Input 15-electronic_system_restart.04-td_restart_part2.inp
Commits >
Commit 3d047708c1ab8d71894fb240c9b3cff2ecebd198 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 0] | -1.060686608766762e+01 | -1.060686608766760e+01 | 1.060000000000000e-13 | -2.131628207280301e-14 | PASS |
| Energy [step 20] | -1.060637353666431e+01 | -1.060637353666430e+01 | 1.060000000000000e-13 | -1.243449787580175e-14 | PASS |
| Multipoles [step 0] | 8.745504320728514e-16 | -8.908015926463452e-16 | 4.090000000000000e-15 | 1.765352024719197e-15 | PASS |
| Multipoles [step 20] | -1.265509664058049e-01 | -1.265509664057956e-01 | 1.310000000000000e-14 | -9.325873406851315e-15 | PASS |