Nanotwinned alloys under high pressure

Nanotwinned alloys are of interest due to their high strength and ductility, but twin boundaries may not be stable under shear. Computational studies indicate that high hydrostatic pressure may suppress detwinning mechanisms. Here, we investigate the microstructural changes of nanotwinned-nanocrysta...

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Main Authors: Wang, Melody M., Dang, Ruoqi, Parakh, Abhinav, Lee, Andrew C., Li, Zhi, Chariton, Stella, Prakapenka, Vitali B., Kang, Jiyun, Zhang, Yong-Wei, Hodge, Andrea M., Gao, Huajian, Gu, X. Wendy
Other Authors: School of Mechanical and Aerospace Engineering
Format: Article
Language:English
Published: 2025
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Online Access:https://hdl.handle.net/10356/182333
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Institution: Nanyang Technological University
Language: English
id sg-ntu-dr.10356-182333
record_format dspace
institution Nanyang Technological University
building NTU Library
continent Asia
country Singapore
Singapore
content_provider NTU Library
collection DR-NTU
language English
topic Engineering
Nanotwins
Grain boundaries
spellingShingle Engineering
Nanotwins
Grain boundaries
Wang, Melody M.
Dang, Ruoqi
Parakh, Abhinav
Lee, Andrew C.
Li, Zhi
Chariton, Stella
Prakapenka, Vitali B.
Kang, Jiyun
Zhang, Yong-Wei
Hodge, Andrea M.
Gao, Huajian
Gu, X. Wendy
Nanotwinned alloys under high pressure
description Nanotwinned alloys are of interest due to their high strength and ductility, but twin boundaries may not be stable under shear. Computational studies indicate that high hydrostatic pressure may suppress detwinning mechanisms. Here, we investigate the microstructural changes of nanotwinned-nanocrystalline copper-nickel and Inconel 725 alloys under quasi-hydrostatic pressures up to 50 gigapascals (GPa). The alloys are compressed in a diamond anvil cell. In-situ x-ray diffraction (XRD) and ex-situ transmission electron microscopy (TEM) were employed to monitor microstructural changes. Twin boundary deformation and grain growth occur at 11.4 GPa quasi-hydrostatic pressure in the copper-nickel alloy. Molecular dynamics (MD) simulations reveal that hydrostatic pressure causes elevated local shear stress at grain boundaries, which leads to atomic rearrangements. A superposition of hydrostatic and deviatoric pressures lead to partial dislocation mediated twin boundary migration. In contrast, the Inconel 725 alloy showed stable twin and grain boundaries up to a quasi-hydrostatic pressure of 12.7 GPa. Texture, high solid solution strengthening, and low stacking fault energy are hypothesized to the enhanced microstructural stability in Inconel 725.
author2 School of Mechanical and Aerospace Engineering
author_facet School of Mechanical and Aerospace Engineering
Wang, Melody M.
Dang, Ruoqi
Parakh, Abhinav
Lee, Andrew C.
Li, Zhi
Chariton, Stella
Prakapenka, Vitali B.
Kang, Jiyun
Zhang, Yong-Wei
Hodge, Andrea M.
Gao, Huajian
Gu, X. Wendy
format Article
author Wang, Melody M.
Dang, Ruoqi
Parakh, Abhinav
Lee, Andrew C.
Li, Zhi
Chariton, Stella
Prakapenka, Vitali B.
Kang, Jiyun
Zhang, Yong-Wei
Hodge, Andrea M.
Gao, Huajian
Gu, X. Wendy
author_sort Wang, Melody M.
