Theoretical study about alkali metal adsorption on pristine and defective (8,0) SWCNT: Geometrical, magnetic and electronic changes
Francisco Gaztañaga, Mario G. Sandoval, C. Romina Luna, P. Jasen
Topics & Concepts
ElectronegativityAdsorptionCarbon nanotubeMaterials scienceDensity functional theoryMagnetic momentMagnetismWork functionVacancy defectChemical physicsAlkali metalElectronic structureSpintronicsMetalNanotechnologyComputational chemistryCondensed matter physicsFerromagnetismPhysical chemistryChemistryCrystallographyOrganic chemistryPhysicsMetallurgyCarbon Nanotubes in CompositesGraphene research and applicationsAdvancements in Battery Materials