Match comparison for Exchange energy (match type 29032)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.014150150000000e+01 | 5.070000000000000e-07 | -1.014150141148148e+01 | 1.466591842852070e-07 | -1.014150165000000e+01 | 2.800000000746650e-07 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -10.1415015, precision: 0.000000507| Run | Value | Difference | Relative difference | Status |
| foss-ppc: [foss2022a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| intel-serial: [intel2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| valgrind: [foss2023a-serial] | -1.014150137000000e+01 | 1.300000000981072e-07 | 2.564102566037617e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -1.014150193000000e+01 | -4.300000000512227e-07 | -8.481262328426484e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -1.014150193000000e+01 | -4.300000000512227e-07 | -8.481262328426484e-01 | PASS |