title Nanotwinned alloys under high pressure
title_short Nanotwinned alloys under high pressure
title_full Nanotwinned alloys under high pressure
title_fullStr Nanotwinned alloys under high pressure
title_full_unstemmed Nanotwinned alloys under high pressure
title_sort nanotwinned alloys under high pressure
publishDate 2025
url https://hdl.handle.net/10356/182333
_version_ 1823108700112420864
spelling sg-ntu-dr.10356-1823332025-01-22T02:56:58Z Nanotwinned alloys under high pressure Wang, Melody M. Dang, Ruoqi Parakh, Abhinav Lee, Andrew C. Li, Zhi Chariton, Stella Prakapenka, Vitali B. Kang, Jiyun Zhang, Yong-Wei Hodge, Andrea M. Gao, Huajian Gu, X. Wendy School of Mechanical and Aerospace Engineering Institute of High Performance Computing, A*STAR Engineering Nanotwins Grain boundaries Nanotwinned alloys are of interest due to their high strength and ductility, but twin boundaries may not be stable under shear. Computational studies indicate that high hydrostatic pressure may suppress detwinning mechanisms. Here, we investigate the microstructural changes of nanotwinned-nanocrystalline copper-nickel and Inconel 725 alloys under quasi-hydrostatic pressures up to 50 gigapascals (GPa). The alloys are compressed in a diamond anvil cell. In-situ x-ray diffraction (XRD) and ex-situ transmission electron microscopy (TEM) were employed to monitor microstructural changes. Twin boundary deformation and grain growth occur at 11.4 GPa quasi-hydrostatic pressure in the copper-nickel alloy. Molecular dynamics (MD) simulations reveal that hydrostatic pressure causes elevated local shear stress at grain boundaries, which leads to atomic rearrangements. A superposition of hydrostatic and deviatoric pressures lead to partial dislocation mediated twin boundary migration. In contrast, the Inconel 725 alloy showed stable twin and grain boundaries up to a quasi-hydrostatic pressure of 12.7 GPa. Texture, high solid solution strengthening, and low stacking fault energy are hypothesized to the enhanced microstructural stability in Inconel 725. Agency for Science, Technology and Research (A*STAR) National Supercomputing Centre (NSCC) Singapore MMW is supported by the National Science Foundation Graduate Research Fellowship under Grant No. DGE-1656518. MMW and AP were supported by the grant DE-SC0021075 funded by the U.S. Department of Energy, Office of Science. XWG and AP acknowledge financial support from the Army Research Office under grant number W911NF2020171. RD acknowledges the support of the A*STAR Merit Award fellowship under grant SING-2021–02–0258 and computing resources provided by the Singapore National Supercomputing Center (NSCC) under project #12003590. Part of this work was performed at the Stanford Nano Shared Facilities (SNSF)/Stanford Nanofabrication Facility (SNF), supported by the National Science Foundation under award ECCS-2026822. Part of this work was performed at GeoSoilEnviroCARS (The University of Chicago, Sector 13), Advanced Photon Source (APS), Argonne National Laboratory. GeoSoilEnviroCARS is supported by the National Science Foundation – Earth Sciences (EAR – 1634415) and Department of Energy-GeoSciences (DE-FG02–94ER14466). This work used resources of the Advanced Photon Source, a U.S. Department of Energy (DOE) Office of Science User Facility operated for the DOE Office of Science by Argonne National Laboratory under Contract No DEAC02–06CH11357. Use of the COMPRES-GSECARS gas loading system was supported by COMPRES under NSF Cooperative Agreement EAR − 1606856 and by GSECARS through NSF grant EAR-1634415 and DOE grant DE-FG02- 94ER14466. Y-WZ is supported by Singapore MTC Programmatic Project (M22L2b0111). AMH was supported by the National Science Foundation (Grant Numbers: DMR-2227178). AP is currently affiliated with the Lawrence Livermore National Laboratory. Lawrence Livermore National Laboratory is operated by Lawrence Livermore National Security, LLC, for the U.S. Department of Energy, National Nuclear Security Administration under Contract DEAC52–07NA27344. LLNL IM release number - LLNL-JRNL-863235. 2025-01-22T02:56:58Z 2025-01-22T02:56:58Z 2025 Journal Article Wang, M. M., Dang, R., Parakh, A., Lee, A. C., Li, Z., Chariton, S., Prakapenka, V. B., Kang, J., Zhang, Y., Hodge, A. M., Gao, H. & Gu, X. W. (2025). Nanotwinned alloys under high pressure. Acta Materialia, 285, 120654-. https://dx.doi.org/10.1016/j.actamat.2024.120654 1359-6454 https://hdl.handle.net/10356/182333 10.1016/j.actamat.2024.120654 2-s2.0-85212405241 285 120654 en SING-2021–02–0258 12003590 Acta Materialia © 2024 Acta Materialia Inc. Published by Elsevier Ltd. All rights are reserved, including those for text and data mining, AI training, and similar technologies.