論文 Advancing refractory high entropy alloy development with AI-predictive models for high temperature oxidation resistance

Stéphane Gorsse ORCID ; Wei-Chih Lin ; Hideyuki Murakami SAMURAI ORCID (National Institute for Materials ScienceROR) ; Gian-Marco Rignanese ORCID ; An-Chou Yeh ORCID

コレクション

引用
Stéphane Gorsse, Wei-Chih Lin, Hideyuki Murakami, Gian-Marco Rignanese, An-Chou Yeh. Advancing refractory high entropy alloy development with AI-predictive models for high temperature oxidation resistance. SCRIPTA MATERIALIA. 2024, 255 (), 116394. https://doi.org/10.1016/j.scriptamat.2024.116394
SAMURAI

説明:

(abstract)

Refractory high-entropy alloys (RHEAs) and complex concentrated alloys (RCCAs) are vital for high-temperature applications beyond the capabilities of Ni-based superalloys. Traditional methods for predicting oxidation resistance in these alloys are often inaccurate and resource-intensive. This study introduces a novel approach using Gradient Boosted Decision Trees (GBDT), an artificial intelligence technique, to predict specific mass gain due to oxidation. Utilizing a dataset synthesized from extensive literature and characterized by diverse alloy compositions and oxidation conditions, the model was trained using Iterated Nested k-fold Cross Validation with Shuffling (INKCVS). Our findings demonstrate that the GBDT model achieves a good balance between accuracy and generalization capacity in predicting oxidation resistance, as validated experimentally with selected alloys. This approach not only enhances prediction accuracy but also significantly reduces the need for extensive experimental testing, facilitating rapid development of new high-performance materials.

権利情報:

キーワード: Refractory high entropy alloys, Oxidation resistance, AI model

刊行年月日: 2024-10-01

出版者: Elsevier BV

掲載誌:

  • SCRIPTA MATERIALIA (ISSN: 13596462) vol. 255 116394

研究助成金:

  • Centre National de la Recherche Scientifique
  • Agence Nationale de la Recherche ANR-22-PEXD-0003

原稿種別: 出版者版 (Version of record)

MDR DOI:

公開URL: https://doi.org/10.1016/j.scriptamat.2024.116394

関連資料:

その他の識別子:

連絡先:

更新時刻: 2024-10-09 08:30:56 +0900

MDRでの公開時刻: 2024-10-09 08:30:56 +0900

ファイル名 サイズ
ファイル名 1-s2.0-S1359646224004299-main.pdf (サムネイル)
application/pdf
サイズ 6.52MB 詳細