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1437 件のレコードが見つかりました。
TREXIO: A file format and library for quantum chemistry
- ジャーナル論文
- 著者
-
;Evgeny Posenitskiy (author) (この著者で検索);Vijay Gopal Chilkuri (author) (この著者で検索);Abdallah Ammar (author) (この著者で検索);Michał Hapka (author) (この著者で検索);Katarzyna Pernal (author) (この著者で検索);Ravindra Shinde (author) (この著者で検索);Edgar Josué Landinez Borda (author) (この著者で検索);Claudia Filippi (author) (この著者で検索)Kosuke Nakano (author) (この著者で検索)National Institute for Materials Science
;
;Otto Kohulák (author) (この著者で検索);Sandro Sorella (author) (この著者で検索);Pablo de Oliveira Castro (author) (この著者で検索);William Jalby (author) (この著者で検索);Pablo López Ríos (author) (この著者で検索);Ali Alavi (author) (この著者で検索)Anthony Scemama (author) (この著者で検索) - キーワード
- quantum chemistry, data, interoperability
- 刊行年月日
- 2023-05-07
- 更新時刻
- 2024-12-18 08:30:57 +0900
Nature of Li2O2 and its relationship to the mechanisms of discharge/charge reactions of lithium–oxygen batteries
- ジャーナル論文
- 著者
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Yanan Gao (author) (この著者で検索)National Institute for Materials Science
;
Hitoshi Asahina (author) (この著者で検索)
https://orcid.org/0000-0002-1837-9077
(unauthenticated)
National Institute for Materials Science
;
Shoichi Matsuda (author) (この著者で検索)National Institute for Materials Science
;
Hidenori Noguchi (author) (この著者で検索)National Institute for Materials Science
;
Kohei Uosaki (author) (この著者で検索)National Institute for Materials Science
- キーワード
- lithium oxygen battery
- 刊行年月日
- 2024-03-19
- 更新時刻
- 2024-06-28 09:43:46 +0900
Machine extraction of polymer data from tables using XML versions of scientific articles
- データセット
- 著者
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;YOSHIZAWA, Atsushi (author) (この著者で検索)ISHII, Masashi (author) (この著者で検索)
;
SHINDO, Hiroyuki (author) (この著者で検索)
https://orcid.org/0000-0003-1081-9194
(unauthenticated)
;
OKA, Hiroyuki (author) (この著者で検索)
;
MATSUMOTO, Yuji (author) (この著者で検索)
https://orcid.org/0000-0003-4946-9574
(unauthenticated)
- キーワード
- polymer data, table, machine extraction, informatics, XML
- 刊行年月日
- 2021-01-01
- 更新時刻
- 2024-06-21 15:45:49 +0900
Conductance Switching in an Asymmetric Single-Molecule Junction
- ジャーナル論文
- 著者
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Masato Takei (author) (この著者で検索)
https://orcid.org/0000-0002-3522-0033
(unauthenticated)
;
;Akira Takatsuki (author) (この著者で検索)Katsunori Wakabayashi (author) (この著者で検索)
https://orcid.org/0000-0002-9147-9939
(unauthenticated)
;
Satoshi Kaneko (author) (この著者で検索)
https://orcid.org/0000-0002-0351-6681
(unauthenticated)
;
Hiroshi Suga (author) (この著者で検索)
https://orcid.org/0000-0003-4333-4898
(unauthenticated)
;
Yasuhisa Naitoh (author) (この著者で検索)
https://orcid.org/0000-0003-2431-9625
(unauthenticated)
;
Kazuhito Tsukagoshi (author) (この著者で検索)
- キーワード
- fullerene, Single-molecule device, transition voltage spectroscopy, single-level transport model, C60 pyrrolidine tris-acid
- 刊行年月日
- 2025-10-13
- 更新時刻
- 2025-11-06 12:30:22 +0900
Preparation and luminescent performances of tellurite glass coated CsPbBr3@glass film for remote LED color converter
- ジャーナル論文
- 著者
