Input 01-casida.07-casida_elpa.inp
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_intel_mpi_autotools: [intel2023a-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 | 9.003886870000000e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 9.003886870000000e-22 | PASS |
7th eps-diff f | 4.381597260000000e-23 | 0.000000000000000e+00 | 1.000000000000000e-08 | 4.381597260000000e-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 | 1.032931510000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.032931510000000e-21 | PASS |
2nd Petersilka f | 1.032918680000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.032918680000000e-21 | 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 | 9.208112549999999e-22 | 0.000000000000000e+00 | 1.000000000000000e-08 | 9.208112549999999e-22 | PASS |
3rd Casida f | 1.970705490000000e-30 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.970705490000000e-30 | PASS |
9th Casida f | 4.597403580000000e-02 | 4.597269200000000e-02 | 9.310000000000000e-07 | 1.343799999997675e-06 | FAIL |
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 | 1.054543630000000e-21 | 0.000000000000000e+00 | 1.000000000000000e-08 | 1.054543630000000e-21 | PASS |
3rd TDA f | 2.597794340000000e-30 | 0.000000000000000e+00 | 1.000000000000000e-08 | 2.597794340000000e-30 | PASS |
9th TDA f | 4.588262000000000e-02 | 4.588124680000000e-02 | 9.510000000000000e-07 | 1.373200000001629e-06 | FAIL |