[Wien] Band gap (TiC)

[U P Verma]

Any body can help me to find the band gap of TiC(supercell(2x2x2)) with
one carbon atom missing. Here is the input file Case.scf. 

Thanks in advance.

:POT  : POTENTIAL OPTION   14
:LAT  : LATTICE CONSTANTS= 16.71493 16.71493 16.71493    1.571    1.571
1.571
:VOL  : UNIT CELL VOLUME =    1167.49141


            ---------

       NUMBER OF ATOMS IN UNITCELL  =   4
       SUBSTANCE:
TiC                                                         

       LATTICE                      = F   


 NUMBER OF K-POINTS:          47
:GMA  : POTENTIAL AND CHARGE CUT-OFF  12.00 Ry**.5
         Bandranges (emin - emax):
:BAND   :  54    0.467191    0.522104
:BAND   :  55    0.467191    0.612125
:BAND   :  56    0.468139    0.612125
:BAND   :  57    0.516114    0.612125
:BAND   :  58    0.525543    0.616499
:BAND   :  59    0.534628    0.646338
:BAND   :  60    0.539765    0.649243
:BAND   :  61    0.643952    0.682006
:BAND   :  62    0.667820    0.740223
:BAND   :  63    0.677218    0.794857
:BAND   :  64    0.684624    0.813439
:BAND   :  65    0.773169    0.838471
:BAND   :  66    0.802812    0.846058
:BAND   :  67    0.802812    0.915662
:BAND   :  68    0.850223    0.921911
:BAND   :  69    0.859228    0.927612
        Energy to separate low and high energystates:    0.17792


:NOE  : NUMBER OF ELECTRONS          = 124.000

:FER  : F E R M I - ENERGY(TETRAH.M.)=   0.72312


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