Statistical Analysis of Interatomic Transfer Integrals for exploring high-mobility organic semiconductors
- Journal article
- Creator
-
;Koki Ozawa (author) (Search by this author)Toyota Central R&D Labs. Inc;Tomoharu Okada (author) (Search by this author)Hiroyuki Matsui (author) (Search by this author)Research Center for Organic Electronics (ROEL), Yamagata University
- Keyword
- Organic semiconductors, transfer integrals, density functional theory, materials informatics, organic transistors
- Date published
- 2024-12-31
- Updated at
- 2024-06-04 08:30:18 +0900
NIMSʼs Materials Data Platform DICE and its future direction
- Other
- Collection
- The history of DICE and NIMS Digital Library
- Creator
-
MATSUDA, Asahiko (author) (Search by this author)
;
KADOHIRA, Takuya (author) (Search by this author)
;
DEMURA, Masahiko (author) (Search by this author)
- Keyword
- data platform, metadata, data management, materials informatics, DICE
- Date published
- 2022-03-22
- Updated at
- 2022-10-03 01:23:48 +0900
Efficient discovery of large magnetic anisotropy with thermodynamically stable materials via multi-objective Bayesian optimization
- Journal article
- Creator
-
;Kohei Nakamura (author) (Search by this author);Daigo Furuya (author) (Search by this author)Yoshio Miura (author) (Search by this author)National Institute for Materials Science
;
;Takahiro Yamazaki (author) (Search by this author);Alexandre Lira Foggiatto (author) (Search by this author)Yuma Iwasaki (author) (Search by this author)National Institute for Materials Science
;
Masato Kotsugi (author) (Search by this author)
- Keyword
- materials informatics
- Date published
- 2025-12-31
- Updated at
- 2025-12-12 08:30:29 +0900
Performance of uncertainty-based active learning for efficient approximation of black-box functions in materials science
- Journal article
- Creator
-
;Ai Koizumi (author) (Search by this author);Guillaume Deffrennes (author) (Search by this author);Kei Terayama (author) (Search by this author)Ryo Tamura (author) (Search by this author)
- Keyword
- active learning, black-box function, materials informatics
- Date published
- 2024-11-06
- Updated at
- 2024-11-21 16:35:14 +0900
Combination of recommender system and single-particle diagnosis for accelerated discovery of novel nitrides
- Journal article
- Creator
-
KOYAMA, Yukinori (author) (Search by this author)
;
SEKO, Atsuto (author) (Search by this author)
https://orcid.org/0000-0002-2473-3837
(unauthenticated)
;
TANAKA, Isao (author) (Search by this author)
https://orcid.org/0000-0002-4616-118X
(unauthenticated)
;
FUNAHASHI, Shiro (author) (Search by this author)
;
HIROSAKI, Naoto (author) (Search by this author)
- Keyword
- materials informatics, density functional theory calculation, materials search
- Date published
- 2021-06-14
- Updated at
- 2024-01-05 22:12:06 +0900
An interpretable linear model bridging data-driven analysis and chemical intuition for Eu 2+ -phosphor emissions
- Journal article
- Creator
-
Yukinori Koyama (author) (Search by this author)
;
;Ryusei Hayasaka (author) (Search by this author)Yuta Matsushima (author) (Search by this author)
https://orcid.org/0000-0001-5826-1551
(unauthenticated)
;
Takayuki Nakanishi (author) (Search by this author)
;
Takashi Takeda (author) (Search by this author)
;
Naoto Hirosaki (author) (Search by this author)
- Keyword
- materials informatics, phosphor, europium, machine learning, interpretability, linear model, composition-based feature
- Date published
- 2026-12-31
- Updated at
- 2026-07-07 14:31:04 +0900
Data-driven analysis of electron relaxation times in PbTe-type thermoelectric materials
- Journal article
- Creator
-
Yukari Katsura (author) (Search by this author)National Institute for Materials Science
;
;Masaya Kumagai (author) (Search by this author);Takushi Kodani (author) (Search by this author);Mitsunori Kaneshige (author) (Search by this author);Yuki Ando (author) (Search by this author)National Institute for Materials Science;Sakiko Gunji (author) (Search by this author);Yoji Imai (author) (Search by this author);Hideyasu Ouchi (author) (Search by this author);Kazuki Tobita (author) (Search by this author);Kaoru Kimura (author) (Search by this author)Koji Tsuda (author) (Search by this author)National Institute for Materials Science
- Keyword
- materials informatics, database, data curation, thermoelectric materials, first-principles calculation, electron relaxation time
- Date published
- 2019-12-31
- Updated at
- 2024-10-10 16:31:01 +0900
Semi-automatic staging area for high-quality structured data extraction from scientific literature
- Journal article
- Creator
-
Luca Foppiano (author) (Search by this author)National Institute for Materials Science
;
Tomoya Mato (author) (Search by this author)National Institute for Materials Science
;
Kensei Terashima (author) (Search by this author)National Institute for Materials Science
;
;Pedro Ortiz Suarez (author) (Search by this author);Taku Tou (author) (Search by this author)Chikako Sakai (author) (Search by this author)
;
Wei-Sheng Wang (author) (Search by this author)
https://orcid.org/0009-0001-3572-5736
(unauthenticated)
National Institute for Materials Science
;
;Toshiyuki Amagasa (author) (Search by this author)Yoshihiko Takano (author) (Search by this author)National Institute for Materials Science
;
Masashi Ishii (author) (Search by this author)National Institute for Materials Science
- Keyword
- materials informatics, superconductors, machine learning, database, tdm
- Date published
- 2023-12-31
- Updated at
- 2024-07-11 16:30:24 +0900
Relationship Extraction with Weakly Supervised Learning Based on Process-Structure-Property-Performance Reciprocity
- Journal article
- Creator
-
;Takeshi Onishi (author) (Search by this author)Takuya Kadohira (author) (Search by this author)National Institute for Materials Science
;
Ikumu Watanabe (author) (Search by this author)National Institute for Materials Science
- Keyword
- Natural language processing, knowledge extraction, relation extraction, weakly supervised learning, materials informatics
- Date published
- 2018-12-31
- Updated at
- 2024-01-05 22:13:14 +0900
Multiobjective Solid Electrolyte Design of Tetragonal and Cubic Inverse-Perovskites for All-Solid-State Lithium-Ion Batteries by High-Throughput Density Functional Theory Calculations and AI-Driven Methods
- Journal article
- Creator
-
JALEM Randy (author) (Search by this author)Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
;
TATEYAMA Yoshitaka (author) (Search by this author)Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
;
TAKADA Kazunori (author) (Search by this author)Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group, National Institute for Materials Science
;
JANG Seonghoon (author) (Search by this author)Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
- Keyword
- all solid state batteries, solid electrolytes, density functional theory, materials informatics, machine learning, novel materials search
- Date published
- 2023-09-07
- Updated at
- 2024-08-28 08:30:15 +0900