Match comparison for Multipoles [step 0] (match type 30239)

Commits > Commit 3874475d54e6d4931162c1a62f5667add8f8f561 > Input 14-fullerene_unpacked.02-td-unpacked.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.211520628226222e-03 8.480000000000000e-06 -1.207711603669670e-03 1.174937874662942e-06 -1.209041862634257e-03 2.185716323481468e-06 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: -0.001211520628226222, precision: 0.00000848
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
foss_min_autotools: [foss2023b-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
foss_min_autotools: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_min_autotools: [foss2022a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_autotools: [foss2023b-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_opt_autotools: [foss2023a-serial] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
foss_autotools: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_autotools: [foss2022a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
intel_autotools: [intel2023a-serial] -1.207063797924138e-03 4.456830302084153e-06 5.255696110948294e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.206856146310775e-03 4.664481915446711e-06 5.500568296517349e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.206954688216230e-03 4.565940009991715e-06 5.384363219329853e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.206858552957768e-03 4.662075268453908e-06 5.497730269403194e-01 PASS
foss_omp_autotools: [foss2023a-serial] -1.208811838704527e-03 2.708789521695338e-06 3.194327266150162e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -1.207060233366877e-03 4.460394859344624e-06 5.259899598283755e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -1.207033828909937e-03 4.486799316284979e-06 5.291036929581343e-01 PASS
foss_debug_autotools: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -1.207777530759416e-03 3.743097466806173e-06 4.414030031611053e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -1.206862964333325e-03 4.657663892897396e-06 5.492528175586552e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.207107502425850e-03 4.413125800372059e-06 5.204157783457617e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -1.206870077190808e-03 4.650551035413836e-06 5.484140371950278e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -1.206899184283988e-03 4.621443942233678e-06 5.449815969615186e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.207108766862405e-03 4.411861363816600e-06 5.202666702613915e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.207359978850298e-03 4.160649375924358e-06 4.906426150854196e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -1.207040282391034e-03 4.480345835188243e-06 5.283426692438966e-01 PASS