Электронная библиотека (репозиторий) Томского государственного университета
точечные дефекты | Bakulin, Alexander V.

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Add   Atomic self-diffusion in TiNi
Authors: Bakulin, Alexander V. | Spiridonova, T. I. | Kulkova, Svetlana E.
Source: Computational materials science. 2018. Vol. 148. P. 1-9
Type: статьи в журналах
Date: 2018
Description: The projector augmented wave method was applied to investigate the energetics of point defect formation at finite temperatures and the Ni-vacancy jumps in the intermetallic B2-TiNi alloy. It was shown ... More
Add   Point defects in TiNi from ab-initio calculations
Authors: Kulkova, Svetlana E. | Hu, Q. M. | Yang, Rui | Bakulin, Alexander V.
Source: Materials today: proceedings. 2015. Vol. 2, Supplement 3. P. S615-S618
Type: статьи в журналах
Date: 2015
Description: Ab initio calculations of the electronic structure and elastic properties of TiNi-based alloys were performed within density functional theory. The influence of impurities (transition, noble and simpl ... More
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