Revealing the distinct electrochemical properties of TiSe2 monolayer and bulk counterpart in Li-ion batteries by first-principles calculations
Chunyu Zhao, Dashuai Wang, Ruqian Lian, Dongxiao Kan, Yaying Dou, Chunzhong Wang, Gang Chen, Yingjin Wei
Topics & Concepts
MonolayerElectrochemistryIntercalation (chemistry)Lithium (medication)Density functional theoryAnodeRedoxIonMaterials scienceDiffusionChemical physicsTransition metalChemistryInorganic chemistryElectrodePhysical chemistryNanotechnologyComputational chemistryThermodynamicsCatalysisOrganic chemistryMedicinePhysicsEndocrinologyAdvancements in Battery Materials2D Materials and ApplicationsMXene and MAX Phase Materials