First-principles calculations find that fluorine doping lowers lithium and carbon vacancy formation energies in Li2CO3 and lithium vacancy energy in Li2O2.
Journal of Physics and Chemistry of Solids 1998, 59 (3), 363 –376
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Intrinsic Defect Energetics and Fluorine Doping Effects in Li2CO3 and Li2O2: A First-Principles Study
First-principles calculations find that fluorine doping lowers lithium and carbon vacancy formation energies in Li2CO3 and lithium vacancy energy in Li2O2.