Match comparison for Hartree energy (match type 26101)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
4.244778686000000e+01 | 1.190000000000000e-06 | 4.244778712772727e+01 | 3.675339418466927e-07 | 4.244778742500000e+01 | 5.650000005630318e-07 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 42.44778686, precision: 0.00000119Run | Value | Difference | Relative difference | Status |
cuda-mpi-omp: [foss2022a-cuda-mpi] | 4.244778702000000e+01 | 1.599999990276046e-07 | 1.344537806954661e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 4.244778703000000e+01 | 1.699999998550084e-07 | 1.428571427353011e-01 | PASS |
foss-serial-min: [foss2022a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-serial-min: [foss2023b-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-serial-min: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-opt-full: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-serial-full: [foss2023b-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-serial-full: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_autotools: [intel2023a-serial] | 4.244778693000000e+01 | 6.999999868639861e-08 | 5.882352830789799e-02 | PASS |
foss-ppc: [foss2022a-serial] | 4.244778757000000e+01 | 7.100000019022445e-07 | 5.966386570607097e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | 4.244778686000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | 4.244778779000000e+01 | 9.299999987888441e-07 | 7.815126040242387e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | 4.244778699000000e+01 | 1.299999965453935e-07 | 1.092436945759609e-01 | PASS |
foss-omp-full: [foss2023a-serial] | 4.244778695000000e+01 | 9.000000034120603e-08 | 7.563025238756810e-02 | PASS |
intel_omp_autotools: [intel2022a-serial] | 4.244778701000000e+01 | 1.499999982002009e-07 | 1.260504186556310e-01 | PASS |
foss-mpi-full: [foss2023a-mpi] | 4.244778779000000e+01 | 9.299999987888441e-07 | 7.815126040242387e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 4.244778696000000e+01 | 1.000000011686097e-07 | 8.403361442740315e-02 | PASS |
foss-mpi-debug: [foss2023a-mpi] | 4.244778779000000e+01 | 9.299999987888441e-07 | 7.815126040242387e-01 | PASS |
foss-mpi-min: [foss2022a-mpi] | 4.244778702000000e+01 | 1.599999990276046e-07 | 1.344537806954661e-01 | PASS |
foss-mpi-min: [foss2023a-mpi] | 4.244778702000000e+01 | 1.599999990276046e-07 | 1.344537806954661e-01 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | 4.244778693000000e+01 | 6.999999868639861e-08 | 5.882352830789799e-02 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 4.244778799000000e+01 | 1.130000001126064e-06 | 9.495798328790450e-01 | PASS |