Match comparison for GGA 2D B86 MGC eigenvalue 2 up (libxc5) (match type 18445)

Commits > Commit 045d20dc05e1b42e239243cb04e8ce4d1aad770d > Input 02-xc_2d.gga_b86_mgc.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
9.398910000000000e-01 1.000000000000000e-04 2.861022484848485e+00 1.086756080389876e+01 3.263856050000000e+01 3.169866950000000e+01 FAIL

Checks for this match

  • MPI builders have different values.
  • OpenMP 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: 0.939891, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2022a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-min] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-serial: [intel2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023b-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-ppc: [foss2022a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-omp-full: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-debug: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2022a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-opt-full: [foss2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-full: [foss2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_autotools: [intel2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2022a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-debug: [foss2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-omp-full: [foss2023a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
valgrind: [foss2023a-serial] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 6.433723000000001e+01 6.339733900000000e+01 6.339733900000000e+05 FAIL
cuda-serial: [foss2022a-cuda-mpi] 9.398910000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS