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    • Metastable Intermediate in LixMnO₂ Layered to Spinel Phase Transition 

      Reed, John; Ceder, Gerbrand; Van Der Ven, A. (2002-01)
      Ab Initio calculations suggest that partially lithiated layered LixMnO₂ transforms to spinel in a two-stage process. In the first stage, a significant fraction of the Mn and Li ions rapidly occupy tetrahedral sites, forming ...