LCPQ/dft_tools
3
0
Fork 0
mirror of https://github.com/triqs/dft_tools synced 2024-12-23 12:55:17 +01:00
Code Issues Releases Wiki Activity
7771e415e7
dft_tools/test/plovasp/proj_group/two_site/EIGENVAL
Oleg E. Peil f86038a7fd Fixed tests to make them runnable with build pytriqs 
All imports inside the test cases refer now to paths relative
to TRIQS python library path. For example,

`import vaspio`

is replaced with

`import applications.dft.converters.plovasp.vasio`

In this way all tests can be executed wtih `build_pytriqs` provided
that the package is installed (the same practice as with other
'dft_tools' tests).

Also, the underscore can now be removed from subdirectory names
because there is no more conflict with module names.
2016-03-10 12:24:05 +01:00

279 lines
8.9 KiB
Plaintext
Raw Blame History

2 2 1 1
0.1333597E+02 0.2987800E-09 0.2987800E-09 0.2987800E-09 0.4000000E-15
1.000000000000000E-004
CAR
unknown system
22 8 32
0.0000000E+00 0.0000000E+00 0.0000000E+00 0.1250000E+00
1 -31.124884 1.000000
2 -31.124878 1.000000
3 -31.124878 1.000000
4 -30.472934 1.000000
5 -30.472928 1.000000
6 -30.472928 1.000000
7 -0.656314 1.000000
8 3.114520 1.000000
9 3.114525 1.000000
10 6.756068 1.000000
11 6.756069 1.000000
12 6.756069 1.000000
13 8.830520 0.000000
14 8.830529 0.000000
15 10.218786 0.000000
16 10.218786 0.000000
17 10.218786 0.000000
18 16.385691 0.000000
19 16.385692 0.000000
20 16.385692 0.000000
21 23.245996 0.000000
22 23.246002 0.000000
23 27.038148 0.000000
24 27.038149 0.000000
25 27.038149 0.000000
26 28.124403 0.000000
27 33.563563 0.000000
28 33.563565 0.000000
29 37.108469 0.000000
30 37.108972 0.000000
31 37.746820 0.000000
32 37.746821 0.000000
0.5000000E+00 0.0000000E+00 0.0000000E+00 0.1250000E+00
1 -30.987587 1.000000
2 -30.987263 1.000000
3 -30.789180 1.000000
4 -30.789176 1.000000
5 -30.788852 1.000000
6 -30.788842 1.000000
7 3.111116 1.000000
8 3.111169 1.000000
9 5.662667 1.000000
10 5.662887 1.000000
11 7.182529 0.344890
12 7.182531 0.344668
13 7.182759 0.321989
14 7.182761 0.321799
15 8.381554 0.000000
16 8.381831 0.000000
17 10.018479 0.000000
18 10.018734 0.000000
19 23.630034 0.000000
20 23.630166 0.000000
21 23.955328 0.000000
22 23.955328 0.000000
23 23.955361 0.000000
24 23.955363 0.000000
25 24.866032 0.000000
26 24.866034 0.000000
27 37.108139 0.000000
28 37.108570 0.000000
29 37.172305 0.000000
30 37.172305 0.000000
31 37.172382 0.000000
32 37.172385 0.000000
0.0000000E+00 0.5000000E+00 0.0000000E+00 0.1250000E+00
1 -30.987590 1.000000
2 -30.987260 1.000000
3 -30.789179 1.000000
4 -30.789174 1.000000
5 -30.788852 1.000000
6 -30.788845 1.000000
7 3.111118 1.000000
8 3.111167 1.000000
9 5.662669 1.000000
10 5.662885 1.000000
11 7.182528 0.344920
12 7.182529 0.344879
13 7.182761 0.321780
14 7.182761 0.321769
15 8.381556 0.000000
16 8.381829 0.000000
17 10.018477 0.000000
18 10.018736 0.000000
19 23.630036 0.000000
20 23.630165 0.000000
21 23.955326 0.000000
22 23.955327 0.000000
23 23.955364 0.000000
24 23.955365 0.000000
25 24.866031 0.000000
26 24.866035 0.000000
27 37.108139 0.000000
28 37.108570 0.000000
29 37.172305 0.000000
30 37.172306 0.000000
31 37.172382 0.000000
32 37.172383 0.000000
0.5000000E+00 0.5000000E+00 0.0000000E+00 0.1250000E+00
1 -31.432998 1.000000
2 -31.432995 1.000000
3 -30.770918 1.000000
4 -30.770590 1.000000
5 -30.481189 1.000000
6 -30.481187 1.000000
7 2.921350 1.000000
8 2.921365 1.000000
9 5.127233 1.000000
10 5.127236 1.000000
11 7.662587 0.000000
