Input 05-lithium.02-td.inp
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -5.157407024886563e-01 | -5.157407024878778e-01 | 8.570000000000000e-13 | -7.784883848671598e-13 | PASS |
| Energy [step 5] | -5.157422641346725e-01 | -5.157422641338946e-01 | 8.560000000000000e-13 | -7.779332733548472e-13 | PASS |
| Energy [step 10] | -5.157439811346197e-01 | -5.157439811338429e-01 | 8.550000000000000e-13 | -7.768230503302220e-13 | PASS |
| Energy [step 15] | -5.157456625516766e-01 | -5.157456625509005e-01 | 8.540000000000000e-13 | -7.761569165154469e-13 | PASS |
| Energy [step 20] | -5.157472968421832e-01 | -5.157472968414080e-01 | 8.530000000000000e-13 | -7.752687380957468e-13 | PASS |
| Vector potential [step 1] | 1.000000000000000e+01 | 1.000000000000000e+01 | 1.000000000000000e-01 | 0.000000000000000e+00 | PASS |
| Vector potential [step 5] | 9.995809683997518e+00 | 9.995809683997477e+00 | 1.000000000000000e-13 | 4.085620730620576e-14 | PASS |
| Vector potential [step 10] | 9.983251615815687e+00 | 9.983251615815531e+00 | 1.770000000000000e-13 | 1.563194018672220e-13 | PASS |
| Vector potential [step 15] | 9.962362627886614e+00 | 9.962362627886289e+00 | 3.680000000000000e-13 | 3.250733016102458e-13 | PASS |
| Vector potential [step 20] | 9.933199018482794e+00 | 9.933199018482281e+00 | 5.880000000000000e-13 | 5.133671265866724e-13 | PASS |