The assisting and stabilizing role played by ω phase during the {112} <111>β twinning in Ti-Mo alloys:A first-principles insight

• 作者: Qiu-Jie Chen Shang-Yi Ma Shao-Qing Wang
• 来源期刊: 材料科学技术（英文版）
• 年，卷（期）: 2021,（21）
• 页码范围: 163-170
• 页数: 8页
• 语种: 英文

摘要

The ω phase is commonly observed in β-Ti alloys and plays a significant role on various properties of β-Ti alloys.Although many results about the role ofω phase on mechanical properties of β-Ti alloys have been derived from theoretical and experimental studies,the role ofω phase on deformation mechanism hitherto remains elusive and deserves to be further studied.In this work,the role played by ω phase during the {112 } <111>β twinning in Ti-Mo alloys were investigated by first-principles calculations at atomic scale.In the energy favorable interface of(112)β/(10(1)0)ω,we found that partial dislocations slipping on the successive (10(1)0)ω planes ofω phase can lead to the formation of { 112} <111>β twin nucleus.And the twin nucleus grows inwards ω grain interior through atomic shuffle.Thus,a new twinning mechanism of {112 } <111>β assisted by ω phase was proposed.Furthermore,our calculations indicated that the Pearance of ITB (interfacial twin boundary) ω phase can improve the stability of the symmetrical 12 } <111 >β twin boundary (TB),which can well explain the experimental phenomenon that the ITB ω phase always accompanies the formation of {112 } <111>β twin.Finally,a probable microstructure evolution sequence was suggested,namely β matrix → β matrix + athermal ω phase → (112)[11(1)]twin → (112)[11(1)]β twin + ITB ω phase.Our calculations provide new insights on the role played by ω phase during the twinning process of {112} <111>β,which can deepen the understanding on the deformation behaviors of β-Ti alloys.