Match comparison for Born charge O ZZ w=0.0 (match type 22435)

Commits > Commit 4b7a334ce1857269604388697d6e11d007df5aba > Input 06-h2o_pol_lr.03_emresp.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-6.243400000000000e-01 3.120000000000000e-04 -6.243400000000000e-01 0.000000000000000e+00 -6.243400000000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: -0.62434, precision: 0.000312
Run Value Difference Relative difference Status
foss-2022a_ppc -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_opt -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_serial -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_omp -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b_impi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_impi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_mpi_omp -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a_mpi_omp -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_debug -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6 -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_opt -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp_impi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_omp -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6_mpi -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi_debug -6.243400000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS