Match comparison for Polarizability YY w=0.0 (match type 17682)

Commits > Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 > Input 02-h2o_pol_lr.02_h2o_dyn_pol.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.233363000000000e+01 6.170000000000000e-05 1.233362800000000e+01 3.552713678800501e-15 1.233362800000000e+01 0.000000000000000e+00 PASS
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Detailed information

Reference: 12.33363, precision: 0.0000617
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_serial_min 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_ppc 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_serial_opt 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023b_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_mpi_min 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_serial_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_intel-2022a_serial_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_mpi_opt 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_serial_debug 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_mpi 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
cmake_foss_2022a_full_mpi 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_mpi_debug 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_cuda_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_cuda_mpi_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_mpi_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
cmake_foss_2022a_min_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
cmake_foss_2022a_full_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
cmake_foss_2022a_min_mpi 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_intel-2023a_serial 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_mpi_min 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_intel-2022a_impi_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2022a_mpi 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_intel-2023a_serial_omp 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_intel-2023a_impi 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS
spack_foss-2023a_valgrind 1.233362800000000e+01 -2.000000000279556e-06 -3.241491086352603e-02 PASS