Match comparison for Dipole y (match type 22770)

Commits > Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 > Input 08-benzene_supercell.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
6.211499999999999e-13 5.850000000000000e-12 -9.269273000000000e-13 1.982260207478173e-12 6.288649999999999e-13 5.310025000000000e-12 PASS

Checks for this match

  • GPU builders have different values.
  • Precision seems large and value close to zero. Should value be 0?
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 0.0000000000006211499999999999, precision: 0.00000000000585
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_min_autotools: [foss2022a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_min_autotools: [foss2023a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_min_autotools: [foss2023b-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_autotools: [foss2023a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_autotools: [foss2022a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_opt_autotools: [foss2023a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
intel_autotools: [intel2023a-serial] 1.994260000000000e-12 1.373110000000000e-12 2.347196581196581e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.471860000000000e-12 -2.093010000000000e-12 -3.577794871794871e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.471860000000000e-12 -2.093010000000000e-12 -3.577794871794871e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.471860000000000e-12 -2.093010000000000e-12 -3.577794871794871e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.471860000000000e-12 -2.093010000000000e-12 -3.577794871794871e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
foss_autotools: [foss2023b-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_omp_autotools: [foss2023a-serial] -1.494400000000000e-12 -2.115550000000000e-12 -3.616324786324786e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
intel_omp_autotools: [intel2022a-serial] 2.001080000000000e-12 1.379930000000000e-12 2.358854700854701e-01 PASS
intel_omp_autotools: [intel2023a-serial] 2.001080000000000e-12 1.379930000000000e-12 2.358854700854701e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 5.938890000000000e-12 5.317740000000000e-12 9.090153846153846e-01 PASS
foss_debug_autotools: [foss2023a-serial] -1.501110000000000e-12 -2.122260000000000e-12 -3.627794871794872e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -4.681160000000000e-12 -5.302310000000000e-12 -9.063777777777777e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.000460000000000e-12 1.379310000000000e-12 2.357794871794872e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.480800000000000e-12 -2.101950000000000e-12 -3.593076923076923e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.490420000000000e-12 -2.111570000000000e-12 -3.609521367521367e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] 3.483510000000000e-13 -2.727989999999999e-13 -4.663230769230768e-02 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -4.642620000000000e-12 -5.263770000000000e-12 -8.997897435897435e-01 PASS