Match comparison for Hartree energy (match type 23213)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 2.484390760000000e+00 | 1.240000000000000e-07 | 2.484390734705882e+00 | 1.419098599414627e-08 | 2.484390760000000e+00 | 3.000000003972048e-08 | PASS |
Checks for this match
- OpenMP builders have different values.
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Detailed information
Reference: 2.48439076, precision: 0.000000124| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-full] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 2.484390740000000e+00 | -2.000000032253979e-08 | -1.612903251817725e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 2.484390790000000e+00 | 2.999999981767587e-08 | 2.419354824006119e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 2.484390740000000e+00 | -2.000000032253979e-08 | -1.612903251817725e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 2.484390730000000e+00 | -3.000000026176508e-08 | -2.419354859819765e-01 | PASS |