The coupling between stability and ion pair formation in magnesium electrolytes from first-principles quantum mechanics and classical molecular dynamics

  • Nav Nidhi Rajput
  • , Xiaohui Qu
  • , Niya Sa
  • , Anthony K. Burrell
  • , Kristin A. Persson

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Pages (from-to)3411-3420
Number of pages10
JournalJournal of the American Chemical Society
Volume137
Issue number9
DOIs
StatePublished - Feb 2015

ASJC Scopus Subject Areas

  • Catalysis
  • General Chemistry
  • Biochemistry
  • Colloid and Surface Chemistry

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