Ab Initio Study of AMBO<sub>3</sub> (A = Li, Na and M = Mn, Fe, Co, Ni) as Cathode Materials for Li-Ion and Na-Ion Batteries
Mohammad Mahdi Kalantarian, Mahziar Hafizi-Barjini, Massoud Momeni
Abstract
are the best to the worst considered cathode materials.
Topics & Concepts
CathodeIntercalation (chemistry)Density functional theoryIonMaterials scienceTransition metalConductivityAb initioElectrical resistivity and conductivityStructural stabilityAnalytical Chemistry (journal)Inorganic chemistryChemistryPhysical chemistryComputational chemistryEngineeringOrganic chemistryChromatographyElectrical engineeringStructural engineeringCatalysisBiochemistryAdvancements in Battery MaterialsAdvanced Battery Materials and TechnologiesExtraction and Separation Processes