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41 件のレコードが見つかりました。 1件目から10件目まで表示します。

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データセット
Benchmark Dataset used in the paper "Fast Evaluation of Unbiased Atomic Forces in ab initio Variational Monte Carlo via the Lagrangian Technique"
データセット
著者
Kosuke Nakano (author) (この著者で検索)
National Institute for Materials Science (NIMS) Center for Basic Research on Materials (CBRM)
ORCID SAMURAI ;
Stefano Battaglia (author) (この著者で検索)
University of Zurich (UZH) Department of Chemistry
;
Jürg Hutter (author) (この著者で検索)
University of Zurich (UZH) Department of Chemistry
キーワード
Variational Monte Carlo, Atomic forces, rMD17
刊行年月日
更新時刻
2026-01-28 08:30:04 +0900
A data-driven elucidation of the challenges in designing stable quinone derivatives for aqueous organic redox flow batteries correlations between the.pdf
A data-driven elucidation of the challenges in designing stable quinone derivatives for aqueous organic redox flow batteries: correlations between thermodynamics of chemical degradation and energy capacity metrics
ジャーナル論文
著者
Ning Lu (author) (この著者で検索)
RWTH Aachen University a MODES, the Integrated Fuel & Chemical Science Centre
;
Shiyao Ju (author) (この著者で検索)
;
Daniel Willimetz (author) (この著者で検索)
;
Shengming Tang (author) (この著者で検索)
;
Abhishek Khetan (author) (この著者で検索)
キーワード
Aqueous organic redox flow batteries, quinone stability, degradation, molecular design, high-throughput screening, durability, grid-scale energy storage
刊行年月日
2026-07-16
更新時刻
2026-07-17 13:28:23 +0900
ジャーナル論文
Dual quantum spin Hall insulator by density-tuned correlations in TaIrTe4
ジャーナル論文
著者
Jian Tang (author) (この著者で検索)
;
Thomas Siyuan Ding (author) (この著者で検索)
;
Hongyu Chen (author) (この著者で検索)
;
Anyuan Gao (author) (この著者で検索)
;
Tiema Qian (author) (この著者で検索)
;
Zumeng Huang (author) (この著者で検索)
;
Zhe Sun (author) (この著者で検索)
;
Xin Han (author) (この著者で検索)
;
Alex Strasser (author) (この著者で検索)
;
Jiangxu Li (author) (この著者で検索)
;
Michael Geiwitz (author) (この著者で検索)
;
Mohamed Shehabeldin (author) (この著者で検索)
;
Vsevolod Belosevich (author) (この著者で検索)
;
Zihan Wang (author) (この著者で検索)
;
Yiping Wang (author) (この著者で検索)
;
Kenji Watanabe (author) (この著者で検索)
National Institute for Materials Science
ORCID SAMURAI ;
Takashi Taniguchi (author) (この著者で検索)
National Institute for Materials Science
ORCID SAMURAI ;
David C. Bell (author) (この著者で検索)
;
Ziqiang Wang (author) (この著者で検索)
;
Liang Fu (author) (この著者で検索)
;
Yang Zhang (author) (この著者で検索)
;
Xiaofeng Qian (author) (この著者で検索)
;
Kenneth S. Burch (author) (この著者で検索)
;
Youguo Shi (author) (この著者で検索)
;
Ni Ni (author) (この著者で検索)
;
Guoqing Chang (author) (この著者で検索)
;
Su-Yang Xu (author) (この著者で検索)
;
Qiong Ma (author) (この著者で検索)
キーワード
Quantum Spin Hall (QSH) Insulator, Electron Correlations, Charge Density Wave (CDW)
刊行年月日
2024-04-18
更新時刻
2025-09-05 16:30:37 +0900
Dataset
MaterialBERT for Natural Language Processing of Materials Science Texts
ジャーナル論文
著者
KAWANO, Hiroyuki (author) (この著者で検索)
Ridgelinez Limited
;
SATO, Fumitaka (author) (この著者で検索)
Ridgelinez Limited
;
YOSHITAKE, Michiko (author) (この著者で検索)
National Institute for Materials Science MaDIS
ORCID SAMURAI ;
MOTEKI, Fuma (operator) (この著者で検索)
Ridgelinez Limited
;
TERAOKA, Hiroshi (author) (この著者で検索)
Ridgelinez Limited
キーワード
word embedding, pre-training, BERT, literal information
刊行年月日
更新時刻
2025-04-15 08:30:11 +0900
Dataset
