Match comparison for gga_x_b88 Eigenvalue up (match type 12290)

Commits > Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 > Input 03-xc.gga_x_b88.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.712959999999999e-01 4.400000000000000e-05 -9.708629687499999e-01 2.619395057598878e-03 -9.638074999999999e-01 7.528499999999994e-03 FAIL

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.
  • Mid point of values far away from reference. Recentering may be necessary.
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Detailed information

Reference: -0.9712959999999999, precision: 0.000044
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-min: [foss2022a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-min: [foss2023b-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-min: [foss2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel_autotools: [intel2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-full: [foss2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-opt-full: [foss2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-full: [foss2023b-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-ppc: [foss2022a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel_omp_autotools: [intel2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-serial-debug: [foss2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel_omp_autotools: [intel2022a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-omp-full: [foss2023a-serial] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-full: [foss2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-min: [foss2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-min: [foss2022a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -9.562790000000000e-01 1.501699999999995e-02 3.412954545454534e+02 FAIL
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -9.712560000000000e-01 3.999999999992898e-05 9.090909090892950e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -9.713360000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS