Match comparison for PBE0 Fock Correlation (match type 12505)

Commits > Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d > Input 03-xc.pbe0_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.521371850000000e-01 3.100000000000000e-06 -2.521398477419354e-01 9.982685322313436e-07 -2.521372050000000e-01 2.825000000011846e-06 PASS

Checks for this match

  • GPU builders have different values.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -0.252137185, precision: 0.0000031
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-min: [foss2022a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-min: [foss2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
intel-serial: [intel2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-full: [foss2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-opt-full: [foss2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-min: [foss2023b-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-full: [foss2023b-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-ppc: [foss2022a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-omp-full: [foss2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.521400300000000e-01 -2.845000000029074e-06 -9.177419354932498e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -2.521343800000000e-01 2.804999999994617e-06 9.048387096756830e-01 PASS