Match comparison for MVORB HSE06 Fock Total (match type 23351)

Commits > Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d > Input 03-xc.mvorb_hse06_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-7.874097100000000e-01 6.090000000000000e-06 -1.181777186129032e+00 8.834234799705253e-08 -1.181777420000000e+00 2.500000000349445e-07 FAIL

Checks for this match

  • GPU builders have different values.
  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -0.78740971, precision: 0.00000609
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-min: [foss2022a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-min: [foss2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2022a-serial, foss-min] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2022a-serial, foss-full] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
intel-serial: [intel2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-full: [foss2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-opt-full: [foss2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-min: [foss2023b-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-full: [foss2023b-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-ppc: [foss2022a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
intel_omp_autotools: [intel2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-omp-full: [foss2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-serial-debug: [foss2023a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
intel_omp_autotools: [intel2022a-serial] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-opt-full: [foss2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-full: [foss2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
intel_mpi_autotools: [intel2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-min: [foss2022a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-debug: [foss2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-min: [foss2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
foss-mpi-omp-full: [foss2023a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
intel_mpi_omp_autotools: [intel2022a-mpi] -1.181777170000000e+00 -3.943674599999999e-01 -6.475656157635466e+04 FAIL
cuda-serial: [foss2022a-cuda-mpi] -1.181777670000000e+00 -3.943679600000000e-01 -6.475664367816092e+04 FAIL