001019406 001__ 1019406
001019406 005__ 20240712113118.0
001019406 0247_ $$2doi$$a10.1021/acs.macromol.2c01795
001019406 0247_ $$2ISSN$$a0024-9297
001019406 0247_ $$2ISSN$$a1520-5835
001019406 0247_ $$2datacite_doi$$a10.34734/FZJ-2023-05366
001019406 0247_ $$2WOS$$aWOS:000884919100001
001019406 037__ $$aFZJ-2023-05366
001019406 082__ $$a540
001019406 1001_ $$00000-0002-3903-1504$$aFischer, Mirko$$b0
001019406 245__ $$aStructure and Transport Properties of Poly(ethylene oxide)-Based Cross-Linked Polymer Electrolytes─A Molecular Dynamics Simulations Study
001019406 260__ $$aWashington, DC$$bSoc.$$c2022
001019406 3367_ $$2DRIVER$$aarticle
001019406 3367_ $$2DataCite$$aOutput Types/Journal article
001019406 3367_ $$0PUB:(DE-HGF)16$$2PUB:(DE-HGF)$$aJournal Article$$bjournal$$mjournal$$s1714995025_14350
001019406 3367_ $$2BibTeX$$aARTICLE
001019406 3367_ $$2ORCID$$aJOURNAL_ARTICLE
001019406 3367_ $$00$$2EndNote$$aJournal Article
001019406 520__ $$aWe present an extensive molecular dynamics (MD) simulation study of poly(ethylene oxide) (PEO)-based densely cross-linked polymers, focusing on structural properties as well as the systems’ dynamics in the presence of lithium salt. Motivated by experimental findings for networks with short PEO strands, we employ a combination of LiTFSI (lithium bis(trifluoromethanesulfonyl)imide) and LiDFOB (lithium difluoro(oxalato)borate). Recently, it has been shown that such multisalt systems outperform classical single-salt systems [Shaji, I. Energy Storage Mater.2022, 44, 263−277]. To analyze the microscopic scenario, we employ an analytical model, originally developed for non-cross-linked polymer electrolytes or blends [Maitra, A. Phys. Rev. Lett.2007, 98, 227802 and Diddens, D. J. Electrochem. Soc.2017, 164, E3225–E3231]. Excluding very short PEO strands, the local dynamics is only slightly restricted compared to linear PEO and is not significantly dependent on the network structure. The transfer of lithium ions between PEO chains and the motion along the polymer backbone may be controlled through the employed salt.
001019406 536__ $$0G:(DE-HGF)POF4-1221$$a1221 - Fundamentals and Materials (POF4-122)$$cPOF4-122$$fPOF IV$$x0
001019406 588__ $$aDataset connected to CrossRef, Journals: juser.fz-juelich.de
001019406 7001_ $$0P:(DE-Juel1)176646$$aHeuer, Andreas$$b1$$ufzj
001019406 7001_ $$0P:(DE-Juel1)169877$$aDiddens, Diddo$$b2
001019406 773__ $$0PERI:(DE-600)1491942-4$$a10.1021/acs.macromol.2c01795$$gVol. 55, no. 22, p. 10229 - 10242$$n22$$p10229 - 10242$$tMacromolecules$$v55$$x0024-9297$$y2022
001019406 8564_ $$uhttps://juser.fz-juelich.de/record/1019406/files/2208.13450.pdf$$yOpenAccess
001019406 8564_ $$uhttps://juser.fz-juelich.de/record/1019406/files/2208.13450.gif?subformat=icon$$xicon$$yOpenAccess
001019406 8564_ $$uhttps://juser.fz-juelich.de/record/1019406/files/2208.13450.jpg?subformat=icon-1440$$xicon-1440$$yOpenAccess
001019406 8564_ $$uhttps://juser.fz-juelich.de/record/1019406/files/2208.13450.jpg?subformat=icon-180$$xicon-180$$yOpenAccess
001019406 8564_ $$uhttps://juser.fz-juelich.de/record/1019406/files/2208.13450.jpg?subformat=icon-640$$xicon-640$$yOpenAccess
001019406 909CO $$ooai:juser.fz-juelich.de:1019406$$pdnbdelivery$$pdriver$$pVDB$$popen_access$$popenaire
001019406 9101_ $$0I:(DE-HGF)0$$60000-0002-3903-1504$$aExternal Institute$$b0$$kExtern
001019406 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)176646$$aForschungszentrum Jülich$$b1$$kFZJ
001019406 9101_ $$0I:(DE-588b)5008462-8$$6P:(DE-Juel1)169877$$aForschungszentrum Jülich$$b2$$kFZJ
001019406 9131_ $$0G:(DE-HGF)POF4-122$$1G:(DE-HGF)POF4-120$$2G:(DE-HGF)POF4-100$$3G:(DE-HGF)POF4$$4G:(DE-HGF)POF$$9G:(DE-HGF)POF4-1221$$aDE-HGF$$bForschungsbereich Energie$$lMaterialien und Technologien für die Energiewende (MTET)$$vElektrochemische Energiespeicherung$$x0
001019406 9141_ $$y2023
001019406 915__ $$0StatID:(DE-HGF)0510$$2StatID$$aOpenAccess
001019406 915__ $$0StatID:(DE-HGF)0420$$2StatID$$aNationallizenz$$d2023-10-21$$wger
001019406 915__ $$0StatID:(DE-HGF)0200$$2StatID$$aDBCoverage$$bSCOPUS$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0300$$2StatID$$aDBCoverage$$bMedline$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0199$$2StatID$$aDBCoverage$$bClarivate Analytics Master Journal List$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0113$$2StatID$$aWoS$$bScience Citation Index Expanded$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0150$$2StatID$$aDBCoverage$$bWeb of Science Core Collection$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)1200$$2StatID$$aDBCoverage$$bChemical Reactions$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0160$$2StatID$$aDBCoverage$$bEssential Science Indicators$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)1150$$2StatID$$aDBCoverage$$bCurrent Contents - Physical, Chemical and Earth Sciences$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0100$$2StatID$$aJCR$$bMACROMOLECULES : 2022$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0600$$2StatID$$aDBCoverage$$bEbsco Academic Search$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)0030$$2StatID$$aPeer Review$$bASC$$d2023-10-21
001019406 915__ $$0StatID:(DE-HGF)9905$$2StatID$$aIF >= 5$$bMACROMOLECULES : 2022$$d2023-10-21
001019406 9201_ $$0I:(DE-Juel1)IEK-12-20141217$$kIEK-12$$lHelmholtz-Institut Münster Ionenleiter für Energiespeicher$$x0
001019406 9801_ $$aFullTexts
001019406 980__ $$ajournal
001019406 980__ $$aVDB
001019406 980__ $$aI:(DE-Juel1)IEK-12-20141217
001019406 980__ $$aUNRESTRICTED
001019406 981__ $$aI:(DE-Juel1)IMD-4-20141217