Match comparison for Ionch [step 0] (match type 29473)
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 1.000000000000000e+00 | 1.000000000000000e-04 | 1.000000000000000e+00 | 1.170277822858900e-16 | 1.000000000000000e+00 | 2.775557561562891e-16 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 1.0, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| foss-ppc: [foss2022a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-serial-full: [foss2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 1.000000000000000e+00 | 2.220446049250313e-16 | 2.220446049250313e-12 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-serial-debug: [foss2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-serial-full: [foss2023b-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-opt-full: [foss2023a-serial] | 1.000000000000000e+00 | 2.220446049250313e-16 | 2.220446049250313e-12 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-serial: [intel2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-omp-full: [foss2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-serial-min: [foss2023a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-serial-min: [foss2023b-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-serial-min: [foss2022a-serial] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| valgrind: [foss2023a-serial] | 9.999999999999997e-01 | -3.330669073875470e-16 | -3.330669073875470e-12 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 9.999999999999999e-01 | -1.110223024625157e-16 | -1.110223024625157e-12 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | 1.000000000000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |