Input 04-lithium.02-absorbing_boundaries.inp
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-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] | 2.319032814202681e+00 | 2.319032630881478e+00 | 3.060000000000000e-07 | 1.833212035506904e-07 | PASS |
| norm11 [step 0] | 1.000000000000001e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 6.661338147750939e-16 | PASS |
| norm11 [step 500] | 8.562173274567257e-01 | 8.562172473301963e-01 | 7.470000000000000e-08 | 8.012652941147280e-08 | FAIL |
| norm21 [step 0] | 1.000000000000000e+00 | 1.000000000000000e+00 | 1.300000000000000e-07 | 0.000000000000000e+00 | PASS |
| norm21 [step 500] | 9.153054699241999e-01 | 9.153054729587488e-01 | 2.520000000000000e-08 | -3.034548834435213e-09 | PASS |