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Asta, M.
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Asta, M.
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Modeling antiphase boundary energies of Ni3Al-based alloys using automated density functional theory and machine learning
by
Asta
,
M
.
,
Chen, E.
,
Epler, M.E
,
Frolov, T.
,
Tamm, A.
,
Wang, T.
Published 2022
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Related Subjects
Alloy compositions
Alloy designs
Antiphase boundaries
Antiphase boundary energies
Computation theory
Computational workflows
Density functional theory
Density-functional-theory
Machine learning
Machine learning models
Materials properties
Ni-based superalloys
Nickel alloys
Nickel compounds
Planar defect
Superalloys
Tuning parameter
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