mirror of
https://github.com/triqs/dft_tools
synced 2024-08-17 01:31:44 +02:00
![Alexander Hampel](/assets/img/avatar_default.png)
* moved the plovasp C++ code to c++/triqs_dft_tools/converters/vasp * added global header triqs_dft_tools/triqs_dft_tools.hpp * python dir based on single cmakelist file * registered C++ tests for plovasp * corrected imports for py3 tests for plovasp * corrected block order in sigma_from_file and srvo3_Gloc * exchanged ref files for sigma_from_file, srvo3_Gloc, SrVO3.ref.h5 * moved vasp converter bash scripts from dir shells to bin dir
123 lines
6.2 KiB
Plaintext
123 lines
6.2 KiB
Plaintext
Automatically generated mesh
|
|
10
|
|
Reciprocal lattice
|
|
0.00000000000000 0.00000000000000 0.00000000000000 1
|
|
0.20000000000000 0.00000000000000 0.00000000000000 12
|
|
0.40000000000000 0.00000000000000 0.00000000000000 12
|
|
0.20000000000000 0.20000000000000 0.00000000000000 24
|
|
0.40000000000000 0.20000000000000 -0.00000000000000 24
|
|
0.20000000000000 0.20000000000000 0.20000000000000 8
|
|
-0.20000000000000 0.20000000000000 0.20000000000000 6
|
|
-0.40000000000000 0.40000000000000 0.20000000000000 24
|
|
-0.40000000000000 -0.40000000000000 0.20000000000000 8
|
|
-0.40000000000000 0.40000000000000 0.40000000000000 6
|
|
Tetrahedra
|
|
107 0.00133333333333
|
|
4 1 2 2 4
|
|
12 2 2 4 4
|
|
4 2 4 4 6
|
|
4 2 3 4 5
|
|
4 2 4 4 5
|
|
12 4 4 5 6
|
|
16 3 4 5 5
|
|
28 4 5 5 6
|
|
8 4 5 6 6
|
|
4 3 3 4 5
|
|
12 3 4 4 5
|
|
4 4 4 4 5
|
|
4 2 2 3 4
|
|
12 2 3 4 4
|
|
8 2 4 4 4
|
|
8 2 2 2 4
|
|
12 2 2 4 7
|
|
12 2 4 4 7
|
|
8 1 2 2 2
|
|
4 2 2 2 2
|
|
4 2 2 2 7
|
|
16 5 5 6 6
|
|
12 3 4 5 6
|
|
8 3 5 5 6
|
|
8 3 4 4 6
|
|
4 3 4 6 8
|
|
4 3 5 6 8
|
|
4 3 4 4 4
|
|
4 3 4 4 8
|
|
8 4 4 7 8
|
|
4 4 4 8 8
|
|
4 2 2 3 7
|
|
16 2 3 4 7
|
|
12 3 4 7 8
|
|
4 3 4 5 7
|
|
4 3 5 7 8
|
|
4 3 5 5 5
|
|
12 3 5 5 8
|
|
16 5 5 8 9
|
|
24 3 4 5 8
|
|
8 4 5 8 8
|
|
4 5 8 8 8
|
|
16 5 8 8 9
|
|
4 3 3 4 8
|
|
12 3 5 8 8
|
|
12 3 3 5 8
|
|
4 3 4 8 8
|
|
8 4 5 5 9
|
|
12 4 5 8 9
|
|
4 4 7 8 9
|
|
4 2 3 5 8
|
|
4 2 4 5 8
|
|
8 2 4 7 8
|
|
12 2 3 4 8
|
|
4 2 2 4 8
|
|
4 2 2 7 8
|
|
4 1 2 4 7
|
|
8 1 2 2 7
|
|
4 2 3 4 6
|
|
4 3 5 6 6
|
|
8 5 6 6 6
|
|
8 5 5 5 6
|
|
4 4 4 5 5
|
|
16 4 5 5 8
|
|
4 3 4 4 7
|
|
4 3 7 8 8
|
|
8 4 4 5 8
|
|
4 5 5 6 9
|
|
4 4 5 6 8
|
|
4 5 5 6 8
|
|
8 5 8 8 10
|
|
8 5 8 9 10
|
|
4 4 7 8 8
|
|
4 4 8 8 8
|
|
8 8 8 8 10
|
|
4 7 8 8 8
|
|
4 8 8 8 9
|
|
20 8 8 9 10
|
|
4 4 5 7 8
|
|
4 5 7 8 8
|
|
4 5 5 5 8
|
|
4 5 8 9 9
|
|
8 8 9 9 10
|
|
6 9 9 10 10
|
|
12 8 9 10 10
|
|
4 8 8 10 10
|
|
8 4 8 8 9
|
|
4 3 4 5 9
|
|
4 3 4 8 9
|
|
4 7 8 9 10
|
|
4 7 8 8 10
|
|
4 4 7 8 10
|
|
4 2 4 8 8
|
|
4 2 7 8 8
|
|
4 2 4 4 8
|
|
4 3 3 5 6
|
|
4 4 5 5 5
|
|
4 3 5 8 9
|
|
4 3 8 8 9
|
|
6 5 5 8 8
|
|
2 3 3 5 5
|
|
4 4 5 6 9
|
|
4 4 8 9 10
|
|
4 8 10 10 10
|
|
6 8 8 9 9
|
|
4 9 10 10 10
|
|
2 10 10 10 10
|