mirror of https://github.com/abinit/abinit.git
54 lines
4.5 KiB
Plaintext
54 lines
4.5 KiB
Plaintext
BoltzTraP geometry file generated by ABINIT.
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0.0000000000E+00 0.3826500000E+01 0.3826500000E+01
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0.3826500000E+01 0.0000000000E+00 0.3826500000E+01
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0.3826500000E+01 0.3826500000E+01 0.0000000000E+00
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48
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1 0 0 0 1 0 0 0 1 ! symmetry rotation matrix isym = 1
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-1 0 0 0 -1 0 0 0 -1 ! symmetry rotation matrix isym = 2
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0 0 1 -1 -1 -1 1 0 0 ! symmetry rotation matrix isym = 3
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0 0 -1 1 1 1 -1 0 0 ! symmetry rotation matrix isym = 4
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-1 -1 -1 0 0 1 0 1 0 ! symmetry rotation matrix isym = 5
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1 1 1 0 0 -1 0 -1 0 ! symmetry rotation matrix isym = 6
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0 1 0 1 0 0 -1 -1 -1 ! symmetry rotation matrix isym = 7
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0 -1 0 -1 0 0 1 1 1 ! symmetry rotation matrix isym = 8
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-1 -1 -1 0 1 0 0 0 1 ! symmetry rotation matrix isym = 9
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1 1 1 0 -1 0 0 0 -1 ! symmetry rotation matrix isym = 10
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0 1 0 -1 -1 -1 1 0 0 ! symmetry rotation matrix isym = 11
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0 -1 0 1 1 1 -1 0 0 ! symmetry rotation matrix isym = 12
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1 0 0 0 0 1 0 1 0 ! symmetry rotation matrix isym = 13
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-1 0 0 0 0 -1 0 -1 0 ! symmetry rotation matrix isym = 14
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0 0 1 1 0 0 -1 -1 -1 ! symmetry rotation matrix isym = 15
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0 0 -1 -1 0 0 1 1 1 ! symmetry rotation matrix isym = 16
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-1 -1 -1 0 1 0 1 0 0 ! symmetry rotation matrix isym = 17
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1 1 1 0 -1 0 -1 0 0 ! symmetry rotation matrix isym = 18
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0 1 0 -1 -1 -1 0 0 1 ! symmetry rotation matrix isym = 19
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0 -1 0 1 1 1 0 0 -1 ! symmetry rotation matrix isym = 20
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1 0 0 0 0 1 -1 -1 -1 ! symmetry rotation matrix isym = 21
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-1 0 0 0 0 -1 1 1 1 ! symmetry rotation matrix isym = 22
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0 0 1 1 0 0 0 1 0 ! symmetry rotation matrix isym = 23
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0 0 -1 -1 0 0 0 -1 0 ! symmetry rotation matrix isym = 24
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1 0 0 0 1 0 -1 -1 -1 ! symmetry rotation matrix isym = 25
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-1 0 0 0 -1 0 1 1 1 ! symmetry rotation matrix isym = 26
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0 0 1 -1 -1 -1 0 1 0 ! symmetry rotation matrix isym = 27
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0 0 -1 1 1 1 0 -1 0 ! symmetry rotation matrix isym = 28
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-1 -1 -1 0 0 1 1 0 0 ! symmetry rotation matrix isym = 29
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1 1 1 0 0 -1 -1 0 0 ! symmetry rotation matrix isym = 30
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0 1 0 1 0 0 0 0 1 ! symmetry rotation matrix isym = 31
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0 -1 0 -1 0 0 0 0 -1 ! symmetry rotation matrix isym = 32
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0 0 1 0 1 0 -1 -1 -1 ! symmetry rotation matrix isym = 33
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0 0 -1 0 -1 0 1 1 1 ! symmetry rotation matrix isym = 34
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1 0 0 -1 -1 -1 0 1 0 ! symmetry rotation matrix isym = 35
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-1 0 0 1 1 1 0 -1 0 ! symmetry rotation matrix isym = 36
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0 1 0 0 0 1 1 0 0 ! symmetry rotation matrix isym = 37
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0 -1 0 0 0 -1 -1 0 0 ! symmetry rotation matrix isym = 38
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-1 -1 -1 1 0 0 0 0 1 ! symmetry rotation matrix isym = 39
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1 1 1 -1 0 0 0 0 -1 ! symmetry rotation matrix isym = 40
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0 0 1 0 1 0 1 0 0 ! symmetry rotation matrix isym = 41
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0 0 -1 0 -1 0 -1 0 0 ! symmetry rotation matrix isym = 42
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1 0 0 -1 -1 -1 0 0 1 ! symmetry rotation matrix isym = 43
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-1 0 0 1 1 1 0 0 -1 ! symmetry rotation matrix isym = 44
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0 1 0 0 0 1 -1 -1 -1 ! symmetry rotation matrix isym = 45
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0 -1 0 0 0 -1 1 1 1 ! symmetry rotation matrix isym = 46
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-1 -1 -1 1 0 0 0 1 0 ! symmetry rotation matrix isym = 47
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1 1 1 -1 0 0 0 -1 0 ! symmetry rotation matrix isym = 48
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