@article{oai:kanazawa-u.repo.nii.ac.jp:00059276, author = {斎藤, 峯雄 and Widianto, Muhammad Yusuf Hakim and Saito, Mineo}, issue = {3}, journal = {Japanese Journal of Applied Physics}, month = {Mar}, note = {We study band structures of group-V two-dimensional materials, i.e. phosphorene and bismuthene, by carrying out first-principles calculations including spin–orbit coupling (SOC). We propose a method to identify irreducible representations (IR) of both symmorphic and nonsymmorphic systems. We find for the α structures that all the non-SOC bands are doubly degenerated on the first Brillouin zone edge due to sticking or pairing of bands and that the SOC slightly splits the bands in most of the cases. We evaluate Z2 invariants based on identified IR. We find that the Z2 invariant of 1 in the case of β bismuthene is due to the strong SOC that reverses the highest occupied and the lowest unoccupied bands at the Γ point., Embargo Period 12 months, 金沢大学ナノマテリアル研究所 / 金沢大学理工研究域数物科学系}, title = {Analysis of band structures of phosphorene and bismuthene based on the double group theory}, volume = {61}, year = {2022} }