Match comparison for Multipoles [step 20] (match type 30244)
Commits >
Commit 61d12a07bb2f18211cbe349e5d87c7e10e0bf297 >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-2.020306920872538e+00 | 1.600000000000000e-06 | -2.020306899158578e+00 | 4.758068656467881e-07 | -2.020307427405041e+00 | 9.439818255962962e-07 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -2.020306920872538, precision: 0.0000016Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.020307278201782e+00 | -3.573292444158938e-07 | -2.233307777599336e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, foss-full] | -2.020307278201782e+00 | -3.573292444158938e-07 | -2.233307777599336e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -2.020306507211355e+00 | 4.136611830851677e-07 | 2.585382394282298e-01 | PASS |
foss_cmake: [foss2022a-serial, foss-min] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
foss-serial-min: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
foss-serial-min: [foss2022a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -2.020306656026285e+00 | 2.648462533727525e-07 | 1.655289083579703e-01 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
foss-serial-min: [foss2023b-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
foss-serial-full: [foss2023b-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
foss-serial-full: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
intel_autotools: [intel2023a-serial] | -2.020306588622871e+00 | 3.322496664459607e-07 | 2.076560415287254e-01 | PASS |
foss-opt-full: [foss2023a-serial] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
foss-ppc: [foss2022a-serial] | -2.020306502335685e+00 | 4.185368527309663e-07 | 2.615855329568539e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.020306680549451e+00 | 2.403230867642492e-07 | 1.502019292276557e-01 | PASS |
foss-serial-debug: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
intel_omp_autotools: [intel2022a-serial] | -2.020306521049204e+00 | 3.998233335522627e-07 | 2.498895834701642e-01 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | -2.020306577436996e+00 | 3.434355422271551e-07 | 2.146472138919719e-01 | PASS |
intel_omp_autotools: [intel2023a-serial] | -2.020306834911076e+00 | 8.596146150452455e-08 | 5.372591344032784e-02 | PASS |
foss-omp-full: [foss2023a-serial] | -2.020307331422782e+00 | -4.105502435791664e-07 | -2.565939022369790e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.020306551241580e+00 | 3.696309578415935e-07 | 2.310193486509959e-01 | PASS |
foss-mpi-full: [foss2023a-mpi] | -2.020306759765567e+00 | 1.611069713192137e-07 | 1.006918570745086e-01 | PASS |
foss_cuda_autotools: [foss2022a-cuda-mpi] | -2.020306507896946e+00 | 4.129755919457523e-07 | 2.581097449660952e-01 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.020306505431042e+00 | 4.154414963153386e-07 | 2.596509351970866e-01 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.020306505431042e+00 | 4.154414963153386e-07 | 2.596509351970866e-01 | PASS |
foss-mpi-min: [foss2023a-mpi] | -2.020308371386866e+00 | -1.450514328205088e-06 | -9.065714551281800e-01 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | -2.020307033021260e+00 | -1.121487223088025e-07 | -7.009295144300154e-02 | PASS |
foss_mpi_debug_autotools: [foss2023a-mpi] | -2.020306705973507e+00 | 2.148990310146814e-07 | 1.343118943841759e-01 | PASS |
foss-mpi-min: [foss2022a-mpi] | -2.020308371386866e+00 | -1.450514328205088e-06 | -9.065714551281800e-01 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | -2.020306483423215e+00 | 4.374493229875043e-07 | 2.734058268671902e-01 | PASS |
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -2.020307089763439e+00 | -1.688909012642625e-07 | -1.055568132901641e-01 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | -2.020306755430853e+00 | 1.654416852403529e-07 | 1.034010532752205e-01 | PASS |