Match comparison for Born charge O XX w=0.0 (match type 22433)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 06-h2o_pol_lr.03_emresp.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.941120000000000e-01 2.470000000000000e-05 -4.941120000000000e-01 0.000000000000000e+00 -4.941120000000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: -0.494112, precision: 0.0000247
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_opt -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_ppc -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_min -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_opt -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_debug -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_mpi_omp -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp -4.941120000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS