Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 >
Run intel_mpi_omp_autotools: [intel2022a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| N_electrons [step 0] | 3.000000000000001e+00 | 3.000000000000000e+00 | 2.000000000000000e-07 | 8.881784197001252e-16 | PASS |
| N_electrons [step 500] | 2.319032832094391e+00 | 2.319032630881478e+00 | 3.060000000000000e-07 | 2.012129134421059e-07 | PASS |
| norm11 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 4.440892098500626e-16 | PASS |
| norm11 [step 500] | 8.562171996679381e-01 | 8.562172473301963e-01 | 7.470000000000000e-08 | -4.766225825125758e-08 | PASS |
| norm21 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 2.220446049250313e-16 | PASS |
| norm21 [step 500] | 9.153054958525795e-01 | 9.153054729587488e-01 | 2.520000000000000e-08 | 2.289383072007212e-08 | PASS |