Vinylene carbonate reactivity at lithium metal surface: first-principles insights into the early steps of SEI formation
Francesca Fasulo, Ana B. Muñoz‐García, Arianna Massaro, Orlando Crescenzi, Chen Huang, Michele Pavone
Abstract
Density Functional Embedding Theory (DFET) unveils the mechanism of Vinylene Carbonate (VC) degradation at the Li metal surface.
Topics & Concepts
Lithium carbonateCarbonateReactivity (psychology)Lithium (medication)MetalLithium metalMaterials scienceChemistryMetallurgyOrganic chemistryPhysical chemistryIonPsychologyIonic bondingElectrolytePathologyMedicinePsychiatryElectrodeAlternative medicineAdvanced Battery Materials and TechnologiesAdvancements in Battery MaterialsChemical Synthesis and Characterization