Time-dependent DFT calculations for bulk diamond

Sample directory: band/Diamond/

$ADFBIN/band << eor
TITLE DIAMOND 

ACCURACY 5
KSPACE 2

Dependency  Basis=1.e-6

UNITS
 LENGTH ANGSTROM
END

RESPONSE
nfreq    7
strtfr   0d0
endfr    7d-1
END

DEFINE
AAA=3.57
HA=AAA/2
END

LATTICE
0   HA  HA
HA  0   HA
HA  HA  0
END


ATOMS C
0.0   0.0   0.0
HA/2  HA/2  HA/2
END

BasisDefaults
BasisType DZ
End

END INPUT
eor