Match comparison for MVORB HSE06 Fock Correlation (match type 23349)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.072237000000000e-01 2.180000000000000e-06 -2.072222674193548e-01 6.431322933285052e-07 -2.072239700000000e-01 1.819999999999600e-06 PASS

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: -0.2072237, precision: 0.00000218
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-min: [foss2022a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-min: [foss2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
intel-serial: [intel2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-full: [foss2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-opt-full: [foss2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-min: [foss2023b-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-full: [foss2023b-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-ppc: [foss2022a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-omp-full: [foss2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.072221500000000e-01 1.550000000016816e-06 7.110091743196403e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -2.072257900000000e-01 -2.089999999982384e-06 -9.587155963221944e-01 PASS