Match comparison for PBE0 Fock Int[n*v_xc] (match type 12506)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.236457000000000e-01 3.840000000000000e-06 -3.236477860000000e-01 2.787999999998014e-06 -3.236456950000000e-01 3.484999999997518e-06 PASS

Checks for this match

  • MPI builders have different values.
  • GPU builders have different values.
  • Intel® builders have different values.
    Zen 4 builders have different values.
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Detailed information

Reference: -0.3236457, precision: 0.00000384
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
intel_autotools: [intel2023a-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
foss-omp-full: [foss2023a-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
foss-serial-min: [foss2023b-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
foss-opt-full: [foss2023a-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
foss-serial-min: [foss2022a-serial] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.236491800000000e-01 -3.480000000000150e-06 -9.062500000000391e-01 PASS
cuda-mpi: [foss2022a-cuda-mpi] -3.236422100000000e-01 3.489999999994886e-06 9.088541666653350e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.236422100000000e-01 3.489999999994886e-06 9.088541666653350e-01 PASS