Theoretical investigation of synergistically boosting the anchoring and electrochemical performance of lithiophilic/sulfiphilic transition metal carbides for lithium–sulfur batteries
Mingyang Wang, Jianjun Mao, Yudong Pang, Xilin Zhang, Zongxian Yang, Zhansheng Lu, Shuting Yang
Abstract
S decomposition which facilitates accelerating electrode kinetics and elevating utilization of sulfur. Our results offer a systematic approach to designing and screening non-polar materials for high-performance Li-S batteries, based on the rational electronic structure and lattice match strategy.
Topics & Concepts
Materials scienceAnchoringBoosting (machine learning)ElectrochemistryCarbideTransition metalMetalNanotechnologyLithium metalLithium (medication)Chemical engineeringComposite materialChemistryMetallurgyElectrolyteElectrodeComputer scienceCatalysisBiologyPhysical chemistryOrganic chemistryEngineeringEndocrinologyMachine learningStructural engineeringAdvancements in Battery MaterialsAdvanced Battery Materials and TechnologiesMXene and MAX Phase Materials