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書誌情報	ファイル
First-principles study of bulk ordering and surface segregation in Pt-Rh binary alloys Yuge, K; Seko, A; Kuwabara, A; Oba, F; Tanaka, I (2006-11) PHYSICAL REVIEW B, 74(17)
General rule for displacive phase transitions in perovskite compounds revisited by first principles calculations Tohei, T; Kuwabara, A; Yamamoto, T; Oba, F; Tanaka, I (2005) PHYSICAL REVIEW LETTERS, 94(3)
Debye temperature and stiffness of carbon and boron nitride polymorphs from first principles calculations Tohei, T; Kuwabara, A; Oba, F; Tanaka, I (2006-02) PHYSICAL REVIEW B, 73(6)
Prediction of ground-state structures and order-disorder phase transitions in II-III spinel oxides: A combined cluster-expansion method and first-principles study Seko, A; Yuge, K; Oba, F; Kuwabara, A; Tanaka, I (2006-05) PHYSICAL REVIEW B, 73(18)
Ordering and segregation of a Cu75Pt25(111) surface: A first-principles cluster expansion study Yuge, K; Seko, A; Kuwabara, A; Oba, F; Tanaka, I (2007-07) PHYSICAL REVIEW B, 76(4)
General rule for displacive phase transitions in perovskite compounds revisited by first principles calculations Tohei, T; Kuwabara, A; Yamamoto, T; Oba, F; Tanaka, I (2005-01-28) Physical Review Letters, 94(3)
Prediction of ground-state structures and order-disorder phase transitions in II-III spinel oxides: A combined cluster-expansion method and first-principles study Seko, A; Yuge, K; Oba, F; Kuwabara, A; Tanaka, I (2006) PHYSICAL REVIEW B, 73(18)
First-principles study of bulk ordering and surface segregation in Pt-Rh binary alloys Yuge, K; Seko, A; Kuwabara, A; Oba, F; Tanaka, I (2006) PHYSICAL REVIEW B, 74(17)
Debye temperature and stiffness of carbon and boron nitride polymorphs from first principles calculations Tohei, T; Kuwabara, A; Oba, F; Tanaka, I (2006) PHYSICAL REVIEW B, 73(6)
First-principles study of defect equilibria in lithium zinc nitride Toyoura, K; Oba, F; Ninomiya, T; Kuwabara, A; Tanaka, I (2007) JOURNAL OF PHYSICS-CONDENSED MATTER, 19(4)