Input 07-octopus_basics-time_dependent_propagation.01-gs.inp
Commits >
Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a >
Run foss_cmake: [foss2023a-mpi, foss-full-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-02 | 0.000000000000000e+00 | PASS |
| Total Energy | -2.188704886500000e+02 | -2.188700363200000e+02 | 4.980000000000000e-04 | -4.523300000016661e-04 | PASS |