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The influence of Cl doping on the structural, electronic properties and Li-ion migration of LiFePO4: A DFT study

Nader Zaki, Shahrul Izwan Ahmad, Fatin Nabilah Sazman, Fadhlul Wafi Badrudin, Abqari Luthfi Albert Abdullah, Mohamad Fariz Mohamad Taib, Oskar Hasdinor Hassan, Muhd Zu Azhan Yahya

2023Computational and Theoretical Chemistry25 citationsDOI

Topics & Concepts

ChemistryDensity functional theoryDopingIonElectrochemistryLithium (medication)Ionic radiusBand gapConductivityInorganic chemistryChemical physicsAnalytical Chemistry (journal)Physical chemistryComputational chemistryElectrodeMaterials scienceOptoelectronicsOrganic chemistryEndocrinologyMedicineAdvancements in Battery MaterialsAdvanced Battery Materials and TechnologiesAdvanced Battery Technologies Research
The influence of Cl doping on the structural, electronic properties and Li-ion migration of LiFePO4: A DFT study | Litcius