Match comparison for PBE0 Fock Eigenvalue up (match type 12503)

Commits > Commit 1d082993d3bad72c6bb5f6456239111dd26ba4bd > Input 03-xc.pbe0_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.024722000000000e+00 3.410000000000000e-05 -1.024740600000000e+00 2.480000000000260e-05 -1.024722000000000e+00 3.100000000000325e-05 PASS

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
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Detailed information

Reference: -1.0247220000000001, precision: 0.0000341
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
intel_autotools: [intel2023a-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
foss-omp-full: [foss2023a-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
foss-serial-min: [foss2023b-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
foss-opt-full: [foss2023a-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
foss-serial-min: [foss2022a-serial] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.024753000000000e+00 -3.099999999989222e-05 -9.090909090877485e-01 PASS
cuda-mpi: [foss2022a-cuda-mpi] -1.024691000000000e+00 3.100000000011427e-05 9.090909090942600e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.024691000000000e+00 3.100000000011427e-05 9.090909090942600e-01 PASS