Match comparison for Hartree energy (match type 30568)

Commits > Commit f8aeac8acec97cad57d0dc81a915c34dc5591a3a > Input 07-mgga.04-br89_gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.246899510000000e+00 2.120000000000000e-07 4.246899486666666e+00 1.626795812109505e-08 4.246899450000000e+00 4.999999969612645e-08 PASS

Checks for this match

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Detailed information

Reference: 4.24689951, precision: 0.000000212
Run Value Difference Relative difference Status
foss_cuda_autotools: [foss2022a-cuda-mpi] 4.246899400000000e+00 -1.100000002196566e-07 -5.188679255644180e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss_autotools: [foss2023a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
intel_autotools: [intel2023a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_autotools: [foss2022a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss_autotools: [foss2023b-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-serial-debug: [foss2023a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
intel_omp_autotools: [intel2022a-serial] 4.246899500000000e+00 -1.000000082740371e-08 -4.716981522360240e-02 PASS
intel_omp_autotools: [intel2023a-serial] 4.246899500000000e+00 -1.000000082740371e-08 -4.716981522360240e-02 PASS
foss_ppc_autotools: [foss2022a-serial] 4.246899500000000e+00 -1.000000082740371e-08 -4.716981522360240e-02 PASS
foss-serial-min: [foss2022a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_mpi_autotools: [foss2022a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-serial-min: [foss2023a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-serial-min: [foss2023b-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-opt-full: [foss2023a-serial] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-omp-full: [foss2023a-serial] 4.246899480000000e+00 -3.000000070585429e-08 -1.415094372917655e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 4.246899500000000e+00 -1.000000082740371e-08 -4.716981522360240e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-mpi-min: [foss2022a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS
foss-mpi-min: [foss2023a-mpi] 4.246899490000000e+00 -2.000000076662900e-08 -9.433962625768397e-02 PASS