12 7.662591 0.000000
13 8.844080 0.000000
14 8.844193 0.000000
15 9.229038 0.000000
16 9.229338 0.000000
17 10.631838 0.000000
18 10.631840 0.000000
19 16.556217 0.000000
20 16.556271 0.000000
21 22.179203 0.000000
22 22.179206 0.000000
23 26.193076 0.000000
24 26.193177 0.000000
25 29.429252 0.000000
26 29.429256 0.000000
27 32.939216 0.000000
28 32.939348 0.000000
29 36.050785 0.000000
30 36.050786 0.000000
31 37.108389 0.000000
32 37.108820 0.000000
0.0000000E+00 0.0000000E+00 0.5000000E+00 0.1250000E+00
1 -30.987593 1.000000
2 -30.987269 1.000000
3 -30.789176 1.000000
4 -30.789174 1.000000
5 -30.788845 1.000000
6 -30.788842 1.000000
7 3.111115 1.000000
8 3.111168 1.000000
9 5.662672 1.000000
10 5.662892 1.000000
11 7.182529 0.344843
12 7.182531 0.344661
13 7.182759 0.321991
14 7.182760 0.321811
15 8.381553 0.000000
16 8.381831 0.000000
17 10.018473 0.000000
18 10.018728 0.000000
19 23.630037 0.000000
20 23.630169 0.000000
21 23.955328 0.000000
22 23.955329 0.000000
23 23.955362 0.000000
24 23.955363 0.000000
25 24.866030 0.000000
26 24.866032 0.000000
27 37.108139 0.000000
28 37.108570 0.000000
29 37.172304 0.000000
30 37.172306 0.000000
31 37.172383 0.000000
32 37.172384 0.000000
0.5000000E+00 0.0000000E+00 0.5000000E+00 0.1250000E+00
1 -31.432999 1.000000
2 -31.432999 1.000000
3 -30.770915 1.000000
4 -30.770581 1.000000
5 -30.481191 1.000000
6 -30.481191 1.000000
7 2.921355 1.000000
8 2.921363 1.000000
9 5.127234 1.000000
10 5.127235 1.000000
11 7.662588 0.000000
12 7.662588 0.000000
13 8.844083 0.000000
14 8.844200 0.000000
15 9.229033 0.000000
16 9.229329 0.000000
17 10.631839 0.000000
18 10.631839 0.000000
19 16.556220 0.000000
20 16.556270 0.000000
21 22.179203 0.000000
22 22.179204 0.000000
23 26.193075 0.000000
24 26.193180 0.000000
25 29.429254 0.000000
26 29.429255 0.000000
27 32.939216 0.000000
28 32.939348 0.000000
29 36.050785 0.000000
30 36.050785 0.000000
31 37.108389 0.000000
32 37.108820 0.000000
0.0000000E+00 0.5000000E+00 0.5000000E+00 0.1250000E+00
1 -31.433001 1.000000
2 -31.432998 1.000000
3 -30.770913 1.000000
4 -30.770584 1.000000
5 -30.481193 1.000000
6 -30.481189 1.000000
7 2.921352 1.000000
8 2.921366 1.000000
9 5.127233 1.000000
10 5.127236 1.000000
11 7.662586 0.000000
12 7.662590 0.000000
13 8.844084 0.000000
14 8.844198 0.000000
15 9.229031 0.000000
16 9.229331 0.000000
17 10.631838 0.000000
18 10.631840 0.000000
19 16.556218 0.000000
20 16.556272 0.000000
21 22.179202 0.000000
22 22.179206 0.000000
23 26.193077 0.000000
24 26.193178 0.000000
25 29.429252 0.000000
26 29.429257 0.000000
27 32.939216 0.000000
28 32.939348 0.000000
29 36.050785 0.000000
30 36.050786 0.000000
31 37.108389 0.000000
32 37.108820 0.000000
0.5000000E+00 0.5000000E+00 0.5000000E+00 0.1250000E+00
1 -30.950298 1.000000
2 -30.950295 1.000000
3 -30.950292 1.000000
4 -30.949973 1.000000
5 -30.949966 1.000000
6 -30.949964 1.000000
7 5.070353 1.000000
8 5.070354 1.000000
9 5.070356 1.000000
10 5.070492 1.000000
11 5.070494 1.000000
12 5.070494 1.000000
13 9.297921 0.000000
14 9.297929 0.000000
15 9.298221 0.000000
16 9.298232 0.000000
17 16.720886 0.000000
18 16.720888 0.000000
19 16.720891 0.000000
20 16.720994 0.000000
21 16.720997 0.000000
22 16.720997 0.000000
23 18.168424 0.000000
24 18.168545 0.000000
25 37.108915 0.000000
26 37.109346 0.000000
27 39.605307 0.000000
28 39.605309 0.000000
29 39.605310 0.000000
30 39.605331 0.000000
31 39.605331 0.000000
32 39.605333 0.000000
Reference in New Issue View Git Blame Copy Permalink