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Substantial role of charge transfer on the diffusion mechanism of interstitial elements in α-titanium: A First-principles study

Kazuki Shitara, Masato Yoshiya, Junko Umeda, Katsuyoshi Kondoh

2021Scripta Materialia18 citationsDOI

Topics & Concepts

DiffusionMaterials scienceCharge (physics)TitaniumOctahedronChemical physicsInterstitial defectAtomic diffusionAtomic physicsCrystallographyThermodynamicsChemistryMetallurgyCrystal structurePhysicsDopingOptoelectronicsQuantum mechanicsTitanium Alloys Microstructure and PropertiesNuclear Materials and PropertiesIntermetallics and Advanced Alloy Properties
Substantial role of charge transfer on the diffusion mechanism of interstitial elements in α-titanium: A First-principles study | Litcius