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- W1970778865 abstract "We present a first-principles investigation of the crystal and electronic structure as well as the average insertion voltage of the Li-site (by Na and Cr) and metal-site (by isovalent Ni, Zn, Ca, Mg and Mn and aliovalent Cu, Al, In, Mo and Zr) doped LiCoPO4. The results show that both the Li-site doping and metal-site doping may reduce the volume change of the material during Li extraction/reinsertion process. The metal doped at Li-site will block the path of Li ion diffusion. The doping by aliovalent transition metals will introduce defect levels in the energy band. It could influence the conductivity insertion voltage." @default.
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- W1970778865 date "2009-02-23" @default.
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- W1970778865 title "Li- Site and Metal-Site Ion Doping in Phosphate-Olivine LiCoPO 4 by First-Principles Calculation" @default.
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- W1970778865 doi "https://doi.org/10.1088/0256-307x/26/3/038202" @default.
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