Litcius/Paper detail

Understanding the lithiation mechanisms of pyrenetetrone-based carbonyl compound as cathode material for lithium-ion battery: Insight from first principle density functional theory

Hitler Louis, Terkumbur E. Gber, Fredrick C. Asogwa, Ededet A. Eno, Tomsmith O. Unimuke, Victoria M. Bassey, Benedict I. Ita

2021Materials Chemistry and Physics112 citationsDOI

Topics & Concepts

Density functional theoryElectrochemistryLithium (medication)HOMO/LUMOReactivity (psychology)Battery (electricity)ChemistryMoleculeIonComputational chemistryBasis setCathodeLithium-ion batteryTopology (electrical circuits)Chemical physicsPhysical chemistryElectrodeOrganic chemistryThermodynamicsPhysicsMathematicsMedicineCombinatoricsPower (physics)PathologyAlternative medicineEndocrinologyAdvancements in Battery MaterialsAdvanced Battery Materials and TechnologiesAdvanced Battery Technologies Research
Understanding the lithiation mechanisms of pyrenetetrone-based carbonyl compound as cathode material for lithium-ion battery: Insight from first principle density functional theory | Litcius