band structure calculation, error KPOINTS
Posted: Tue Jul 28, 2009 1:08 pm
Dear all,
Each time I try to perform a band structure calculation for an CFC type lattice, it stopps quickly and I get this error message :
Error reading KPOINTS file
the error occured at line: 2
My KPOINTS is as following :
k-points along high symmetry lines
10 ! 10 intersections
Line-mode
rec
0 0 0 ! gamma
0 0.5 0 ! X
0 0.5 0 ! X
0.25 0.25 0.25 ! L
0.25 0.25 0.25 ! L
0.25 0.5 0 ! W
So, does anyone know where the problem really comes from ?
Thanks in advance !
Each time I try to perform a band structure calculation for an CFC type lattice, it stopps quickly and I get this error message :
Error reading KPOINTS file
the error occured at line: 2
My KPOINTS is as following :
k-points along high symmetry lines
10 ! 10 intersections
Line-mode
rec
0 0 0 ! gamma
0 0.5 0 ! X
0 0.5 0 ! X
0.25 0.25 0.25 ! L
0.25 0.25 0.25 ! L
0.25 0.5 0 ! W
So, does anyone know where the problem really comes from ?
Thanks in advance !