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ArticlesPeer ReviewedFull Text
Point defects in ZnO: an approach from first principles
Author / Creator:Oba, Fumiyasu ; Choi, Minseok ; Togo, Atsushi ; Tanaka, Isao
Publisher:United States: Taylor & Francis
Journal title:Science and technology of advanced materials, 2011-06, Vol.12 (3), p.034302
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Discovery of earth-abundant nitride semiconductors by computational screening and high-pressure synthesis
Author / Creator:Hinuma, Yoyo ; Hatakeyama, Taisuke ; Kumagai, Yu ; Burton, Lee A. ; Sato, Hikaru ; Muraba, Yoshinori ; Iimura, Soshi ; Hiramatsu, Hidenori ; Tanaka, Isao ; Hosono, Hideo ; Oba, Fumiyasu
Publisher:London: Nature Publishing Group UK
Journal title:Nature communications, 2016-06, Vol.7 (1), p.11962-11962, Article 11962
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ArticlesPeer ReviewedFull Text
Theoretical and data-driven approaches to semiconductors and dielectrics: from prediction to experiment
Author / Creator:Oba, Fumiyasu ; Nagai, Takayuki ; Katsube, Ryoji ; Mochizuki, Yasuhide ; Tsuji, Masatake ; Deffrennes, Guillaume ; Hanzawa, Kota ; Nakano, Akitoshi ; Takahashi, Akira ; Terayama, Kei ; Tamura, Ryo ; Hiramatsu, Hidenori ; Nose, Yoshitaro ; Taniguchi, Hiroki
Publisher:United States: Taylor & Francis Ltd
Journal title:Science and technology of advanced materials, 2024-12, Vol.25 (1), p.2423600
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ArticlesPeer ReviewedFull Text
Target Material Property‐Dependent Cluster Analysis of Inorganic Compounds
Author / Creator:Sato, Nobuya ; Takahashi, Akira ; Kiyohara, Shin ; Terayama, Kei ; Tamura, Ryo ; Oba, Fumiyasu
Publisher:Weinheim: Wiley
Journal title:Advanced Intelligent Systems, 2024-12, Vol.6 (12), p.n/a
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Atomic Structure of Luminescent Centers in High-Efficiency Ce-doped w-AlN Single Crystal
Author / Creator:Ishikawa, Ryo ; Lupini, Andrew R. ; Oba, Fumiyasu ; Findlay, Scott D. ; Shibata, Naoya ; Taniguchi, Takashi ; Watanabe, Kenji ; Hayashi, Hiroyuki ; Sakai, Toshifumi ; Tanaka, Isao ; Ikuhara, Yuichi ; Pennycook, Stephen J.
Publisher:London: Nature Publishing Group UK
Journal title:Scientific reports, 2014-01, Vol.4 (1), p.3778, Article 3778
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Emergence of Dynamically‐Disordered Phases During Fast Oxygen Deintercalation Reaction of Layered Perovskite
Author / Creator:Yamamoto, Takafumi ; Kawaguchi, Shogo ; Kosuge, Taiki ; Sugai, Akira ; Tsunoda, Naoki ; Kumagai, Yu ; Beppu, Kosuke ; Ohmi, Takuya ; Nagase, Teppei ; Higashi, Kotaro ; Kato, Kazuo ; Nitta, Kiyofumi ; Uruga, Tomoya ; Yamazoe, Seiji ; Oba, Fumiyasu ; Tanaka, Tsunehiro ; Azuma, Masaki ; Hosokawa, Saburo
Publisher:Germany: John Wiley & Sons, Inc
Journal title:Advanced science, 2023-07, Vol.10 (19), p.e2301876-n/a
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Intercalation and Push‐Out Process with Spinel‐to‐Rocksalt Transition on Mg Insertion into Spinel Oxides in Magnesium Batteries
Author / Creator:Okamoto, Shinya ; Ichitsubo, Tetsu ; Kawaguchi, Tomoya ; Kumagai, Yu ; Oba, Fumiyasu ; Yagi, Shunsuke ; Shimokawa, Kohei ; Goto, Natsumi ; Doi, Takayuki ; Matsubara, Eiichiro
Publisher:Germany: John Wiley and Sons Inc
Journal title:Advanced science, 2015-08, Vol.2 (8), p.1500072-n/a
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Epitaxial growth of Mn-doped γ-Ga2O3 on spinel substrate
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Publisher:New York, USA: Cambridge University Press
Journal title:JOURNAL OF MATERIALS RESEARCH, 2011-02, Vol.26 (4), p.578-583
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Atomistic structure and energetics of interface between Mn-doped γ-Ga2O3 and MgAl2O4
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Publisher:Boston: Springer US
Journal title:Journal of materials science, 2011-06, Vol.46 (12), p.4169-4175
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Atomistic structure and energetics of interface between Mn-doped γ-[Ga.sub.2][O.sub.3] and Mg[Al.sub.2][O.sub.4]
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Publisher:Springer
Journal title:Journal of materials science, 2011-06, Vol.46 (12), p.4169
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Atomistic structure and energetics of interface between Mn-doped Delta g-Ga2O3 and MgAl2O4
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Journal title:Journal of materials science, 2011-06, Vol.46 (12), p.4169-4175
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ArticlesPeer ReviewedFull Text
Epitaxial growth of Mn-doped [gamma]-Ga2O3 on spinel substrate
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Publisher:Warrendale: Springer Nature B.V
Journal title:Journal of materials research, 2011-02, Vol.26 (4), p.578
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ArticlesPeer ReviewedFull Text
Epitaxial growth of Mn-doped γ-Ga 2 O 3 on spinel substrate
Author / Creator:Hayashi, Hiroyuki ; Huang, Rong ; Oba, Fumiyasu ; Hirayama, Tsukasa ; Tanaka, Isao
Journal title:Journal of materials research, 2011-02, Vol.26 (4), p.578-583
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ArticlesPeer ReviewedFull Text
Discovery of a Novel Sn(II)‐Based Oxide β‐SnMoO4 for Daylight‐Driven Photocatalysis
Author / Creator:Hayashi, Hiroyuki ; Katayama, Shota ; Komura, Takahiro ; Hinuma, Yoyo ; Yokoyama, Tomoyasu ; Mibu, Ko ; Oba, Fumiyasu ; Tanaka, Isao
Publisher:Hoboken: John Wiley and Sons Inc
Journal title:Advanced science, 2017-01, Vol.4 (1), p.1600246-n/a
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ArticlesPeer ReviewedFull Text
Discovery of a Novel Sn(II)-Based Oxide β-SnMoO 4 for Daylight-Driven Photocatalysis
Author / Creator:林博之 ; 壬生攻 ; 大場史康 ; 田中功 ; Yokoyama Tomoyasu ; Mibu Ko ; Oba Fumiyasu ; Tanaka Isao
Publisher:John Wiley & Sons, Inc
Journal title:Advanced Science, 2016-08
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ArticlesPeer ReviewedFull Text
Discovery of a Novel Sn(II)‐Based Oxide β‐SnMoO 4 for Daylight‐Driven Photocatalysis
Author / Creator:Hayashi, Hiroyuki ; Katayama, Shota ; Komura, Takahiro ; Hinuma, Yoyo ; Yokoyama, Tomoyasu ; Mibu, Ko ; Oba, Fumiyasu ; Tanaka, Isao
Publisher:Germany: John Wiley & Sons, Inc
Journal title:Advanced science, 2017-01, Vol.4 (1), p.1600246
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ArticlesFull Text
Switchable Electric Dipole from Polaron Localization in Dielectric Crystals
Author / Creator:Morita, Kazuki ; Kumagai, Yu ; Oba, Fumiyasu ; Walsh, Aron
Publisher:Ithaca: Cornell University Library, arXiv.org
Journal title:arXiv.org, 2022-05
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ArticlesFull Text
Finite-size corrections for defect-involving vertical transitions in supercell calculations
Author / Creator:Gake, Tomoya ; Kumagai, Yu ; Freysoldt, Christoph ; Oba, Fumiyasu
Publisher:Ithaca: Cornell University Library, arXiv.org
Journal title:arXiv.org, 2020-01
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Electrostatics-based finite-size correction for first-principles point defect calculations
Author / Creator:Kumagai, Yu ; Oba, Fumiyasu
Publisher:Ithaca: Cornell University Library, arXiv.org
Journal title:arXiv.org, 2014-02
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Electrically Benign Defect Behavior in Zinc Tin Nitride Revealed from First Principles
Author / Creator:Tsunoda, Naoki ; Kumagai, Yu ; Takahashi, Akira ; Oba, Fumiyasu
Publisher:Ithaca: Cornell University Library, arXiv.org
Journal title:arXiv.org, 2018-07
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Showing 1 to 20 of 32 results

