Shear band mediated ω phase transformation in Nb single crystals deformed at 77 K
Phase transformation is rare in pure body-centered cubic (BCC) metals due to the associated high energy barrier. Here, omega (ω) phase transformation in single-crystal niobium (Nb) under compression at 77 K was studied by atomistic characterization and density functional theory (DFT) calculation. Th...
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Autores principales: | , , , , , |
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Formato: | article |
Lenguaje: | EN |
Publicado: |
Taylor & Francis Group
2021
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Materias: | |
Acceso en línea: | https://doaj.org/article/0888df5347ad435290a741dc4c669f1e |
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Sumario: | Phase transformation is rare in pure body-centered cubic (BCC) metals due to the associated high energy barrier. Here, omega (ω) phase transformation in single-crystal niobium (Nb) under compression at 77 K was studied by atomistic characterization and density functional theory (DFT) calculation. The ω phases were found to nucleate preferentially at the boundaries of 112 shear bands, via a sequence of BCC-to-ω structural transformation induced by shear stress. Theoretically, calculations reveal that the formation of a shear transition region can reduce the energy barrier of BCC-to-ω phase transformation. These findings provide insights into the phase transformation involved in the cryogenic deformation of bulk BCC metals. |
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