Match comparison for Hartree energy (match type 28370)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 1.729323236000000e+01 | 1.900000000000000e-06 | 1.729338338888889e+01 | 5.327562690340250e-04 | 1.729424903000000e+01 | 1.017949999999601e-03 | FAIL |
Checks for this match
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Detailed information
Reference: 17.293232359999998, precision: 0.0000019| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | 1.729323256000000e+01 | 2.000000023372195e-07 | 1.052631591248524e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | 1.729323401000000e+01 | 1.650000001518492e-06 | 8.684210534307855e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | 1.729323400000000e+01 | 1.640000004243802e-06 | 8.631578969704222e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | 1.729323255000000e+01 | 1.900000015098158e-07 | 1.000000007946399e-01 | PASS |
| foss-ppc: [foss2022a-serial] | 1.729323108000000e+01 | -1.279999995773551e-06 | -6.736842083018688e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | 1.729323229000000e+01 | -6.999999868639861e-08 | -3.684210457178874e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 1.729323230000000e+01 | -5.999999785899490e-08 | -3.157894624157626e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 1.729323348000000e+01 | 1.120000003851374e-06 | 5.894736862375650e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | 1.729323229000000e+01 | -6.999999868639861e-08 | -3.684210457178874e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | 1.729323194000000e+01 | -4.199999992238190e-07 | -2.210526311704311e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 1.729323224000000e+01 | -1.199999992707035e-07 | -6.315789435300183e-02 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 1.729323230000000e+01 | -5.999999785899490e-08 | -3.157894624157626e-02 | PASS |
| intel-serial: [intel2023a-serial] | 1.729323224000000e+01 | -1.199999992707035e-07 | -6.315789435300183e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 1.729323329000000e+01 | 9.300000023415578e-07 | 4.894736854429251e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 1.729323194000000e+01 | -4.199999992238190e-07 | -2.210526311704311e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 1.729323230000000e+01 | -5.999999785899490e-08 | -3.157894624157626e-02 | PASS |
| foss-serial-min: [foss2022a-serial] | 1.729526698000000e+01 | 2.034620000003429e-03 | 1.070852631580752e+03 | FAIL |
| valgrind: [foss2023a-serial] | 1.729323357000000e+01 | 1.210000004192580e-06 | 6.368421074697788e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 1.729526695000000e+01 | 2.034590000000946e-03 | 1.070836842105761e+03 | FAIL |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 1.729323175000000e+01 | -6.099999971809211e-07 | -3.210526300952217e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 1.729323170000000e+01 | -6.599999977652260e-07 | -3.473684198764347e-01 | PASS |