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Point defects in ZnO: an approach from first principles

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Discovery of earth-abundant nitride semiconductors by computational screening and high-pressure synthesis

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Theoretical and data-driven approaches to semiconductors and dielectrics: from prediction to experiment

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Target Material Property‐Dependent Cluster Analysis of Inorganic Compounds

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Atomic Structure of Luminescent Centers in High-Efficiency Ce-doped w-AlN Single Crystal

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Emergence of Dynamically‐Disordered Phases During Fast Oxygen Deintercalation Reaction of Layered Perovskite

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Intercalation and Push‐Out Process with Spinel‐to‐Rocksalt Transition on Mg Insertion into Spinel Oxides in Magnesium Batteries

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Epitaxial growth of Mn-doped γ-Ga2O3 on spinel substrate

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Atomistic structure and energetics of interface between Mn-doped γ-Ga2O3 and MgAl2O4

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Atomistic structure and energetics of interface between Mn-doped γ-[Ga.sub.2][O.sub.3] and Mg[Al.sub.2][O.sub.4]

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Atomistic structure and energetics of interface between Mn-doped Delta g-Ga2O3 and MgAl2O4

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Epitaxial growth of Mn-doped [gamma]-Ga2O3 on spinel substrate

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Epitaxial growth of Mn-doped γ-Ga 2 O 3 on spinel substrate

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Discovery of a Novel Sn(II)‐Based Oxide β‐SnMoO4 for Daylight‐Driven Photocatalysis

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Discovery of a Novel Sn(II)-Based Oxide β-SnMoO 4 for Daylight-Driven Photocatalysis

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Discovery of a Novel Sn(II)‐Based Oxide β‐SnMoO 4 for Daylight‐Driven Photocatalysis

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Switchable Electric Dipole from Polaron Localization in Dielectric Crystals

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Finite-size corrections for defect-involving vertical transitions in supercell calculations

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Electrostatics-based finite-size correction for first-principles point defect calculations

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Electrically Benign Defect Behavior in Zinc Tin Nitride Revealed from First Principles

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