- Creative Commons BY Attribution 4.0 International (96)
- In Copyright (39)
- Creative Commons BY-NC-ND Attribution-NonCommercial-NoDerivs 4.0 International (29)
- Creative Commons BY-NC Attribution-NonCommercial 4.0 International (10)
- cc-by-3.0 (3)
- cc-by-nc-3.0 (1)
- Creative Commons BY-ND Attribution-NoDerivatives 4.0 International (1)
- http://arxiv.org/licenses/nonexclusive-distrib/1.0/ (1)
- https://creativecommons.org/licenses/by-nc/3.0/ (1)
Generative AI‐Driven Accelerated Discovery of Passivation Molecules for Perovskite Solar Cells
- Journal article
- Creator
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;Adroit T. N. Fajar (author) (Search by this author)Guillaume Lambard (author) (Search by this author)National Institute for Materials Science
;
;Jessie Manopo (author) (Search by this author);Ruili Guo (author) (Search by this author);Kevin Septioga (author) (Search by this author);Rizfi F. Pari (author) (Search by this author);Toshinori Matsushima (author) (Search by this author)Zhanglin Guo (author) (Search by this author) - Keyword
- Generative AI, Passivation Molecules, Perovskite Solar Cells
- Date published
- 2026-04-02
- Updated at
- 2026-07-02 14:43:51 +0900
Periodic table-based compositional descriptors for accelerating electrochemical material discovery: Li-ion conductors and oxygen evolution electrocatalysts
- Journal article
- Creator
-
Yen-Ju Wu (author) (Search by this author)
;
Yibin Xu (author) (Search by this author)
;
Lei Fang (author) (Search by this author)
;
;Wenqin Peng (author) (Search by this author)Ken Sakaushi (author) (Search by this author)
;
;Meiqi Zhang (author) (Search by this author)Masao Arai (author) (Search by this author)
;
Yukinori Koyama (author) (Search by this author)
- Keyword
- Solid electrolyte, ionic conductor, electrocatalyst, energy storage, descriptor
- Date published
- 2025-12-31
- Updated at
- 2025-06-18 12:30:21 +0900
Large-scale DFT calculations of multi-component glass systems (SiO2)0.70(Al2O3)0.13(XO)0.17 (X = Mg, Ca, Sr, Ba) : Accuracy of classical force fields
- Journal article
- Creator
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;Atsushi Tanaka (author) (Search by this author);Atsuki Saito (author) (Search by this author);Takashi Murata (author) (Search by this author)Ayako Nakata (author) (Search by this author)National Institute for Materials Science
;
Tsuyoshi Miyazaki (author) (Search by this author)National Institute for Materials Science
- Keyword
- Multi-component glass, First-principles calculations, Large-scale DFT, Classical force fields, Molecular dynamics simulations
- Date published
- 2023-11-25
- Updated at
- 2024-03-05 16:30:21 +0900
Hydrogen-based functional recycling of Nd-Fe-B sintered magnets from e-mobility and wind power: influence on GBDP microstructure evolution and possibilities to improve the resulting properties
- Conference poster
- Collection
- The 28th International Workshop on Rare Earth and Future Permanent Magnets and Their Applications (REPM2025)
- Creator
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;Mario Schönfeldt (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Jürgen Rossa (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Konrad Opelt (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Kilian Schäfer (author) (Search by this author)TU Darmstadt, Department of Materials and Geosciences, Functional Materials, Peter-Grünberg-Str. 16, 64287 Darmstadt, Germany;Lukas Schäfer (author) (Search by this author)TU Darmstadt, Department of Materials and Geosciences, Functional Materials, Peter-Grünberg-Str. 16, 64287 Darmstadt, Germany;Fernando Maccari (author) (Search by this author)TU Darmstadt, Department of Materials and Geosciences, Functional Materials, Peter-Grünberg-Str. 16, 64287 Darmstadt, Germany;Matic Jovičević-Klug (author) (Search by this author)Max-Planck-Institute for Sustainable Materials GmbH, Department of Microstructure Physics and Alloy Design, Max-Planck-Str. 1, 40237 Düsseldorf, Germany;Tim M. Schwarz (author) (Search by this author)Max-Planck-Institute for Sustainable Materials GmbH, Department of Microstructure Physics and Alloy Design, Max-Planck-Str. 1, 40237 Düsseldorf, Germany;Chi-Chia Lin (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Mahmudul Hasan (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Jürgen Gassmann (author) (Search by this author)Fraunhofer IWKS, Fraunhofer Research Institution for Materials Recycling and Resource Strategies, Aschaffenburger Str. 121, 63457 Hanau, Germany;Dierk Raabe (author) (Search by this author)Max-Planck-Institute for Sustainable Materials GmbH, Department of Microstructure Physics and Alloy Design, Max-Planck-Str. 1, 40237 Düsseldorf, GermanyOliver Gutfleisch (author) (Search by this author)TU Darmstadt, Department of Materials and Geosciences, Functional Materials, Peter-Grünberg-Str. 16, 64287 Darmstadt, Germany
