Match comparison for Multipoles [step 20] (match type 30240)
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Input 14-fullerene_unpacked.02-td-unpacked.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.020306920872538e+00 | 1.600000000000000e-06 | -2.020306851180806e+00 | 4.958025242451337e-07 | -2.020307428920427e+00 | 9.424664386692427e-07 | PASS |
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Detailed information
Reference: -2.020306920872538, precision: 0.0000016| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -2.020307345165826e+00 | -4.242932880593742e-07 | -2.651833050371089e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | -2.020306566947651e+00 | 3.539248867312494e-07 | 2.212030542070309e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | -2.020306701766813e+00 | 2.191057246747619e-07 | 1.369410779217262e-01 | PASS |
| foss_autotools: [foss2023b-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_autotools: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -2.020308371386866e+00 | -1.450514328205088e-06 | -9.065714551281800e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -2.020307331422782e+00 | -4.105502435791664e-07 | -2.565939022369790e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -2.020308371386866e+00 | -1.450514328205088e-06 | -9.065714551281800e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.020306614240447e+00 | 3.066320908295950e-07 | 1.916450567684969e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -2.020306502849667e+00 | 4.180228714290024e-07 | 2.612642946431265e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.020306511677654e+00 | 4.091948837547932e-07 | 2.557468023467457e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -2.020306834911076e+00 | 8.596146150452455e-08 | 5.372591344032784e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -2.020306506002874e+00 | 4.148696639560967e-07 | 2.592935399725604e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -2.020306555465923e+00 | 3.654066151881352e-07 | 2.283791344925845e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -2.020306521049204e+00 | 3.998233335522627e-07 | 2.498895834701642e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -2.020306723575932e+00 | 1.972966061636328e-07 | 1.233103788522705e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -2.020306502335685e+00 | 4.185368527309663e-07 | 2.615855329568539e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.020307335502633e+00 | -4.146300947027726e-07 | -2.591438091892329e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -2.020306486453989e+00 | 4.344185491333974e-07 | 2.715115932083734e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -2.020306507896946e+00 | 4.129755919457523e-07 | 2.581097449660952e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -2.020306553075634e+00 | 3.677969035997819e-07 | 2.298730647498637e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.020306520100066e+00 | 4.007724720977990e-07 | 2.504827950611244e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -2.020306551799544e+00 | 3.690729943883753e-07 | 2.306706214927345e-01 | PASS |