Computational high entropy alloy design

Materials scientists are developing new materials to meet increasing demands by employing a systematic approach linking material performance to composition, processing, and microstructure. Computational techniques, such as Calculation of Phase Diagrams and Integrated Computational Materials Engineer...

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Main Authors: Simelane Khombisile, Becker Thorsten Hermann
Format: Article
Language:English
Published: EDP Sciences 2024-01-01
Series:MATEC Web of Conferences
Online Access:https://www.matec-conferences.org/articles/matecconf/pdf/2024/18/matecconf_rapdasa2024_03008.pdf
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author Simelane Khombisile
Becker Thorsten Hermann
author_facet Simelane Khombisile
Becker Thorsten Hermann
author_sort Simelane Khombisile
collection DOAJ
description Materials scientists are developing new materials to meet increasing demands by employing a systematic approach linking material performance to composition, processing, and microstructure. Computational techniques, such as Calculation of Phase Diagrams and Integrated Computational Materials Engineering, play a crucial role in this process, enabling fast and efficient material design. This study focuses on developing a high damage-tolerant high entropy alloy for hydrogen service, using the two computational techniques to identify optimal composition, predict mechanical properties, and elucidate strengthening mechanisms.
format Article
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institution OA Journals
issn 2261-236X
language English
publishDate 2024-01-01
publisher EDP Sciences
record_format Article
series MATEC Web of Conferences
spelling doaj-art-32d20bb73e074e0b82a8e7651055cbbf2025-08-20T01:58:49ZengEDP SciencesMATEC Web of Conferences2261-236X2024-01-014060300810.1051/matecconf/202440603008matecconf_rapdasa2024_03008Computational high entropy alloy designSimelane Khombisile0Becker Thorsten Hermann1Centre for Materials Engineering, University of Cape TownCentre for Materials Engineering, University of Cape TownMaterials scientists are developing new materials to meet increasing demands by employing a systematic approach linking material performance to composition, processing, and microstructure. Computational techniques, such as Calculation of Phase Diagrams and Integrated Computational Materials Engineering, play a crucial role in this process, enabling fast and efficient material design. This study focuses on developing a high damage-tolerant high entropy alloy for hydrogen service, using the two computational techniques to identify optimal composition, predict mechanical properties, and elucidate strengthening mechanisms.https://www.matec-conferences.org/articles/matecconf/pdf/2024/18/matecconf_rapdasa2024_03008.pdf
spellingShingle Simelane Khombisile
Becker Thorsten Hermann
Computational high entropy alloy design
MATEC Web of Conferences
title Computational high entropy alloy design
title_full Computational high entropy alloy design
title_fullStr Computational high entropy alloy design
title_full_unstemmed Computational high entropy alloy design
title_short Computational high entropy alloy design
title_sort computational high entropy alloy design
url https://www.matec-conferences.org/articles/matecconf/pdf/2024/18/matecconf_rapdasa2024_03008.pdf
work_keys_str_mv AT simelanekhombisile computationalhighentropyalloydesign
AT beckerthorstenhermann computationalhighentropyalloydesign