Match comparison for Total energy (match type 25785)

Commits > Commit bb161c2d0107cec853e686df3a469ebc444968d7 > Input 18-TiO2.02-gs_kerker.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.840216667800000e+02 1.100000000000000e-07 -1.840216667516667e+02 1.213351426525040e-08 -1.840216667500000e+02 2.000000165480742e-08 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -184.02166678, precision: 0.00000011
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_min_autotools: [foss2023a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_min_autotools: [foss2023b-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_min_autotools: [foss2022a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_autotools: [foss2022a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_opt_autotools: [foss2023a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_cmake_mpi_min: [foss2023a-mpi] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
foss_cmake_mpi_min: [foss2022a-mpi] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
foss_autotools: [foss2023b-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
intel_autotools: [intel2023a-serial] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
foss_autotools: [foss2023a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
foss_omp_autotools: [foss2023a-serial] -1.840216667400000e+02 4.000000330961484e-08 3.636363937237713e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_debug_autotools: [foss2023a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.840216667300000e+02 5.000001124244591e-08 4.545455567495083e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.840216667500000e+02 2.999999537678377e-08 2.727272306980343e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.840216667600000e+02 2.000001586566214e-08 1.818183260514739e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.840216667700000e+02 1.000000793283107e-08 9.090916302573697e-02 PASS