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First coordination shell of Co atoms around (a) P and (b) Li in the olivine structure. Tables showing (c) the 12 P and (d) 12 Li sites generated in the (a × 3b × c) supercell of the olivine structure, and their nearest Co atoms. The Co atoms shaded in red and white represent Co3+ and Co2+, respectively, generating three P and two Li local environments in the Co2+/Co3+ arrangement shown here.
