Input 15-electronic_system_restart.04-td_restart_part2.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run foss_cmake: [foss2022a-mpi, foss-min-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
Energy [step 0] | -1.060686608766763e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -2.486899575160351e-14 | PASS |
Energy [step 20] | -1.060637353666431e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -5.329070518200751e-15 | PASS |
Multipoles [step 0] | 8.448867216200202e-16 | -8.908015926463452e-16 | 4.090000000000000e-15 | 1.735688314266366e-15 | PASS |
Multipoles [step 20] | -1.265509664058060e-01 | -1.265509664057956e-01 | 1.310000000000000e-14 | -1.040834085586084e-14 | PASS |