Examples of SQS (special quasirandom structure) models for arbitrary binary bcc (body centered cubic) and hcp (hexagonal close packed) structures
データセット
著者
ORCID SAMURAI
キーワード
Sommerfeld model, quasi-harmonic vibrational contribution, First-principles calculation, Debye model, titanium alloys
刊行年月日
2020-10-15
更新時刻
2024-01-05 22:12:16 +0900
Manuscript_clean.pdf
Machine learning prediction of Young's modulus in multi component titanium based biomedical alloys using extended thermodynamic descriptors
ジャーナル論文
著者
Hassan Ahmad (author) (この著者で検索)
Pakistan Institute of Engineering and Applied Sciences (PIEAS) Department of Metallurgy and Materials Engineering
;
Muhammad Haider (author) (この著者で検索)
;
Zafar Iqbal (author) (この著者で検索)
;
Muhammad Zarif (author) (この著者で検索)
;
Syed Mujtaba Ul Hassan (author) (この著者で検索)
キーワード
Titanium alloys, machine learning, biomedical alloys, Young’s modulus prediction
刊行年月日
2026-12-31
更新時刻
2026-07-08 16:58:38 +0900
Dataset
Precipitative Coating of Calcium Phosphate on Microporous Silica–Titania Hybrid Particles in Simulated Body Fluid
ジャーナル論文
著者
Reo Kimura (author) (この著者で検索)
Nagaoka University of Technology
;
Kota Shiba (author) (この著者で検索)
National Institute for Materials Science Research Center for Macromolecules and Biomaterials/Biomaterials Field/Olfactory Sensors Group
ORCID SAMURAI ;
Kanata Fujiwara (author) (この著者で検索)
Nagaoka University of Technology
;
Yanni Zhou (author) (この著者で検索)
Nagaoka University of Technology
;
Iori Yamada (author) (この著者で検索)
Nagaoka University of Technology
;
Motohiro Tagaya (author) (この著者で検索)
Nagaoka University of Technology
キーワード
bioceramic nanoparticles, simulated body fluid, nanopore, CP precipitative coating, silica–titania nanohybrid
刊行年月日
2023-05-28
更新時刻
2024-11-20 18:40:02 +0900
published_version.pdf
Electronic modes induced by spin and charge perturbations in Mott and Kondo insulators
ジャーナル論文
著者
Masanori Kohno (author) (この著者で検索)
National Institute for Materials Science Research Center for Materials Nanoarchitectonics (MANA)/Quantum Materials Field/Quantum Material Properties Group
ORCID SAMURAI
キーワード
Strongly correlated systems, Mott insulators, Electronic structure, Spin perturbation, Charge perturbation, Kondo insulators
刊行年月日
2025-12-03
更新時刻
2025-12-11 12:21:37 +0900
Identification of microscopic structures in CFRP from X-ray CT based on topological data analysis.pdf
Identification of microscopic structures in CFRP from X-ray CT based on topological data analysis
ジャーナル論文
著者
Xichan Gao (author) (この著者で検索)
Tohoku University a The Advanced Institute for Materials Research (AIMR)
;
Kazuto Akagi (author) (この著者で検索)
;
Daiki Kido (author) (この著者で検索)
;
Mayrene Uy (author) (この著者で検索)
;
Masao Kimura (author) (この著者で検索)
キーワード
CFRP, fiber positions, crack, persistent homology, TDA, X-ray CT
刊行年月日
2025-12-31
更新時刻
2025-11-06 12:30:15 +0900
0118ZrCuAgAlBe#1.png
Original dataset for ID 131 Zr46Cu30.14Al8.36Al8Be7.5 in Thermophysical Property Database
データセット
コレクション
Thermophysical Property Original Datasets
著者
Takehiko Ishikawa (depositor) (この著者で検索)
Japan Aerospace Exploration Agency
;
Masashi Ishii (editor) (この著者で検索)
National Institute for Materials Science
ORCID SAMURAI
キーワード
Zr46Cu30.14Al8.36Al8Be7.5, Alloy, Drop oscillation, VELF, Electrostatic Levitation, collection - Thermophys Datasets
刊行年月日
更新時刻
2024-03-30 18:39:42 +0900
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