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  Quantitative three-dimensional imaging of chemical short-range order via machine learning enhanced atom probe tomography

Li, Y., Wei, Y., Wang, Z., Liu, X., Colnaghi, T., Han, L., et al. (2023). Quantitative three-dimensional imaging of chemical short-range order via machine learning enhanced atom probe tomography. Nature Communications, 14(1): 7410. doi:10.1038/s41467-023-43314-y.

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 Creators:
Li, Yue, Author
Wei, Ye, Author
Wang, Zhangwei, Author
Liu, Xiaochun, Author
Colnaghi, Timoteo1, Author           
Han, Liuliu, Author
Rao, Ziyuan, Author
Zhou, Xuyang, Author
Huber, Liam, Author
Dsouza, Raynol, Author
Gong, Yilun, Author
Neugebauer, Jörg, Author
Marek, Andreas1, Author           
Rampp, Markus1, Author           
Bauer, Stefan, Author
Li, Hongxiang, Author
Baker, Ian, Author
Gault, Leigh T. Stephenson Baptiste, Author
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1Max Planck Computing and Data Facility, Max Planck Society, ou_2364734              

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 Abstract: Chemical short-range order (CSRO) refers to atoms of specific elements self-organising within a disordered crystalline matrix to form particular atomic neighbourhoods. CSRO is typically characterized indirectly, using volume-averaged or through projection microscopy techniques that fail to capture the three-dimensional atomistic architectures. Here, we present a machine-learning enhanced approach to break the inherent resolution limits of atom probe tomography enabling three-dimensional imaging of multiple CSROs. We showcase our approach by addressing a long-standing question encountered in body-centred-cubic Fe-Al alloys that see anomalous property changes upon heat treatment. We use it to evidence non-statistical B2-CSRO instead of the generally-expected D03-CSRO. We introduce quantitative correlations among annealing temperature, CSRO, and nano-hardness and electrical resistivity. Our approach is further validated on modified D03-CSRO detected in Fe-Ga. The proposed strategy can be generally employed to investigate short/medium/long-range ordering phenomena in different materials and help design future high-performance materials.

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Language(s): eng - English
 Dates: 2023-11-16
 Publication Status: Published online
 Pages: -
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 Table of Contents: -
 Rev. Type: Peer
 Identifiers: DOI: 10.1038/s41467-023-43314-y
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Title: Nature Communications
  Abbreviation : Nat. Commun.
Source Genre: Journal
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Publ. Info: London : Nature Publishing Group
Pages: - Volume / Issue: 14 (1) Sequence Number: 7410 Start / End Page: - Identifier: ISSN: 2041-1723
CoNE: https://pure.mpg.de/cone/journals/resource/2041-1723