Input 15-electronic_system_restart.02-td_full.inp
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run GCI_intel_mpi_autotools: [intel2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766763e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -2.842170943040401e-14 | PASS |
Energy [step 20] | -1.060637353666431e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -8.881784197001252e-15 | PASS |
Multipoles [step 0] | 2.566544633070267e-15 | 6.744248104320451e-16 | 4.500000000000000e-15 | 1.892119822638222e-15 | PASS |
Multipoles [step 20] | -1.265509664058006e-01 | -1.265509664058023e-01 | 2.600000000000000e-15 | 1.693090112553364e-15 | PASS |