Transformations of the Microstructure and Phase Compositions of Titanium Alloys during Ultrasonic Impact Treatment Part II: Ti-6Al-4V Titanium Alloy

Abstract

Experimental and theoretical studies enabled the reveal of patterns of the microstructure formation in the surface layer of Ti-6Al-4V titanium alloy subjected to ultrasonic impact treatment. The mixed amorphous and nanocrystalline structure of the 200 nm thick uppermost surface layer of titanium dioxide TiO2 was demonstrated using transmission electron microscopy. The 5 µm thick intermediate layer containing nanocrystalline α grains, and the 50–60 µm thick lower layer containing fragmented α-Ti grains with retained β phase were also observed. The refinement of the β-Ti phase during ultrasonic impact treatment was accompanied by the formation of the orthorhombic (α″) martensitic phase. Molecular dynamics simulation of strains of a vanadium-doped titanium crystallite subjected to ultrasonic impact treatment revealed the formation of striped dislocation substructures as well as the development of reversible β→α phase transformations. Ab initio calculations of the atomic structure of V-doped Ti crystallites containing α, β or α″ phases of titanium were carried out. On the basis of the results of the experimental observations, a molecular dynamics simulation and ab initio calculations a mechanism was proposed, which associated the development of the strain-induced β→α″ phase transformations in Ti-6Al-4V alloy with the presence of oxygen. The role of the electronic subsystem in the development of the strain-induced phase transformations was discussed.

Keywords

• titanium alloy
• phase transformation
• electronic structure
• microstructure
• molecular dynamics
• ab-initio calculation