Tuning the mechanical and electronic properties and carrier mobility of phosphorene <i>via</i> family atom doping: a first-principles study
Yan Xu, Guipeng Liu, Shu’an Xing, Guijuan Zhao, Jianhong Yang
Abstract
Formation energy and cohesive energy are used to evaluate the thermodynamic stability of substitutionally doped phosphorene.
Topics & Concepts
PhosphoreneMaterials scienceDopingAtom (system on chip)Electron mobilityChemical physicsBinding energyCondensed matter physicsBand gapOptoelectronicsAtomic physicsPhysicsEmbedded systemComputer science2D Materials and ApplicationsMXene and MAX Phase MaterialsMachine Learning in Materials Science