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JAIST Repository >
著者: "Terakura, Kiyoyuki"
5 著者名表示.
発行日 | タイトル |
著者 |
10-Jun-2009 | Revisiting magnetic coupling in transition-metal-benzene complexes with maximally localized Wannier functions | Weng, Hongming; Ozaki, Taisuke; Terakura, Kiyoyuki |
8-Dec-2009 | First-principles calculation of the electronic properties of graphene clusters doped with nitrogen and boron: Analysis of catalytic activity for the oxygen reduction reaction | Huang, Sheng-Feng; Terakura, Kiyoyuki; Ozaki, Taisuke; Ikeda, Takashi; Boero, Mauro; Oshima, Masaharu; Ozaki, Jun-ichi; Miyata, Seizo |
7-Sep-2010 | Phase diagram of LaVO_3 under epitaxial strain: Implications for thin films grown on SrTiO_3 and LaAlO_3 substrates | Weng, Hongming; Terakura, Kiyoyuki |
17-Oct-2016 | Novel mixture model for the representation of potential energy surfaces | Pham, Tien Lam; Kino, Hiori; Terakura, Kiyoyuki; Miyake, Takashi; Dam, Hieu Chi |
26-Oct-2017 | Machine learning reveals orbital interaction in materials | Pham, Tien Lam; Kino, Hiori; Terakura, Kiyoyuki; Miyake, Takashi; Tsuda, Koji; Takigawa, Ichigaku; Dam, Hieu Chi |
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