- Keyword
- REPM2025, recycling, Nd-Fe-B, sustainability, permanent magnets, grain boundary diffusion process
- Date published
- Updated at
- 2025-09-11 16:31:41 +0900
Direct Visualization of the Charge Transfer in a Graphene/α-RuCl3 Heterostructure via Angle-Resolved Photoemission Spectroscopy
- Journal article
- Creator
-
;Antonio Rossi (author) (Search by this author);Cameron Johnson (author) (Search by this author);Jesse Balgley (author) (Search by this author);John C. Thomas (author) (Search by this author);Luca Francaviglia (author) (Search by this author);Riccardo Dettori (author) (Search by this author);Andreas K. Schmid (author) (Search by this author)Kenji Watanabe (author) (Search by this author)National Institute for Materials Science
;
Takashi Taniguchi (author) (Search by this author)National Institute for Materials Science
;
;Matthew Cothrine (author) (Search by this author);David G. Mandrus (author) (Search by this author);Chris Jozwiak (author) (Search by this author);Aaron Bostwick (author) (Search by this author);Erik A. Henriksen (author) (Search by this author);Alexander Weber-Bargioni (author) (Search by this author)Eli Rotenberg (author) (Search by this author)
- Keyword
- Graphene, α-ruthenium trichloride, electronic properties
- Date published
- 2023-09-13
- Updated at
- 2025-02-26 12:31:14 +0900
Demagnetization Processes in Nd-Fe-B sintered and Ferrite Magnets derived from magnetic measurement and soft X-ray magnetic circular dichroism microscopy
- Conference poster
- Collection
- The 28th International Workshop on Rare Earth and Future Permanent Magnets and Their Applications (REPM2025)
- Creator
-
Yutaka Matsuura (author) (Search by this author)Research Institute for Applied Sciences, Japan
- Keyword
- REPM2025, Nd-Fe-B sintered magnet, ferrite magnet, demagnetization, coercivity, coercivity mechanism
- Date published
- Updated at
- 2025-09-11 16:30:56 +0900
Nonnegative matrix factorization incorporating domain specific constraints for four dimensional scanning transmission electron microscopy
- Journal article
- Creator
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Koji Kimoto (author) (Search by this author)
;
Fumihiko Uesugi (author) (Search by this author)
;
Koji Harano (author) (Search by this author)
;
Jun Kikkawa (author) (Search by this author)
;
Ovidiu Cretu (author) (Search by this author)
;
Yuki Shibazaki (author) (Search by this author)
https://orcid.org/0000-0002-0550-6719
(unauthenticated)
;
Motoki Shiga (author) (Search by this author)
;
Atsushi Togo (author) (Search by this author)
- Keyword
- 4D-STEM, unsupervised machine learning, nonnegative matrix factorization, scanning transmission electron microscopy, metallic glass, amorphous, ZrCuAl
- Date published
- 2025-11-07
- Updated at
- 2025-12-01 12:30:04 +0900
Machine learning prediction of coordination energies for alkali group elements in battery electrolyte solvents
- Dataset
- Creator
-
ISHIKAWA, Atsushi (author) (Search by this author)
;
SODEYAMA, Keitaro (author) (Search by this author)
;
IGARASHI, Yasuhiko (author) (Search by this author)
https://orcid.org/0000-0003-1042-6657
(unauthenticated)
;
NAKAYAMA, Tomofumi (author) (Search by this author)
https://orcid.org/0000-0003-1240-3571
(unauthenticated)
;
TATEYAMA, Yoshitaka (author) (Search by this author)
;
OKADA, Masato (author) (Search by this author)
https://orcid.org/0000-0002-9040-8784
(unauthenticated)
- Keyword
- quantum chemistry, electrolyte, battery
- Date published
- 2019-11-18
- Updated at
- 2024-01-05 22:13:39 +0900
Dual grain size-effects on hydrogen-assisted fatigue crack growth in 1 GPa-class medium-carbon martensitic steel
- Journal article
- Creator
-
Yuhei Ogawa (author) (Search by this author)National Institute for Materials Science
;
;Kazuhiro Kuriyama (author) (Search by this author)Motomichi Koyama (author) (Search by this author)
- Keyword
- Hydrogen embrittlement, Fatigue, Fracture, Martensitic steels, Grain size
- Date published
- 2023-09-09
- Updated at
- 2025-09-09 08:30:40 +0900
Quantitative analysis of local plasticity accompanying hydrogen-related fracture in low-carbon martensitic steel
- Journal article
- Creator
-
Xiaodong Lan (author) (Search by this author)
;
Kazuho Okada (author) (Search by this author)
;
Ivan Gutierrrez-Urrutia (author) (Search by this author)
;
Akinobu Shibata (author) (Search by this author)
- Keyword
- Hydrogen embrittlement, Martensite, Local plasticity, Electron backscatter diffraction (EBSD), Digital image correlation (DIC)
- Date published
- 2023-11-08
- Updated at
- 2024-11-21 16:31:07 +0900