Match comparison for Born charge O ZZ w=-0.2 (match type 17716)

Commits > Commit b27eded3d993de0343d6f1363463df82eb2e5c60 > Input 02-h2o_pol_lr.03_h2o_dyn_pol_cmplx.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.772797000000000e+00 8.860000000000000e-06 -1.772797000000000e+00 2.220446049250313e-16 -1.772797000000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: -1.772797, precision: 0.00000886
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023a-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2022a-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023b-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] -1.772797000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS