Input 09-angular_momentum.01-gs.inp
Commits >
Commit dbbd967b788cdda4a2df74a46ac2e5066a09d99b >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
SCF convergence | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
Initial energy | -2.319595787000000e+01 | -2.319595787000000e+01 | 1.160000000000000e-07 | 0.000000000000000e+00 | PASS |