Match comparison for Hartree energy (match type 29667)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 07-noncollinear.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.636231627000000e+01 2.630000000000000e-04 1.636250137315789e+01 2.209924312233117e-06 1.636250543000000e+01 6.190000000572127e-06 PASS

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Detailed information

Reference: 16.36231627, precision: 0.000263
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] 1.636249981000000e+01 1.835399999983167e-04 6.978707224270597e-01 PASS
cmake_foss_2022a_full_serial 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2022a_ppc 1.636249981000000e+01 1.835399999983167e-04 6.978707224270597e-01 PASS
spack_foss-2023a_serial_opt 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
cmake_foss_2022a_min_serial 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
cmake_foss_2022a_min_mpi 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
cmake_foss_2022a_full_mpi 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_foss-2022a_mpi 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_foss-2022a_mpi_min 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_foss-2022a_serial 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2022a_serial_min 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_serial 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_mpi_min 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_foss-2023a_mpi 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_foss-2023a_serial_min 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_mpi_opt 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_serial_debug 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023b_serial 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_serial_omp 1.636250268000000e+01 1.864099999977498e-04 7.087832699534212e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 1.636250268000000e+01 1.864099999977498e-04 7.087832699534212e-01 PASS
spack_foss-2023a_mpi_debug 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_intel-2022a_serial_omp 1.636250276000000e+01 1.864900000008163e-04 7.090874524745866e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
spack_foss-2023a_mpi_omp 1.636249924000000e+01 1.829699999973400e-04 6.957034220431179e-01 PASS
spack_intel-2023a_serial 1.636250055000000e+01 1.842799999991485e-04 7.006844106431500e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 1.636250055000000e+01 1.842799999991485e-04 7.006844106431500e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 1.636250276000000e+01 1.864900000008163e-04 7.090874524745866e-01 PASS
spack_intel-2023a_impi 1.636250055000000e+01 1.842799999991485e-04 7.006844106431500e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 1.636250134000000e+01 1.850700000005645e-04 7.036882129299030e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 1.636250095000000e+01 1.846800000002702e-04 7.022053231949437e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 1.636250055000000e+01 1.842799999991485e-04 7.006844106431500e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 1.636249924000000e+01 1.829699999973400e-04 6.957034220431179e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 1.636250043000000e+01 1.841599999998778e-04 7.002281368816645e-01 PASS
spack_intel-2023a_serial_omp 1.636250134000000e+01 1.850700000005645e-04 7.036882129299030e-01 PASS
spack_intel-2022a_impi_omp 1.636250347000000e+01 1.871999999991658e-04 7.117870722401742e-01 PASS
spack_foss-2022a_cuda_mpi_omp 1.636251162000000e+01 1.953499999984842e-04 7.427756653934762e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 1.636250347000000e+01 1.871999999991658e-04 7.117870722401742e-01 PASS
spack_foss-2022a_cuda_serial 1.636250422000000e+01 1.879500000008250e-04 7.146387832730987e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 1.636250422000000e+01 1.879500000008250e-04 7.146387832730987e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.636251162000000e+01 1.953499999984842e-04 7.427756653934762e-01 PASS