Input 05-time_propagation.05-td_md.inp
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run foss_cmake: [foss2022a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Energy [step 1] | -3.791009280177393e+01 | -3.791009280177000e+01 | 1.900000000000000e-10 | -3.929301328753354e-12 | PASS |
| Energy [step 5] | -3.791008856892503e+01 | -3.791008856893000e+01 | 1.900000000000000e-10 | 4.966693722963100e-12 | PASS |
| Energy [step 10] | -3.791001520298094e+01 | -3.791001520298000e+01 | 1.900000000000000e-10 | -9.450218385609332e-13 | PASS |