posted on 2024-09-06, 12:00authored byPengfei Yan, Guanqi Li, Zhihao Li, Yafei Zhao, Liang He
The k-point and cutoff energy testing, details of relaxed structures, CCD and AIMD simulation, unfolding bands of other 3d-TM-CrTe2, and bands difference of 3d-TM-CrTe2