[J403-2pm] 09. Coordination Chemistry, Organometallic Chemistry

[J403-2pm-04] Theoretical study on change in electronic state of cobalt(II) bathocuproine complex by halogen ligands.

^○Masahiro Tsuda¹, Keigo Cho², Naoka Amamizu², Taigo Kamimura², Yuta Hayashi¹, Keisuke Sasaki¹, Ryohei Kishi^2,4,3,5, Yasutaka Kitagawa^2,3,4,5, Masayoshi Nakano^2,3,4,5,6 (1. Faculty of Engineering Science, Osaka University, 2. Graduate School of Engineering Science, Osaka University, 3. Center for Spintronics Research Network, Osaka University, 4. Center for Quantum Information and Quantum Biology, 5. Osaka University Research Center for Solar Energy, Osaka University, 6. Innovative Catalysis Science Division (ICS), OTRI, Osaka University)

[Lang.] Japanese

Keywords:single molecular magnets, cobalt(II) bathocuproine complex, density functional theory(DFT) calculation, magnetic anisotropy