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著者:  "Terakura, Kiyoyuki"

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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 functionsWeng, 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 reactionHuang, 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 substratesWeng, Hongming; Terakura, Kiyoyuki
17-Oct-2016 Novel mixture model for the representation of potential energy surfacesPham, Tien Lam; Kino, Hiori; Terakura, Kiyoyuki; Miyake, Takashi; Dam, Hieu Chi
26-Oct-2017 Machine learning reveals orbital interaction in materialsPham, Tien Lam; Kino, Hiori; Terakura, Kiyoyuki; Miyake, Takashi; Tsuda, Koji; Takigawa, Ichigaku; Dam, Hieu Chi

 


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