Match comparison for Hartree energy (match type 28447)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.857300972000000e+01 | 1.430000000000000e-07 | 2.902639961615385e+01 | 1.686867467562909e+00 | 3.262955407500000e+01 | 4.056544384999999e+00 | FAIL |
Checks for this match
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Detailed information
Reference: 28.573009719999998, precision: 0.000000143| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | 2.857300978000000e+01 | 6.000000141170858e-08 | 4.195804294525076e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | 2.857300970000000e+01 | -1.999999810209374e-08 | -1.398601265880681e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | 2.857300971000000e+01 | -9.999997274690031e-09 | -6.993005087195826e-02 | PASS |
| foss-serial-full: [foss2023a-serial] | 2.857300971000000e+01 | -9.999997274690031e-09 | -6.993005087195826e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | 2.857300971000000e+01 | -9.999997274690031e-09 | -6.993005087195826e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | 2.857300971000000e+01 | -9.999997274690031e-09 | -6.993005087195826e-02 | PASS |
| foss-ppc: [foss2022a-serial] | 2.857300977000000e+01 | 5.000000058430487e-08 | 3.496503537363977e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 2.857300969000000e+01 | -2.999999892949745e-08 | -2.097902023041780e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | 2.857300973000000e+01 | 1.000000082740371e-08 | 6.993007571610986e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| foss-serial-min: [foss2023b-serial] | 2.857300973000000e+01 | 1.000000082740371e-08 | 6.993007571610986e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | 2.857300971000000e+01 | -9.999997274690031e-09 | -6.993005087195826e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | 2.857300969000000e+01 | -2.999999892949745e-08 | -2.097902023041780e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 2.857300970000000e+01 | -1.999999810209374e-08 | -1.398601265880681e-01 | PASS |
| intel-serial: [intel2023a-serial] | 2.857300978000000e+01 | 6.000000141170858e-08 | 4.195804294525076e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 2.857300972000000e+01 | 3.552713678800501e-15 | 2.484415160000350e-08 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 2.857300974000000e+01 | 2.000000165480742e-08 | 1.398601514322197e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 2.857300970000000e+01 | -1.999999810209374e-08 | -1.398601265880681e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | 3.668609846000000e+01 | 8.113088739999998e+00 | 5.673488629370628e+07 | FAIL |
| foss-mpi-min: [foss2022a-mpi] | 3.224805824000000e+01 | 3.675048520000001e+00 | 2.569964000000000e+07 | FAIL |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 2.857300975000000e+01 | 3.000000248221113e-08 | 2.097902271483296e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 2.857300969000000e+01 | -2.999999892949745e-08 | -2.097902023041780e-01 | PASS |