Match comparison for Hartree energy (match type 30556)

Commits > Commit 968a3ff7080ffa1f89f08d37efc7416527769dec > Input 18-mgga.02-br89_oep.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.641734400000000e+00 1.920000000000000e-05 4.641740184516128e+00 5.385150933115929e-06 4.641734410000000e+00 1.746999999996390e-05 PASS
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Detailed information

Reference: 4.6417344, precision: 0.0000192
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_min_autotools: [foss2023a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_min_autotools: [foss2023b-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_min_autotools: [foss2022a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_opt_autotools: [foss2023a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_autotools: [foss2023a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_autotools: [foss2023b-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_autotools: [foss2022a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
intel_autotools: [intel2023a-serial] 4.641739450000000e+00 5.050000000395016e-06 2.630208333539071e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_omp_autotools: [foss2023a-serial] 4.641740230000000e+00 5.830000000095481e-06 3.036458333383063e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
intel_omp_autotools: [intel2023a-serial] 4.641747970000000e+00 1.357000000012931e-05 7.067708333400684e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
intel_omp_autotools: [intel2022a-serial] 4.641747920000000e+00 1.352000000043319e-05 7.041666666892284e-01 PASS
foss_debug_autotools: [foss2023a-serial] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 4.641745450000000e+00 1.105000000034551e-05 5.755208333513284e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.641739450000000e+00 5.050000000395016e-06 2.630208333539071e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 4.641739500000000e+00 5.100000000091143e-06 2.656250000047470e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 4.641716940000000e+00 -1.745999999958059e-05 -9.093749999781557e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 4.641740230000000e+00 5.830000000095481e-06 3.036458333383063e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 4.641751880000000e+00 1.748000000034722e-05 9.104166666847510e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] 4.641738290000000e+00 3.890000000339455e-06 2.026041666843466e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 4.641747910000000e+00 1.351000000049396e-05 7.036458333590605e-01 PASS