The Japan Society of Applied Physics

[PS-13-5] First-Principles Calculations for Diffusion Mechanism of Li Atom from Li(EC)4 to Interlayer of Graphite with Hydrogen/Carbonylic Edge Terminations

T. Kawai1,2, S. Okada2, M. Otani3 (1.NEC Corp., 2.Univ. of Tsukuba, 3.AIST(Japan))