Match comparison for Dipole Moment x (match type 11818)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 16-scfinlcao_std.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
0.000000000000000e+00 1.000000000000000e-10 -2.131202456140352e-15 2.901956296915560e-14 -3.752000000000003e-16 4.778320000000000e-14 PASS
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Detailed information

Reference: 0.0, precision: 0.0000000001
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] -1.239190000000000e-14 -1.239190000000000e-14 -1.239190000000000e-04 PASS
cmake_foss_2022a_full_serial -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
spack_foss-2022a_ppc -1.239190000000000e-14 -1.239190000000000e-14 -1.239190000000000e-04 PASS
spack_foss-2023a_serial_opt -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
cmake_foss_2022a_min_serial -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
cmake_foss_2022a_min_mpi 2.257520000000000e-15 2.257520000000000e-15 2.257520000000000e-05 PASS
cmake_foss_2022a_full_mpi 3.018310000000000e-14 3.018310000000000e-14 3.018310000000000e-04 PASS
spack_foss-2022a_mpi 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
spack_foss-2022a_mpi_min 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
spack_foss-2022a_serial -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
GCI_foss_min_autotools: [foss2023a-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2022a_serial_min -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_serial -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_mpi_min 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
spack_foss-2023a_mpi 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
spack_foss-2023a_serial_min -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_mpi_opt 3.018310000000000e-14 3.018310000000000e-14 3.018310000000000e-04 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_serial_debug -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023b_serial -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_serial_omp 3.628860000000000e-14 3.628860000000000e-14 3.628860000000000e-04 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 3.628860000000000e-14 3.628860000000000e-14 3.628860000000000e-04 PASS
spack_foss-2023a_mpi_debug 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
GCI_foss_autotools: [foss2022a-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
GCI_foss_autotools: [foss2023a-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_intel-2022a_serial_omp -4.815840000000000e-14 -4.815840000000000e-14 -4.815840000000000e-04 PASS
GCI_foss_autotools: [foss2023b-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
spack_foss-2023a_mpi_omp 2.049300000000000e-14 2.049300000000000e-14 2.049300000000000e-04 PASS
spack_intel-2023a_serial 1.896460000000000e-14 1.896460000000000e-14 1.896460000000000e-04 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 3.018310000000000e-14 3.018310000000000e-14 3.018310000000000e-04 PASS
GCI_intel_autotools: [intel2023a-serial] 1.896460000000000e-14 1.896460000000000e-14 1.896460000000000e-04 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -4.815840000000000e-14 -4.815840000000000e-14 -4.815840000000000e-04 PASS
spack_intel-2023a_impi -2.188300000000000e-14 -2.188300000000000e-14 -2.188300000000000e-04 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.712180000000000e-14 -3.712180000000000e-14 -3.712180000000000e-04 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.177980000000000e-14 -3.177980000000000e-14 -3.177980000000000e-04 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -2.357960000000000e-14 -2.357960000000000e-14 -2.357960000000000e-04 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -2.188300000000000e-14 -2.188300000000000e-14 -2.188300000000000e-04 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 2.257520000000000e-15 2.257520000000000e-15 2.257520000000000e-05 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 4.740800000000000e-14 4.740800000000000e-14 4.740799999999999e-04 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 4.740800000000000e-14 4.740800000000000e-14 4.740799999999999e-04 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 3.018310000000000e-14 3.018310000000000e-14 3.018310000000000e-04 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 2.257520000000000e-15 2.257520000000000e-15 2.257520000000000e-05 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 1.913050000000000e-14 1.913050000000000e-14 1.913050000000000e-04 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 2.049300000000000e-14 2.049300000000000e-14 2.049300000000000e-04 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 3.018310000000000e-14 3.018310000000000e-14 3.018310000000000e-04 PASS
spack_intel-2023a_serial_omp -3.712180000000000e-14 -3.712180000000000e-14 -3.712180000000000e-04 PASS
spack_intel-2022a_impi_omp -1.980540000000000e-14 -1.980540000000000e-14 -1.980540000000000e-04 PASS
spack_foss-2022a_cuda_mpi_omp 4.528140000000000e-14 4.528140000000000e-14 4.528140000000000e-04 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -1.980540000000000e-14 -1.980540000000000e-14 -1.980540000000000e-04 PASS
spack_foss-2022a_cuda_serial 3.212710000000000e-14 3.212710000000000e-14 3.212710000000000e-04 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 3.212710000000000e-14 3.212710000000000e-14 3.212710000000000e-04 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 4.528140000000000e-14 4.528140000000000e-14 4.528140000000000e-04 PASS