Input 01-casida.06-casida_scalapack.inp
Commits >
Commit b7dcc99023940be2b83de00317ffa33e598f3f55 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
1st eps-diff E | 3.007001490000000e-01 | 3.007001490000000e-01 | 1.500000000000000e-08 | 0.000000000000000e+00 | PASS |
3rd eps-diff E | 3.537266430000000e-01 | 3.537266430000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
1st eps-diff f | 8.999667630000001e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 8.999667630000001e-22 | PASS |
7th eps-diff f | 4.377701590000000e-23 | 0.000000000000000e+00 | 1.000000000000000e-08 | 4.377701590000000e-23 | PASS |
1st Petersilka E | 3.449651910000000e-01 | 3.449651910000000e-01 | 1.720000000000000e-08 | 0.000000000000000e+00 | PASS |
2nd Petersilka E | 3.449651910000000e-01 | 3.449651910000000e-01 | 1.720000000000000e-08 | 0.000000000000000e+00 | PASS |
3rd Petersilka E | 3.537266420000000e-01 | 3.537266420000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
9th Petersilka E | 4.543886450000000e-01 | 4.543886450000000e-01 | 2.270000000000000e-08 | 0.000000000000000e+00 | PASS |
1st Petersilka f | 1.032449540000000e-21 | 7.552156500000000e-22 | 1.000000000000000e-08 | 2.772338899999999e-22 | PASS |
2nd Petersilka f | 1.032435380000000e-21 | 7.554436610000000e-22 | 1.000000000000000e-08 | 2.769917190000000e-22 | PASS |
7th Petersilka f | 4.964738300000000e-02 | 4.964738300000000e-02 | 2.480000000000000e-08 | 0.000000000000000e+00 | PASS |
9th Petersilka f | 4.974314900000000e-02 | 4.974314900000000e-02 | 2.490000000000000e-08 | 0.000000000000000e+00 | PASS |
1st Casida E | 3.421134150000000e-01 | 3.421134150000000e-01 | 1.710000000000000e-08 | 0.000000000000000e+00 | PASS |
2nd Casida E | 3.537266420000000e-01 | 3.537266420000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
3rd Casida E | 3.738606100000000e-01 | 3.738606100000000e-01 | 1.870000000000000e-07 | 0.000000000000000e+00 | PASS |
1st Casida f | 9.203788670000001e-22 | 0.000000000000000e+00 | 9.999999999999999e-22 | 9.203788670000001e-22 | PASS |
3rd Casida f | 4.855758170000000e-30 | 0.000000000000000e+00 | 1.000000000000000e-27 | 4.855758170000000e-30 | PASS |
9th Casida f | 4.597184550000000e-02 | 4.597269200000000e-02 | 1.720000000000000e-06 | -8.465000000054679e-07 | PASS |
1st TDA E | 3.449651910000000e-01 | 3.449651910000000e-01 | 1.720000000000000e-08 | 0.000000000000000e+00 | PASS |
2nd TDA E | 3.537266420000000e-01 | 3.537266420000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
3rd TDA E | 3.744336180000000e-01 | 3.744336180000000e-01 | 1.870000000000000e-08 | 0.000000000000000e+00 | PASS |
1st TDA f | 1.054050930000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.054050930000000e-21 | PASS |
3rd TDA f | 5.663130330000000e-30 | 0.000000000000000e+00 | 1.000000000000000e-08 | 5.663130330000000e-30 | PASS |
9th TDA f | 4.588038180000000e-02 | 4.588124680000000e-02 | 1.750000000000000e-06 | -8.649999999957303e-07 | PASS |