Match comparison for Hartree energy (match type 23750)

Commits > Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 > Input 10-intersite.01-Na2.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.703058300000000e-01 2.350000000000000e-07 4.703058200000000e-01 0.000000000000000e+00 4.703058200000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: 0.47030583, precision: 0.000000235
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_min_autotools: [foss2022a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_min_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_min_autotools: [foss2023b-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_autotools: [foss2022a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_opt_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
intel_autotools: [intel2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_autotools: [foss2023b-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_omp_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_autotools: [foss2022a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
intel_omp_autotools: [intel2022a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
intel_omp_autotools: [intel2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_ppc_autotools: [foss2022a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_debug_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_valgrind_autotools: [foss2023a-serial] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 4.703058200000000e-01 -9.999999994736442e-09 -4.255319146696358e-02 PASS