Input 01-casida.08-casida_restart.inp
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run foss-cmake-zen4: [foss2023a-mpi, foss-min-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 |
| 12th eps-diff E | 4.336083730000000e-01 | 4.336083730000000e-01 | 2.170000000000000e-08 | 0.000000000000000e+00 | PASS |
| 1st eps-diff f | 8.991405310000000e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 8.991405310000000e-22 | PASS |
| 7th eps-diff f | 4.376116650000000e-23 | 0.000000000000000e+00 | 1.000000000000000e-08 | 4.376116650000000e-23 | PASS |
| 12th eps-diff f | 8.439110820000000e-02 | 8.439110820000001e-02 | 4.220000000000000e-09 | -1.387778780781446e-17 | 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 | 4.333083390000000e-01 | 4.333083390000000e-01 | 2.170000000000000e-08 | 0.000000000000000e+00 | PASS |
| 1st Petersilka f | 1.031499620000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.031499620000000e-21 | PASS |
| 2nd Petersilka f | 1.031533710000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.031533710000000e-21 | PASS |
| 7th Petersilka f | 4.964738300000000e-02 | 4.964738300000000e-02 | 2.480000000000000e-08 | 0.000000000000000e+00 | PASS |
| 9th Petersilka f | 8.433271410000000e-02 | 8.433271410000000e-02 | 4.220000000000000e-11 | 0.000000000000000e+00 | PASS |
| 1st Casida E | 3.391867730000000e-01 | 3.391867730000000e-01 | 1.700000000000000e-08 | 0.000000000000000e+00 | PASS |
| 2nd Casida E | 3.537266420000000e-01 | 3.537266420000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
| 3rd Casida E | 3.738528370000000e-01 | 3.738528370000000e-01 | 1.870000000000000e-08 | 0.000000000000000e+00 | PASS |
| 1st Casida f | 2.632917340000000e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 2.632917340000000e-22 | PASS |
| 3rd Casida f | 7.663116400000000e-10 | 4.001630660000000e-10 | 4.270000000000000e-10 | 3.661485739999999e-10 | PASS |
| 9th Casida f | 1.345989740000000e-01 | 1.345989740000000e-01 | 6.730000000000000e-09 | 0.000000000000000e+00 | PASS |
| 1st TDA E | 3.425436220000000e-01 | 3.425436220000000e-01 | 1.710000000000000e-08 | 0.000000000000000e+00 | PASS |
| 2nd TDA E | 3.537266420000000e-01 | 3.537266420000000e-01 | 1.770000000000000e-08 | 0.000000000000000e+00 | PASS |
| 3rd TDA E | 3.744268630000000e-01 | 3.744268630000000e-01 | 1.870000000000000e-08 | 0.000000000000000e+00 | PASS |
| 1st TDA f | 3.106520730000000e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 3.106520730000000e-22 | PASS |
| 3rd TDA f | 6.824656520000000e-10 | 2.800000000000000e-10 | 5.000000000000000e-10 | 4.024656520000000e-10 | PASS |
| 9th TDA f | 1.325253010000000e-01 | 1.325253010000000e-01 | 6.630000000000000e-09 | 0.000000000000000e+00 | PASS |
| 1st eps-diff force 1 1 | -2.484990000000000e-01 | -2.484920000000000e-01 | 1.240000000000000e-05 | -7.000000000007001e-06 | PASS |
| 1st eps-diff force 1 2 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| 9th eps-diff force 1 1 | -2.698600000000000e-02 | -2.698200000000000e-02 | 1.350000000000000e-05 | -3.999999999997061e-06 | PASS |
| 1st Pet force 1 1 | -2.419290000000000e-01 | -2.419220000000000e-01 | 1.210000000000000e-05 | -7.000000000007001e-06 | PASS |
| 1st Pet force 1 2 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| 9th Pet force 1 1 | -2.333100000000000e-02 | -2.332700000000000e-02 | 1.170000000000000e-05 | -4.000000000000531e-06 | PASS |
| 1st TDA force 1 1 | -2.713000000000000e-01 | -2.712920000000000e-01 | 1.360000000000000e-05 | -8.000000000008001e-06 | PASS |
| 1st TDA force 1 2 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| 9th TDA force 1 1 | -2.446800000000000e-02 | -2.446400000000000e-02 | 1.220000000000000e-05 | -4.000000000000531e-06 | PASS |