How Regiochemistry Influences Aggregation Behavior and Charge Transport in Conjugated Organosulfur Polymer Cathodes for Lithium-Sulfur Batteries.

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作者： Yannik,Schütze ^[1] ; Diptesh,Gayen ^[2] ; Karol,Palczynski ^[3] ; Ranielle,de Oliveira Silva ^[1] ; Yan,Lu ^[4] ; Michael,Tovar ^[4] ; Pouya,Partovi-Azar ^[5] ; Annika,Bande ^[6] ; Joachim,Dzubiella ^[7]

作者单位： Research Group for Simulations of Energy Materials, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, 14109 Berlin, Germany. ^[1] Theoretical Chemistry, Institute of Chemistry and Biochemistry, Freie Universität Berlin, Arnimallee 22, 14195 Berlin, Germany. ^[2] Applied Theoretical Physics - Computational Physics, Physikalisches Institut, Albert-Ludwigs-Universität Freiburg, Hermann-Herder-Straße 3, 79104 Freiburg, Germany. ^[3] Department Electrochemical Energy Storage, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, 14109 Berlin, Germany. ^[4] Institute of Chemistry, University of Potsdam, Am Neuen Palais 10, 14469 Potsdam, Germany. ^[5] Department Structure and Dynamics of Energy Materials, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, 14109 Berlin, Germany. ^[6] Institute for Chemistry, Martin Luther Universität Halle-Wittenberg, Von-Danckelmann-Platz 4, 06120 Halle (Saale), Germany. ^[7] Theory of Electron Dynamics and Spectroscopy, Helmholtz-Zentrum Berlin für Materialien und Energie GmbH, Hahn-Meitner-Platz 1, 14109 Berlin, Germany. ^[8]

关键词 X-ray diffraction charge transport conjugated polymer lithium?sulfur battery molecular dynamics simulations regularity self-assembly

DOI 10.1021/acsnano.3c01523

PMID 37014093

发布时间 2023-05-01

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