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;Huanhuan Zhang (author) (この著者で検索);Jialing Ou (author) (この著者で検索);Guoying Zhao (author) (この著者で検索);Jingshan Hou (author) (この著者で検索);Yufeng Liu (author) (この著者で検索);Xin Qiao (author) (この著者で検索);Zhongzhi Wang (author) (この著者で検索)Ji-Guang Li (author) (この著者で検索)National Institute for Materials Science
;
Yongzheng Fang (author) (この著者で検索)
- キーワード
- Remote glass film, CsPbBr3 perovskite quantum dot, High quantum yield, Double encapsulation
- 刊行年月日
- 2023-01-06
- 更新時刻
- 2025-01-07 16:30:44 +0900
Unveiling the effect of Ni on the formation and structure of Earth’s inner core
- ジャーナル論文
- 著者
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;Yang Sun (author) (この著者で検索);Mikhail I. Mendelev (author) (この著者で検索);Feng Zhang (author) (この著者で検索);Xun Liu (author) (この著者で検索)National Institute for Materials ScienceBo Da (author) (この著者で検索)National Institute for Materials Science
;
;Cai-Zhuang Wang (author) (この著者で検索);Renata M. Wentzcovitch (author) (この著者で検索)Kai-Ming Ho (author) (この著者で検索)
- キーワード
- Earth’s inner core
- 刊行年月日
- 2024-01-23
- 更新時刻
- 2024-12-24 13:58:20 +0900
Extraction of local structure differences in silica based on unsupervised learning
- ジャーナル論文
- 著者
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Anh Khoa Augustin Lu (author) (この著者で検索)National Institute for Materials Science
;
Jianbo Lin (author) (この著者で検索)National Institute for Materials Science
;
;Yasunori Futamura (author) (この著者で検索);Tetsuya Sakurai (author) (この著者で検索)Ryo Tamura (author) (この著者で検索)National Institute for Materials Science
;
Tsuyoshi Miyazaki (author) (この著者で検索)National Institute for Materials Science
- キーワード
- silica, unsupervised learning, Machine Learning, Molecular Dynamics(MD), Density Functional Theory (DFT), local structure analysis
- 刊行年月日
- 2024-03-28
- 更新時刻
- 2024-08-20 08:30:29 +0900
Dynamic cell photo-manipulation technology for the molecular and mechanical regulation analyses of collective cell migration
- ジャーナル論文
- 著者
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Kazuhiro Tatematsu (author) (この著者で検索)
;
Shota Yamamoto (author) (この著者で検索)
;
;Masao Kamimura (author) (この著者で検索);Kazuo Yamaguchi (author) (この著者で検索)Jun Nakanishi (author) (この著者で検索)
- キーワード
- Collective cell migration, Dynamic substrate, Mechanobiology, Extracellular Matrix
- 刊行年月日
- 2024-04-25
- 更新時刻
- 2024-07-05 12:30:29 +0900
Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study
- ジャーナル論文
- 著者
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Shengzhou Li (author) (この著者で検索)National Institute for Materials Science
;
Tsuyoshi Miyazaki (author) (この著者で検索)National Institute for Materials Science
;
Ayako Nakata (author) (この著者で検索)National Institute for Materials Science
- キーワード
- Large-scale DFT, gold nanoparticle, supported nanoparticle, statistic analysis, density of states, principal component analysis, first-principles calculation
- 刊行年月日
- 2024-06-21
- 更新時刻
- 2024-08-31 08:30:29 +0900
High-temperature thermal conductivity of yttrium and rare-earth iron garnets
- ジャーナル論文
- 著者
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Makoto Tachibana (author) (この著者で検索)
;
Cédric Bourgès (author) (この著者で検索)
;
Takao Mori (author) (この著者で検索)
- キーワード
- thermal conductivity, heat capacity, iron garnets, single crystal, phonon, magnon
- 刊行年月日
- 2025-10-06
- 更新時刻
- 2025-10-21 16:05:59 +0900