Match comparison for Hartree energy (match type 25788)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
4.172762507000000e+01 | 2.090000000000000e-07 | 4.172762506899999e+01 | 9.073772476650965e-09 | 4.172762505500000e+01 | 2.500000206850927e-08 | PASS |
Checks for this match
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Detailed information
Reference: 41.72762507, precision: 0.000000209Run | Value | Difference | Relative difference | Status |
foss_cmake: [foss2022a-serial, foss-min] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_min_autotools: [foss2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_min_autotools: [foss2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_min_autotools: [foss2023b-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_opt_autotools: [foss2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_autotools: [foss2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_autotools: [foss2023b-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_autotools: [intel2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_autotools: [foss2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | 4.172762508000000e+01 | 1.000000082740371e-08 | 4.784689391102254e-02 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | 4.172762508000000e+01 | 1.000000082740371e-08 | 4.784689391102254e-02 | PASS |
foss_mpi_min_autotools: [foss2022a-mpi] | 4.172762508000000e+01 | 1.000000082740371e-08 | 4.784689391102254e-02 | PASS |
foss_mpi_min_autotools: [foss2023a-mpi] | 4.172762508000000e+01 | 1.000000082740371e-08 | 4.784689391102254e-02 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_debug_autotools: [foss2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_omp_autotools: [foss2023a-serial] | 4.172762503000000e+01 | -4.000000330961484e-08 | -1.913875756440901e-01 | PASS |
foss_mpi_opt_autotools: [foss2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_omp_autotools: [intel2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_omp_autotools: [intel2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_ppc_autotools: [foss2022a-serial] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
foss_mpi_autotools: [foss2022a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_mpi_autotools: [foss2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_mpi_debug_autotools: [foss2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_mpi_omp_autotools: [foss2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
foss_cuda_autotools: [foss2022a-cuda-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |