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角田直樹 研究業績一覧 (24件)
論文
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Takafumi Yamamoto,
Shogo Kawaguchi,
Taiki Kosuge,
Akira Sugai,
Naoki Tsunoda,
Yu Kumagai,
Kosuke Beppu,
Takuya Ohmi,
Teppei Nagase,
Kotaro Higashi,
Kazuo Kato,
Kiyofumi Nitta,
Tomoya Uruga,
Seiji Yamazoe,
Fumiyasu Oba,
Tsunehiro Tanaka,
Masaki Azuma,
Saburo Hosokawa.
Emergence of Dynamically‐Disordered Phases During Fast Oxygen Deintercalation Reaction of Layered Perovskite,
Advanced Science,
Vol. 10,
2301876,
Apr. 2023.
公式リンク
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K. Matsuzaki,
N. Tsunoda,
Y. Kumagai,
Y. Tang,
K. Nomura,
F. Oba,
HIDEO HOSONO.
Hole-doping to a Cu(I)-based semiconductor with an isovalent cation: Utilizing a complex defect as a shallow acceptor,
Journal of the American Chemical Society,
vol. 144,
pp. 16572–16578,
Sept. 2022.
公式リンク
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Y. Wang,
S. Bruyère,
Y. Kumagai,
N. Tsunoda,
F. Oba,
J. Ghanbaja,
H. Sun,
B. Daib,
J. F. Pierson.
Tuning the optical band gap and electrical properties of NiO thin films by nitrogen doping: a joint experimental and theoretical study,
RSC Advances,
vol. 12,,
pp. 21940-21945,
Aug. 2022.
公式リンク
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N. Tsunoda,
Y. Kumagai,
F. Oba.
Recommendation of interstitial hydrogen positions in metal oxides,
Computational Materials Science,
vol. 203,
pp. 111068,
Feb. 2022.
公式リンク
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Y. Kumagai,
N. Tsunoda,
A. Takahashi,
F. Oba.
Insights into oxygen vacancies from high-throughput first-principles calculations,
Physical Review Materials,
vol. 5,
pp. 123803,
Dec. 2021.
公式リンク
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N. Tsunoda,
Y. Kumagai,
F. Oba.
Stabilization of small polarons in BaTiO3 by local distortions,
Physical Review Materials,
vol. 3,
pp. 114602,
Nov. 2019.
公式リンク
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R. Liu,
D. D. Khalyavin,
N. Tsunoda,
Y. Kumagai,
F. Oba,
Y. Katsuya,
M. Tanaka,
K. Yamaura,
A. A. Belik.
Spin-glass magnetic properties of A-site columnar-ordered quadruple perovskites Y2MnGa(Mn4–xGax)O12 with 0 ≤ x ≤ 3",
Inorganic Chemistry,
American Chemical Society,
vol. 58,
pp. 14830-14841,
Oct. 2019.
公式リンク
国際会議発表 (査読有り)
国内会議発表 (査読有り)
国際会議発表 (査読なし・不明)
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N. Tsunoda,
Y. Kumagai,
F. Oba.
High-throughput computational study of hydrogen impurities in oxides,
The 5th International Union of Materials Research Societies International Conference of Young Researchers on Advanced Materials (IUMRS-ICYRAM 2022),
Aug. 2022.
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N. Tsunoda,
Y. Kumagai,
F. Oba.
Efficient exploration of proton sites in metal oxides,
Materials Research Meeting 2021,
Dec. 2021.
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Naoki Tsunoda,
Yu Kumagai,
Fumiyasu Oba.
Small Polarons in BaTiO3: A First-Principles Study,
Materials Research Meeting 2019,
Dec. 2019.
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N. Tsunoda,
Y. Kumagai,
F. Oba.
Ab initio study of point defects and p-type doping in ScN,
Car-Parrinello Molecular Dynamics (CPMD) 2017,
Oct. 2017.
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N. Tsunoda,
Y. Kumagai,
F. Oba.
Point defects in scandium nitride: A first-principles study,
The Tenth International Conference on the Science and Technology for Advanced Ceramics (STAC-10),
Aug. 2017.
国内会議発表 (査読なし・不明)
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今井佑汰,
角田直樹,
大場史康,
熊谷悠.
酸化物の表面近傍における酸素空孔に関する第一原理計算,
日本セラミックス協会第42回電子材料研究討論会,
Nov. 2022.
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角田直樹,
熊谷悠,
大場史康.
金属酸化物中の格子間水素不純物の局所構造及び電荷遷移準位に関する第一原理計算,
日本金属学会2022年春期講演大会,
Mar. 2022.
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角田 直樹,
熊谷 悠,
大場史康,
.
BaTiO3 中の電子ポーラロンに関する理論的検討,
日本金属学会2019年秋期講演大会,
Sept. 2019.
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角田 直樹,
熊谷 悠,
大場 史康.
ペロブスカイト類縁酸化物中の酸素空孔に関する第一原理計算,
日本金属学会2018年秋期講演大会,
Sept. 2018.
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角田 直樹,
熊谷 悠,
大場 史康.
ZnSnN2中の点欠陥の第一原理計算,
日本金属学会2018年春期講演大会,
Mar. 2018.
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Naoki Tsunoda,
Yu Kumagai,
Fumiyasu Oba.
Defect Energetics in Scandium Nitride: A First-Principles Study,
第27回日本MRS年次大会,
Dec. 2017.
学位論文
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First-principles study of hydrogen impurities in metal oxides,
Exam Summary,
Doctor (Engineering),
Tokyo Institute of Technology,
2023/03/26,
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First-principles study of hydrogen impurities in metal oxides,
Summary,
Doctor (Engineering),
Tokyo Institute of Technology,
2023/03/26,
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First-principles study of hydrogen impurities in metal oxides,
Outline,
Doctor (Engineering),
Tokyo Institute of Technology,
2023/03/26,
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First-principles study of hydrogen impurities in metal oxides,
Thesis,
Doctor (Engineering),
Tokyo Institute of Technology,
2023/03/26,
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