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 | 4.172762506366666e+01 | 8.359958161035745e-09 | 4.172762506000000e+01 | 1.000000082740371e-08 | PASS |
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Detailed information
Reference: 41.72762507, precision: 0.000000209| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 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: [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: [foss2023b-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_opt_autotools: [foss2023a-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 |
| foss_autotools: [foss2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 4.172762505000000e+01 | -2.000000165480742e-08 | -9.569378782204507e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 4.172762507000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 4.172762506000000e+01 | -1.000000082740371e-08 | -4.784689391102254e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-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 |