First-principles calculations on adsorption-diffusion behavior of Boron atom with tungsten surface
Chao Lü, Jian Yang, Xuanwei Lei, Jihua Huang, Zheng Ye, Shuhai Chen, Yüe Zhao
Topics & Concepts
Atom (system on chip)TungstenAdsorptionDiffusionChemistryBoronOctahedronSurface diffusionDensity functional theoryMaterials scienceCrystallographyComputational chemistryPhysical chemistryThermodynamicsCrystal structurePhysicsOrganic chemistryComputer scienceEmbedded systemBoron and Carbon Nanomaterials ResearchNuclear Materials and PropertiesFusion materials and technologies