LWRITE_UNK = .TRUE. wannier90.win num_bands=12 num_wann=4 begin projections f=0.0,0.0,0.0:s f=0.0,0.0,0.5:s f=0.0,0.5,0.0:s f=0.5,0.0,0.0:s end projections WANNIER90计算: wannier90.win num_bands=12 num_wann=4 begin projections f=0.0,0.0,0.0:s f=0.0,0.0,0.5:s f=0.0,0.5,...
LWRITE_UNK = .TRUE.LWRITE_MMN_AMN=.TRUE.Win文件：write_xyz = .TRue.Guiding_centres = .TRue....
LWRITE_MMN_AMN=.TRUE. # 生成本征能量值和各轨道投影 LWRITE_UNK=.TRUE. # 生成UNK文件 你好，...
LWRITE_MMN_AMN=.TRUE. # 生成本征能量值和各轨道投影 LWRITE_UNK=.TRUE. # 生成UNK文件 是直接...