5 records found.
Construction of Machine Learning Potentials toward the Exploration of Alloy Cluster Catalysts
- Journal article
- Creator
-
;Kentaro Miyamoto (author) (Search by this author);Koji Shimizu (author) (Search by this author)Anh Khoa Augustin Lu (author) (Search by this author)National Institute for Materials Science
;
Satoshi Watanabe (author) (Search by this author) - Keyword
- High entropy alloys, Machine learning, Density functional theory, Catalysts, CO2 reduction reaction
- Date published
- 2025-05-17
- Updated at
- 2026-05-18 15:04:41 +0900
HeuslerDB_elecBand_ver1.0
- Dataset
- Creator
-
Terumasa Tadano (author) (Search by this author)Spin Theory Group, Research Center for Magnetic and Spintronic Materials, National Institute for Materials Science
- Keyword
- Heusler alloys, Density functional theory, Band structure
- Date published
- 2025-07-16
- Updated at
- 2025-10-06 16:30:11 +0900
Combinatorial characterization of metastable luminous silver cations
- Journal article
- Creator
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;Hirokazu Masai (author) (Search by this author);Masanori Koshimizu (author) (Search by this author);Hiroki Kawamoto (author) (Search by this author);Hiroyuki Setoyama (author) (Search by this author)Yohei Onodera (author) (Search by this author)National Institute for Materials Science
;
;Kazutaka Ikeda (author) (Search by this author);Shingo Maruyama (author) (Search by this author);Naoki Haruta (author) (Search by this author);Tohru Sato (author) (Search by this author);Yuji Matsumoto (author) (Search by this author);Chika Takahashi (author) (Search by this author)Teruyasu Mizoguchi (author) (Search by this author)
- Keyword
- Glass, Radiophotoluminescence, X-ray diffraction, Neutron diffraction, Reverse Monte Carlo, Density functional theory, X-ray absorption fine structure
- Date published
- 2024-02-26
- Updated at
- 2024-03-28 12:30:33 +0900
An efficient cathode electrocatalyst for anion exchange membrane water electrolyzer
- Journal article
- Creator
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;Shanmugam Ramakrishnan (author) (Search by this author);Subramanian Vijayapradeep (author) (Search by this author)Selva Chandrasekaran Selvaraj (author) (Search by this author)
https://orcid.org/0000-0002-9023-4075
(unauthenticated)
National Institute for Materials Science
;
;Jian Huang (author) (Search by this author);S.C. Karthikeyan (author) (Search by this author);Rambabu Gutru (author) (Search by this author);Natarajan Logeshwaran (author) (Search by this author)Tsuyoshi Miyazaki (author) (Search by this author)National Institute for Materials Science
;
;Mohamed Mamlouk (author) (Search by this author)Dong Jin Yoo (author) (Search by this author) - Keyword
- Hierarchical MoS2, Pt–C core-shell, Density functional theory, In-situ Raman analysis, Anion exchange membrane water electrolyzer
- Date published
- 2024-01-15
- Updated at
- 2024-03-04 16:30:11 +0900
[Research Highlights Vol.48] Origins of Macroscopic Friction Linked to Energy Landscape on the Nanoscale
- Magazine
- Collection
- Research Highlights
- Creator
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International Center for Materials Nanoarchitectonics (WPI-MANA) (author) (Search by this author)National Institute for Materials Science
- Keyword
- Clays, Layered minerals, Mica, Kaolinite, Friction coefficients, Geophysics, Natural faults, Interlayer bonding, First-principles simulation, Density functional theory, van der Waals interaction
- Date published
- 2019-03-19
- Updated at
- 2023-12-25 00:30:23 +0900