Match comparison for Dipole (match type 24578)

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Input 04-lithium.01-ground_state.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
0.000000000000000e+00 5.000000000000000e-06 -6.470913084745764e-07 7.572825187745889e-07 -4.260499999999995e-08 1.423805000000000e-06 PASS
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Detailed information

Reference: 0.0, precision: 0.000005
Run Value Difference Relative difference Status
GCI_foss_min_autotools: [foss2023a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
cmake_foss_2022a_full_serial -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_autotools: [foss2022a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_autotools: [foss2023b-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_serial_min -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_serial_min -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_serial -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_ppc 6.903240000000000e-07 6.903240000000000e-07 1.380648000000000e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 5.488360000000000e-07 5.488360000000000e-07 1.097672000000000e-01 PASS
spack_foss-2023a_serial -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
cmake_foss_2022a_min_mpi -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_mpi_min -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_mpi_min -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 6.903240000000000e-07 6.903240000000000e-07 1.380648000000000e-01 PASS
cmake_foss_2022a_full_mpi -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
cmake_foss_2022a_min_serial -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_mpi_opt -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_serial_debug -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_mpi -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_mpi -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_mpi_debug -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_mpi_omp 3.123260000000000e-07 3.123260000000000e-07 6.246519999999999e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.435740000000000e-07 -2.435740000000000e-07 -4.871480000000000e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -4.873580000000000e-08 -4.873580000000000e-08 -9.747160000000000e-03 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023a_serial_opt -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 3.123260000000000e-07 3.123260000000000e-07 6.246519999999999e-02 PASS
spack_foss-2023a_serial_omp 3.123260000000000e-07 3.123260000000000e-07 6.246519999999999e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_foss-2023b_serial -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_intel-2023a_serial -4.873580000000000e-08 -4.873580000000000e-08 -9.747160000000000e-03 PASS
spack_intel-2022a_serial_omp 5.488360000000000e-07 5.488360000000000e-07 1.097672000000000e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -1.466410000000000e-06 -1.466410000000000e-06 -2.932819999999999e-01 PASS
spack_intel-2023a_serial_omp -1.466410000000000e-06 -1.466410000000000e-06 -2.932819999999999e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 6.292280000000000e-07 6.292280000000000e-07 1.258456000000000e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -4.873580000000000e-08 -4.873580000000000e-08 -9.747160000000000e-03 PASS
spack_intel-2023a_impi -4.873580000000000e-08 -4.873580000000000e-08 -9.747160000000000e-03 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 3.123260000000000e-07 3.123260000000000e-07 6.246519999999999e-02 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -1.147150000000000e-06 -1.147150000000000e-06 -2.294300000000000e-01 PASS
spack_intel-2022a_impi_omp 5.488360000000000e-07 5.488360000000000e-07 1.097672000000000e-01 PASS
spack_foss-2022a_cuda_serial 6.292280000000000e-07 6.292280000000000e-07 1.258456000000000e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 5.488360000000000e-07 5.488360000000000e-07 1.097672000000000e-01 PASS
spack_foss-2023a_valgrind 1.381200000000000e-06 1.381200000000000e-06 2.762400000000000e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.435740000000000e-07 -2.435740000000000e-07 -4.871480000000000e-02 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 4.161220000000000e-07 4.161220000000000e-07 8.322439999999999e-02 PASS