Match comparison for MVORB HSE06 Fock Eigenvalue dn (match type 31635)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-5.422330000000000e-01 2.710000000000000e-05 -5.571459032258064e-01 5.300540879038514e-07 -5.571445000000000e-01 1.499999999987622e-06 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: -0.542233, precision: 0.0000271
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-cmake-zen4: [foss2023a-serial, foss-full] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-min: [foss2022a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-min: [foss2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2022a-serial, foss-min] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2022a-serial, foss-full] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
intel-serial: [intel2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-full: [foss2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-opt-full: [foss2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-min: [foss2023b-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-full: [foss2023b-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-ppc: [foss2022a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
intel_omp_autotools: [intel2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-omp-full: [foss2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2022a-mpi, foss-full-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-serial-debug: [foss2023a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
intel_omp_autotools: [intel2022a-serial] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2023a-mpi, foss-full-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-opt-full: [foss2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2023a-mpi, foss-min-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss_cmake: [foss2022a-mpi, foss-min-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-full: [foss2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
intel_mpi_autotools: [intel2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-min: [foss2022a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-debug: [foss2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-min: [foss2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
foss-mpi-omp-full: [foss2023a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
intel_mpi_omp_autotools: [intel2022a-mpi] -5.571460000000000e-01 -1.491300000000007e-02 -5.502952029520319e+02 FAIL
cuda-serial: [foss2022a-cuda-mpi] -5.571430000000001e-01 -1.491000000000009e-02 -5.501845018450217e+02 FAIL