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Efficient autonomous material search method combining ab initio calculations autoencoder and multi objective Bayesian optimization.pdf
Efficient autonomous material search method combining ab initio calculations, autoencoder, and multi-objective Bayesian optimization
Journal article
Creator
ORCID SAMURAI ;
Hwang Jaekyun (author) (Search by this author)
ORCID ; ORCID SAMURAI ;
Masato Kotsugi (author) (Search by this author)
ORCID ;
Yasuhiko Igarashi (author) (Search by this author)
ORCID
Keyword
autonomous materials search, ab-initio, Machine learning
Date published
2022-12-31
Updated at
2024-01-05 22:14:05 +0900
D5DD00437C.pdf
Automated synthesis and fragment descriptor-based machine learning for retention time prediction in supercritical fluid chromatography
Journal article
Creator
Sitanan Sartyoungkul (author) (Search by this author)
;
Balasubramaniyan Sakthivel (author) (Search by this author)
;
Pavel Sidorov (author) (Search by this author)
ORCID ;
Yuuya Nagata (author) (Search by this author)
ORCID
Keyword
Automated synthesis, Fragment descriptor, Machine learning, Retention time prediction, Supercritical fluid chromatography
Date published
2025-11-26
Updated at
2025-12-24 15:05:55 +0900
Manuscript.pdf
In Situ Forming Supramolecular Nanofiber Hydrogel as a Biodegradable Liquid Embolic Agent for Postembolization Tissue Remodeling
Journal article
Creator
Akihiro Nishiguchi (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Miho Ohta (author) (Search by this author)
;
Debabrata Palai (author) (Search by this author)
National Institute for Materials Science
ORCID ;
Shima Ito (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Kensaku Mori (author) (Search by this author)
;
Ryotaro Akagi (author) (Search by this author)
;
Christophe Bajan (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Guillaume Lambard (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Keitaro Sodeyama (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Tetsushi Taguchi (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI
Keyword
Hydrogel, Embolic agent, Machine learning
Date published
2024-11-07
Updated at
2025-02-26 16:30:29 +0900
Autonomous materials search using machine learning and ab initio calculations for L10-FePt-based quaternary alloys (1).pdf
Autonomous materials search using machine learning and ab initio calculations for L1 0 -FePt-based quaternary alloys
Journal article
Creator
Yuma Iwasaki (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Daisuke Ogawa (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Masato Kotsugi (author) (Search by this author)
;
Yukiko K. Takahashi (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI
Keyword
Machine learning, Autonomous
Date published
2025-12-31
Updated at
2025-12-25 15:02:29 +0900
s41524-025-01757-5 (2).pdf
High-throughput materials exploration system for the anomalous Hall effect using combinatorial experiments and machine learning
Journal article
Creator
ORCID SAMURAI ; ORCID SAMURAI ; ORCID ; ORCID SAMURAI ; ORCID SAMURAI ; ORCID SAMURAI
Keyword
Machine learning, High-throughput, Combinatorial, Anomalous Hall effect
Date published
2025-09-03
Updated at
2025-12-26 13:11:05 +0900
Machine learning prediction of the mechanical properties of injection-molded polypropylene through X-ray diffraction analysis.pdf
Machine learning prediction of the mechanical properties of injection-molded polypropylene through X-ray diffraction analysis
Journal article
Creator
Ryo Tamura (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Kenji Nagata (author) (Search by this author)
;
Keitaro Sodeyama (author) (Search by this author)
;
Kensaku Nakamura (author) (Search by this author)
;
Toshiki Tokuhira (author) (Search by this author)
;
Satoshi Shibata (author) (Search by this author)
;
Kazuki Hammura (author) (Search by this author)
;
Hiroki Sugisawa (author) (Search by this author)
;
Masaya Kawamura (author) (Search by this author)
;
Teruki Tsurimoto (author) (Search by this author)
;
Masanobu Naito (author) (Search by this author)
;
Masahiko Demura (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Takashi Nakanishi (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI
Keyword
Polypropylene, X-ray diffraction, Bayesian spectral deconvolution, Ising machine, Machine learning
Date published
2024-12-31
Updated at
2024-08-30 16:31:01 +0900
Autonomous search for materials with high Curie temperature using ab initio calculations and machine learning (1).pdf
Autonomous search for materials with high Curie temperature using ab initio calculations and machine learning
Journal article
Creator
ORCID SAMURAI
Keyword
Machine learning, Autonomous, Curie temperature, ab initio
Date published
2024-12-31
Updated at
2024-10-04 08:30:28 +0900
Dieb-Tsuda2018_Chapter_MachineLearning-BasedExperimen.pdf
Machine Learning-Based Experimental Design in Materials Science
Book
Creator
ORCID SAMURAI ; ORCID SAMURAI
Keyword
Materials design, Machine learning, Optimal experiment design
Date published
2018-01-16
Updated at
2022-10-03 01:58:06 +0900
Wu 2025 J Appl Crystallogr nanoXRD UMAP HVPE GaN.pdf
Machine learning assisted nanobeam X-ray diffraction based analysis on hydride vapor-phase epitaxy GaN
Journal article
Creator
Zhendong Wu (author) (Search by this author)
;
Yusuke Hayashi (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Tetsuya Tohei (author) (Search by this author)
;
Kazushi Sumitani (author) (Search by this author)
;
Yasuhiko Imai (author) (Search by this author)
;
Shigeru Kimura (author) (Search by this author)
;
Akira Sakai (author) (Search by this author)
Keyword
GaN, SPring-8, nanoXRD, Machine learning
Date published
2025-08-01
Updated at
2025-07-31 12:30:18 +0900
main.pdf
Data-driven analysis of hydrogen embrittlement in martensitic steels with interpretable machine learning
Journal article
Creator
ORCID SAMURAI ; ORCID SAMURAI ; ORCID SAMURAI
Keyword
Hydrogen embrittlement, Martensitic steel, Machine learning, hap (shapley additive explanations), Symbolic regression
Date published
2026-04-23
Updated at
2026-06-17 09:57:29 +0900
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