First principles insights into stability of defected MXenes in water
Haohong Song, De‐en Jiang
Abstract
with an O vacancy where a water molecule dissociates and refills the vacancy. These findings enrich our understanding of water interaction with defects on the MXene surfaces.
Topics & Concepts
Vacancy defectMXenesChemical physicsMaterials scienceMoleculeHydroniumAqueous solutionChemical stabilityHydroxideCrystallographyNanotechnologyChemistryPhysical chemistryInorganic chemistryOrganic chemistryMXene and MAX Phase MaterialsAdvanced Memory and Neural ComputingNanomaterials for catalytic reactions