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

Commits > Commit f4bc596bdcf3afff33b833944576bfd5457df1bc > 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 -1.207697472577012e-03 1.132019813137351e-06 -1.209014325426812e-03 2.213253530926329e-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] -1.207022322154472e-03 4.498306071750108e-06 5.304606216686448e-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: [foss2022a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss-serial-min: [foss2023a-serial] -1.207369550066020e-03 4.151078160201599e-06 4.895139339860377e-01 PASS
foss-serial-min: [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-opt-full: [foss2023a-serial] -1.208835305738704e-03 2.685322487518344e-06 3.166653876790499e-01 PASS
intel-serial: [intel2023a-serial] -1.207063797924138e-03 4.456830302084153e-06 5.255696110948294e-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
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] -1.206801071895885e-03 4.719556330336433e-06 5.565514540491077e-01 PASS
intel_omp_autotools: [intel2023a-serial] -1.207625528450398e-03 3.895099775823524e-06 4.593278037527741e-01 PASS
intel_omp_autotools: [intel2022a-serial] -1.206905980078915e-03 4.614648147306883e-06 5.441802060503399e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.207472655944480e-03 4.047972281741525e-06 4.773552219034817e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.207317344857739e-03 4.203283368482908e-06 4.956702085475127e-01 PASS
foss-omp-full: [foss2023a-serial] -1.208811838704527e-03 2.708789521695338e-06 3.194327266150162e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.206804685799728e-03 4.715942426493586e-06 5.561252861431115e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.206869915098122e-03 4.650713128100331e-06 5.484331518986240e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.206869915098122e-03 4.650713128100331e-06 5.484331518986240e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -1.207301295593960e-03 4.219332632261980e-06 4.975628104082523e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.206878621452856e-03 4.642006773365953e-06 5.474064591233435e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.206870077190808e-03 4.650551035413836e-06 5.484140371950278e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss-mpi-min: [foss2022a-mpi] -1.211227578957738e-03 2.930492684837752e-07 3.455769675516217e-02 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.206938516300313e-03 4.582111925909233e-06 5.403433874892963e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -1.207234442253624e-03 4.286185972597828e-06 5.054464590327628e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.206949470149848e-03 4.571158076373477e-06 5.390516599497025e-01 PASS