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Copy pathPOSCAR
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POSCAR
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graphene with soc
1.0
2.5 0 0
-2.1650635 1.25 0
0 0 10
C
4
Direct Coordinates and onsite energies
0.3333333 0.6666667 0.0 0
0.3333333 0.6666667 0.0 0
0.6666667 0.3333333 0.0 0
0.6666667 0.3333333 0.0 0
Hopping
30
origin(home) to destiny[cell] : amplify
0 ~ 2 [0,0,0] : 1.5
1 ~ 3 [0,0,0] : 1.5
0 ~ 2 [1,0,0] : 1.5
1 ~ 3 [1,0,0] : 1.5
0 ~ 2 [0,1,0] : 1.5
1 ~ 3 [0,1,0] : 1.5
0 ~ 0 [1,0,0] : 0.15i
1 ~ 1 [1,0,0] : -0.15i
0 ~ 0 [0,1,0] : -0.15i
1 ~ 1 [0,1,0] : 0.15i
0 ~ 0 [-1,1,0]: 0.15i
1 ~ 1 [-1,1,0]: -0.15i
0 ~ 0 [-1,0,0]: -0.15i
1 ~ 1 [-1,0,0]: 0.15i
0 ~ 0 [0,-1,0]: 0.15i
1 ~ 1 [0,-1,0]: -0.15i
0 ~ 0 [1,-1,0]: -0.15i
1 ~ 1 [1,-1,0]: 0.15i
2 ~ 2 [1,0,0] : -0.15i
3 ~ 3 [1,0,0] : 0.15i
2 ~ 2 [0,1,0] : 0.15i
3 ~ 3 [0,1,0] : -0.15i
2 ~ 2 [-1,1,0]: -0.15i
3 ~ 3 [-1,1,0]: 0.15i
2 ~ 2 [-1,0,0]: 0.15i
3 ~ 3 [-1,0,0]: -0.15i
2 ~ 2 [0,-1,0]: -0.15i
3 ~ 3 [0,-1,0]: 0.15i
2 ~ 2 [1,-1,0]: 0.15i
3 ~ 3 [1,-1,0]: -0.15i
KPath
4
0.0 0.0 0.0 21
0.33333 0.66667 0.0 21
0.00000 0.5 0.0 21
0.0 0.0 0.0 1
KMesh
20 20 1
WCC
Polar Direction:0 Integration step: 40 OCC: 2
WCCPath
2
0.0 0.0 0.0 21
0.0 1.0 0.0 1