Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit ff858744384f796bd1ad65ff45f26dd2d219c42c >
Run foss_mpi_omp_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 2.999999999999999e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | -8.881784197001252e-16 | PASS |
| N_electrons [step 500] | 2.319032789062367e+00 | 2.319032630881478e+00 | 3.060000000000000e-07 | 1.581808888317937e-07 | PASS |
| norm11 [step 0] | 9.999999999999998e-01 | 1.000000000000000e+00 | 1.300000000000000e-07 | -2.220446049250313e-16 | PASS |
| norm11 [step 500] | 8.562172697999892e-01 | 8.562172473301963e-01 | 7.470000000000000e-08 | 2.246979291520290e-08 | PASS |
| norm21 [step 0] | 9.999999999999997e-01 | 1.000000000000000e+00 | 1.300000000000000e-07 | -3.330669073875470e-16 | PASS |
| norm21 [step 500] | 9.153054699039883e-01 | 9.153054729587488e-01 | 2.520000000000000e-08 | -3.054760444598514e-09 | PASS |