The manuscript describes the phase composition, microstructure, some physical and mechanical properties of the Ti-Al system with addition of 2 at. % Dy (TAD) and Ho (TAH) obtained by "hydride technology". Phase diagrams for Ti-Al-Dy and Ti-Al-Ho at a temperature of 1150 °C and basic properties for ternary phases Dy₆Ti₄Al₄₃ and Ho₆Ti₄Al₄₃ were calculated. A crystallographic database of stable and quasistable structures of the known elemental composition was created in the USPEX-SIESTA software by means of an evolutionary code. The calculations show that adding REM leads to a significant stabilizing effect in each Ti-Al-Me (Me = Dy, Ho) system without exception. It has been established that the lattice energies of AlTiHo and AlTiDy are, respectively, equal to: EAlTiDy = -32,877.825 eV and EAlTiDy = -31,227.561 eV. In the synthesized TiAlHo compound, the main phases include Al-Ti, AlTi and AlTiHo and the contributions to the theoretical intensity are equal to 44.83, 44.43 and 5.55%, respectively. TiAlDy is dominated by the Al-Ti, AlTi and AlTiDy phases, whose contributions are equal to 65.04, 16.88 and 11.2%, respectively. The microhardness of TAD and TAN specimens is 1.61 ± 0.08 and 1.47 ± 0.07 GPa, respectively.
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http://dx.doi.org/10.3390/ma15238584 | DOI Listing |
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Shanxi Jiangyang Chemical Limited Company, Taiyuan, 030041, Shanxi, China.
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View Article and Find Full Text PDFNat Commun
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WA School of Mines: Minerals, Energy and Chemical Engineering (WASM-MECE), Curtin University, Perth, WA, 6102, Australia.
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