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  • Flores, Eibar,1990Chalmers tekniska högskola,Chalmers University of Technology (author)

Solvation structure in dilute to highly concentrated electrolytes for lithium-ion and sodium-ion batteries

  • Article/chapterEnglish2017

Publisher, publication year, extent ...

  • Elsevier BV,2017
  • electronicrdacarrier

Numbers

  • LIBRIS-ID:oai:research.chalmers.se:7b3e70a2-9ce4-41c1-92ba-7083c8b262c4
  • https://doi.org/10.1016/j.electacta.2017.03.031DOI
  • https://research.chalmers.se/publication/249138URI

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  • Language:English
  • Summary in:English

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  • Subject category:art swepub-publicationtype
  • Subject category:ref swepub-contenttype

Notes

  • The solvation structure of several lithium and sodium based electrolytes are explored as a function of salt concentration over a wide range via a detailed PM7 computational study. The cation coordination shells are found to be well-defined and solvent rich for dilute electrolytes, while disordered and anion rich for the more concentrated electrolytes. The Na-based electrolytes display larger cation coordination shells with a more pronounced presence of fluorine as compared to the Li-based electrolytes. The origins of the structural differences are discussed as well as their consequences for properties of battery electrolytes and battery usage-especially targeting the current large interest in highly concentrated electrolytes.

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Added entries (persons, corporate bodies, meetings, titles ...)

  • Åvall, Gustav,1988Chalmers tekniska högskola,Chalmers University of Technology(Swepub:cth)avall (author)
  • Jeschke, Steffen,1986Chalmers tekniska högskola,Chalmers University of Technology(Swepub:cth)jeschke (author)
  • Johansson, Patrik,1969Chalmers tekniska högskola,Chalmers University of Technology(Swepub:cth)jpatrik (author)
  • Chalmers tekniska högskola (creator_code:org_t)

Related titles

  • In:Electrochimica Acta: Elsevier BV233, s. 134-1410013-4686

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