Match comparison for OEP Slater Int[n*v_xc] (match type 12522)

Commits > Commit 7a2379c5947d58fb2522a5e1a0c4903dfa35a523 > Input 03-xc.slater.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-5.057614699999999e-01 2.940000000000000e-05 -5.057347432000000e-01 1.489160833979573e-08 -5.057347450000000e-01 1.499999996434909e-08 PASS

Checks for this match

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

Reference: -0.5057614699999999, precision: 0.0000294
Run Value Difference Relative difference Status
spack_foss-2023a_mpi_debug -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2023a_mpi_omp -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
cmake_foss_2022a_min_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
cmake_foss_2022a_full_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
cmake_foss_2022a_min_mpi -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
cmake_foss_2022a_full_mpi -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_intel-2023a_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_intel-2022a_impi_omp -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_intel-2022a_serial_omp -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_intel-2023a_serial_omp -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_intel-2023a_impi -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2022a_serial_min -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_serial_min -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2022a_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_serial_opt -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023b_serial -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2022a_ppc -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_mpi_min -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2022a_mpi_min -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2023a_serial_omp -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_serial_debug -5.057347300000000e-01 2.673999999991405e-05 9.095238095208862e-01 PASS
spack_foss-2023a_mpi_opt -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2022a_mpi -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS
spack_foss-2023a_mpi -5.057347599999999e-01 2.670999999998536e-05 9.085034013600461e-01 PASS