Match comparison for PBE0 OEP Int[n*v_xc] (match type 12512)

Commits > Commit b27eded3d993de0343d6f1363463df82eb2e5c60 > Input 03-xc.pbe0_oep.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.500860700000000e-01 3.510000000000000e-06 -4.500828637500000e-01 7.806247515555823e-09 -4.500828700000000e-01 1.000000002249202e-08 PASS

Checks for this match

  • MPI builders have different values.
  • OpenMP builders have different values.
  • Intel® builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -0.45008607, precision: 0.00000351
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
intel_autotools: [intel2023a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
intel_omp_autotools: [intel2022a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-serial-full: [foss2023b-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -4.500828800000000e-01 3.189999999986259e-06 9.088319088279941e-01 PASS
foss-serial-full: [foss2023a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-serial-min: [foss2023a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -4.500828800000000e-01 3.189999999986259e-06 9.088319088279941e-01 PASS
foss-omp-full: [foss2023a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-serial-min: [foss2022a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-serial-min: [foss2023b-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -4.500828800000000e-01 3.189999999986259e-06 9.088319088279941e-01 PASS
foss-opt-full: [foss2023a-serial] -4.500828600000000e-01 3.210000000031243e-06 9.145299145388158e-01 PASS