Match comparison for Born charge O ZZ w=0.0 (match type 17689)

Commits > Commit 968a3ff7080ffa1f89f08d37efc7416527769dec > Input 02-h2o_pol_lr.02_h2o_dyn_pol.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.192400000000000e-02 1.600000000000000e-05 -3.192399999999999e-02 1.387778780781446e-17 -3.192400000000000e-02 0.000000000000000e+00 PASS
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Detailed information

Reference: -0.031924, precision: 0.000016
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_min_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_min_autotools: [foss2023b-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_min_autotools: [foss2022a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_opt_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_autotools: [foss2023b-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_autotools: [foss2022a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_autotools: [intel2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_omp_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2022a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_debug_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_ppc_autotools: [foss2022a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_valgrind_autotools: [foss2023a-serial] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.192400000000000e-02 0.000000000000000e+00 0.000000000000000e+00 PASS