[Wien] Understanding case.irrep(so) output

Wen Fong Goh christopher_gohwf at hotmail.com
Fri Apr 22 02:46:05 CEST 2016


Hi, I want to calculate the band parity, so I executed x irrep -so, but I don't quite understand the output file irrepso. Have no luck searching the mailing list nor userguide. Here are some band indices at Gamma, what do the rest of the columns mean?

        47         2  0.302712    6  1    0  0    0  0    0  0 
        48         2  0.302712    6  1    0  0    0  0    0  0 
        49         4  0.321638   -8  2    0  0    0  0    0  0 
        50         4  0.321638   -8  2    0  0    0  0    0  0 


 		 	   		  
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