Match comparison for Hartree energy (match type 30833)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
3.410202582500000e+01 | 8.660000000000000e-06 | 3.410202817705881e+01 | 5.024665941086721e-06 | 3.410202582500000e+01 | 7.875000001433818e-06 | PASS |
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Detailed information
Reference: 34.102025825, precision: 0.00000866Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-serial, foss-min] | 3.410202157000000e+01 | -4.255000000341624e-06 | -4.913394919563077e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 3.410201939000000e+01 | -6.434999995974522e-06 | -7.430715930686514e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, foss-full] | 3.410201962000000e+01 | -6.204999998260519e-06 | -7.165127018776580e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 3.410202363000000e+01 | -2.195000000426717e-06 | -2.534642032825308e-01 | PASS |
foss-serial-min: [foss2022a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss_autotools: [foss2022a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss_autotools: [foss2023a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss_autotools: [foss2023b-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss-serial-min: [foss2023a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss_cuda_autotools: [foss2022a-cuda-mpi] | 3.410202058000000e+01 | -5.244999996989463e-06 | -6.056581982666817e-01 | PASS |
intel_autotools: [intel2023a-serial] | 3.410203040000000e+01 | 4.574999998396834e-06 | 5.282909928864704e-01 | PASS |
foss_ppc_autotools: [foss2022a-serial] | 3.410201795000000e+01 | -7.875000001433818e-06 | -9.093533488953601e-01 | PASS |
foss_mpi_opt_autotools: [foss2023a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_mpi_autotools: [foss2023a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_mpi_autotools: [foss2022a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
intel_omp_autotools: [intel2022a-serial] | 3.410203142000000e+01 | 5.595000004632311e-06 | 6.460739035372184e-01 | PASS |
foss_mpi_debug_autotools: [foss2023a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_mpi_omp_autotools: [foss2023a-mpi] | 3.410203325000000e+01 | 7.424999999727788e-06 | 8.573903001995137e-01 | PASS |
foss-serial-min: [foss2023b-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss-opt-full: [foss2023a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | 3.410203066000000e+01 | 4.834999998593048e-06 | 5.583140875973497e-01 | PASS |
foss_cmake: [foss2022a-serial, foss-min] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | 3.410203370000000e+01 | 7.875000001433818e-06 | 9.093533488953601e-01 | PASS |
foss-omp-full: [foss2023a-serial] | 3.410203135000000e+01 | 5.524999998840485e-06 | 6.379907619908182e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | 3.410203225000000e+01 | 6.425000002252546e-06 | 7.419168593825111e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss-mpi-min: [foss2022a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss-mpi-min: [foss2023a-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | 3.410202571000000e+01 | -1.149999988570016e-07 | -1.327944559549672e-02 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 3.410202988000000e+01 | 4.055000005109832e-06 | 4.682448042852000e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 3.410202197000000e+01 | -3.854999995667185e-06 | -4.451501149731161e-01 | PASS |