#Input file for 'band2eps.' This data layout must be used, line-by-line. #number of atoms in a cell : natom 2 #minimum value, maximum value and number of tics of the vertical axe : min 0.0 max 600.0 ngrad 8 #Units : 1 for cm-1, 2 for THz : cunit 1 #Number of lines : nlines 7 #Description of the points in q space : qpoint_name gamma K X gamma L X W L #Number of q points for each line : nqline 10 10 10 10 10 10 11 #Scale factor for each line : scale 1.06066017 0.35355339 1.0 0.86602540 0.86602540 0.5 0.70710678 #COLOR DEFINITION : #put 1 in place of the atom you want to be colored in #red red 0 0 #green green 0 0 #blue blue 0 0 ############################################################## # This section is used only for regression testing of ABINIT # ############################################################## ## After modifying the following section, one might need to regenerate the pickle database with runtests.py -r #%% #%% [setup] #%% executable = band2eps #%% test_chain = tlw_4.abi, tlw_5.abi, tlw_6.abi, tlw_7.abi #%% no_check = yes #%% [files] #%% files_to_test = #%% tlw_7.out.eps, tolnlines= 5, tolabs= 0.000e+00, tolrel= 0.000e+00 #%% [paral_info] #%% max_nprocs = 1 #%% [extra_info] #%% authors = M. Royo #%% keywords = #%% description = Input file for 'band2eps.' This data layout must be used, line-by-line. #%% topics = longwave #%%