Effect of Mn, N co-doped LiFePO4 on electrochemical and mechanical properties: A DFT study

Shucheng Wang, Fazhan Wang, Fazhan Wang

2023Journal of Molecular Graphics and Modelling32 citationsDOI

Topics & Concepts

Materials scienceDopingLithium (medication)SemiconductorDensity functional theoryDiffusionIonBand gapThermodynamicsChemistryComputational chemistryOptoelectronicsOrganic chemistryMedicineEndocrinologyPhysicsAdvancements in Battery MaterialsAdvanced Battery Materials and TechnologiesAdvanced Battery Technologies Research