Match comparison for Multipoles [step 52] (match type 29257)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 23-td_qedft_breit_pxlda_adiabatic.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.793333093268998e-03 1.000000000000000e-13 -3.793333093262291e-03 3.413585547351596e-14 -3.793333093271079e-03 7.076045478726645e-14 PASS

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Detailed information

Reference: -0.003793333093268998, precision: 0.0000000000001
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] -3.793333093269580e-03 -5.824334070592130e-16 -5.824334070592130e-03 PASS
cmake_foss_2022a_full_serial -3.793333093258216e-03 1.078174008406485e-14 1.078174008406485e-01 PASS
spack_foss-2022a_ppc -3.793333093269580e-03 -5.824334070592130e-16 -5.824334070592130e-03 PASS
spack_foss-2023a_serial_opt -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
cmake_foss_2022a_min_serial -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
cmake_foss_2022a_min_mpi -3.793333093200318e-03 6.867943713739777e-14 6.867943713739777e-01 PASS
cmake_foss_2022a_full_mpi -3.793333093258758e-03 1.023963899782210e-14 1.023963899782210e-01 PASS
spack_foss-2022a_mpi -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
spack_foss-2022a_mpi_min -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
spack_foss-2022a_serial -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2022a_serial_min -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_serial -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_mpi_min -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
spack_foss-2023a_mpi -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
spack_foss-2023a_serial_min -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_mpi_opt -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_foss_min_autotools: [foss2023b-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_serial_debug -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023b_serial -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_serial_omp -3.793333093213174e-03 5.582340145693365e-14 5.582340145693365e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -3.793333093213174e-03 5.582340145693365e-14 5.582340145693365e-01 PASS
spack_foss-2023a_mpi_debug -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss_autotools: [foss2023a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_intel-2022a_serial_omp -3.793333093257105e-03 1.189326415129699e-14 1.189326415129699e-01 PASS
GCI_foss_autotools: [foss2023b-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
spack_foss-2023a_mpi_omp -3.793333093314596e-03 -4.559850760865736e-14 -4.559850760865736e-01 PASS
spack_intel-2023a_serial -3.793333093299625e-03 -3.062697664923952e-14 -3.062697664923952e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -3.793333093299625e-03 -3.062697664923952e-14 -3.062697664923952e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -3.793333093257105e-03 1.189326415129699e-14 1.189326415129699e-01 PASS
spack_intel-2023a_impi -3.793333093303076e-03 -3.407864268556438e-14 -3.407864268556438e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -3.793333093257105e-03 1.189326415129699e-14 1.189326415129699e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -3.793333093246166e-03 2.283156302906875e-14 2.283156302906875e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -3.793333093258216e-03 1.078174008406485e-14 1.078174008406485e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -3.793333093303076e-03 -3.407864268556438e-14 -3.407864268556438e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -3.793333093200318e-03 6.867943713739777e-14 6.867943713739777e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -3.793333093200318e-03 6.867943713739777e-14 6.867943713739777e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -3.793333093200318e-03 6.867943713739777e-14 6.867943713739777e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -3.793333093258758e-03 1.023963899782210e-14 1.023963899782210e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -3.793333093200318e-03 6.867943713739777e-14 6.867943713739777e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -3.793333093266880e-03 2.118097364167681e-15 2.118097364167681e-02 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -3.793333093314596e-03 -4.559850760865736e-14 -4.559850760865736e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -3.793333093258758e-03 1.023963899782210e-14 1.023963899782210e-01 PASS
spack_intel-2023a_serial_omp -3.793333093257105e-03 1.189326415129699e-14 1.189326415129699e-01 PASS
spack_intel-2022a_impi_omp -3.793333093306446e-03 -3.744790935678033e-14 -3.744790935678033e-01 PASS
spack_foss-2022a_cuda_mpi_omp -3.793333093339215e-03 -7.021683581798221e-14 -7.021683581798221e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -3.793333093306446e-03 -3.744790935678033e-14 -3.744790935678033e-01 PASS
spack_foss-2023a_valgrind -3.793333093314067e-03 -4.506898326761544e-14 -4.506898326761544e-01 PASS
spack_foss-2022a_cuda_serial -3.793333093333433e-03 -6.443543615342051e-14 -6.443543615342051e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] -3.793333093322241e-03 -5.324300028641815e-14 -5.324300028641815e-01 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] -3.793333093235081e-03 3.391731340229853e-14 3.391731340229853e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.793333093341839e-03 -7.284147243713512e-14 -7.284147243713512e-01 PASS