Coordination Chemistry, Organometallic Chemistry

[4C3-38] Theoretical study on relationship between molecular structure, electronic state and electron conductivity of one-dimensional penta-nickel complex

Oral A

○KITAGAWA, Yasutaka; TADA, Hayato; ERA, Iori; FUJII, Takuya; IKENAGA, Kazuki; NAKANO, Masayoshi (Grad. Sch. Eng. Sci., Osaka Univ.)

PC Setting Time : 14:30 - 14:40

Keywords:one-dimensional complex、single-molecule electron conductivity、density functional theory (DFT)、elastic Green's function method