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

Commits > Commit 705c4760eef009c58a165e8716adc8057257a566 > 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 -1.207750302351111e-03 1.142924824893306e-06 -1.209012626699132e-03 2.214952258605685e-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-zen4: [foss2023a-serial, foss-min] -1.208663349546196e-03 2.857278680025660e-06 3.369432405690637e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.208663349546196e-03 2.857278680025660e-06 3.369432405690637e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.207142542601097e-03 4.378085625124590e-06 5.162836822080884e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.207213604563023e-03 4.307023663198623e-06 5.079037338677621e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
foss-serial-min: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss-serial-min: [foss2022a-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-serial-min: [foss2023b-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss-serial-full: [foss2023b-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss-serial-full: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
intel-serial: [intel2023a-serial] -1.207063797924138e-03 4.456830302084153e-06 5.255696110948294e-01 PASS
foss-opt-full: [foss2023a-serial] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
foss-ppc: [foss2022a-serial] -1.206862964333325e-03 4.657663892897396e-06 5.492528175586552e-01 PASS
foss-serial-debug: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.206797674440527e-03 4.722953785695145e-06 5.569520973697104e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.206905980078915e-03 4.614648147306883e-06 5.441802060503399e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.206844261104068e-03 4.676367122154407e-06 5.514583870465103e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.207625528450398e-03 3.895099775823524e-06 4.593278037527741e-01 PASS
foss-omp-full: [foss2023a-serial] -1.208811838704527e-03 2.708789521695338e-06 3.194327266150162e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.208509458182377e-03 3.011170043844486e-06 3.550908070571328e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.206883369704592e-03 4.637258521629712e-06 5.468465237770886e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.206869915098122e-03 4.650713128100331e-06 5.484331518986240e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.206869915098122e-03 4.650713128100331e-06 5.484331518986240e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.206870077190808e-03 4.650551035413836e-06 5.484140371950278e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.207160083250905e-03 4.360544975316955e-06 5.142152093534145e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss-mpi-debug: [foss2023a-mpi] -1.208171429949681e-03 3.349198276540949e-06 3.949526269505836e-01 PASS
foss-mpi-min: [foss2022a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.206895864741486e-03 4.624763484735667e-06 5.453730524452437e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.207113214915442e-03 4.407413310779590e-06 5.197421357051404e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.206893080283891e-03 4.627547942330718e-06 5.457014082937167e-01 PASS