model density, here, we identify cases where the mutual information increases with the number of nodes in the wave function and approaches a finite value, whereas in this limit, the linear correlation vanishes. The results of the analytical model are then applied to interpret the correlation measures for coupled electron-nuclear dynamics, which are treated by numerically solving the time-dependent Schrödinger equation.zeige mehrzeige weniger

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Metadaten
Autor(en): Peter SchürgerORCiD, Volker EngelORCiD
URN:urn:nbn:de:bvb:20-opus-350361
Dokumentart:Artikel / Aufsatz in einer Zeitschrift
Institute der Universität:Fakultät für Chemie und Pharmazie / Institut für Physikalische und Theoretische Chemie
Sprache der Veröffentlichung:Englisch
Titel des übergeordneten Werkes / der Zeitschrift (Englisch):AIP Advances
Erscheinungsjahr:2023
Band / Jahrgang:13
Heft / Ausgabe:12
Aufsatznummer:125307
Originalveröffentlichung / Quelle:AIP Advances (2023) 13:12, 125307. DOI: 10.1063/5.0180004
DOI:https://doi.org/10.1063/5.0180004
Allgemeine fachliche Zuordnung (DDC-Klassifikation):5 Naturwissenschaften und Mathematik / 54 Chemie / 541 Physikalische Chemie
Freie Schlagwort(e):Schroedinger equation; covariance and correlation; information theory entropy; nodal structures; particle correlations; quantum wave functions; time-dependent Schrodinger equation
Datum der Freischaltung:16.05.2024
Lizenz (Deutsch):License LogoCC BY: Creative-Commons-Lizenz: Namensnennung 4.0 International