Match comparison for Multipoles [step 20] (match type 30240)

Commits > Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 > 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 -2.020306832455779e+00 4.848905230108911e-07 -2.020307430191517e+00 9.411953492133307e-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: [foss2022a-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: [foss2023a-serial] -2.020306723575932e+00 1.972966061636328e-07 1.233103788522705e-01 PASS
foss_autotools: [foss2023a-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_autotools: [foss2023b-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
intel_autotools: [intel2023a-serial] -2.020306588622871e+00 3.322496664459607e-07 2.076560415287254e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.020306562354031e+00 3.585185073262664e-07 2.240740670789165e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.020306502610901e+00 4.182616368808567e-07 2.614135230505354e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -2.020308371386866e+00 -1.450514328205088e-06 -9.065714551281800e-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] -2.020306498996195e+00 4.218763431929062e-07 2.636727144955664e-01 PASS
foss_omp_autotools: [foss2023a-serial] -2.020307331422782e+00 -4.105502435791664e-07 -2.565939022369790e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -2.020306550244561e+00 3.706279771975574e-07 2.316424857484733e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.020306737967802e+00 1.829047362456038e-07 1.143154601535024e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.020306521049204e+00 3.998233335522627e-07 2.498895834701642e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -2.020306524701534e+00 3.961710035582655e-07 2.476068772239159e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.020306834911076e+00 8.596146150452455e-08 5.372591344032784e-02 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
foss_mpi_autotools: [foss2022a-mpi] -2.020306532265516e+00 3.886070221170712e-07 2.428793888231695e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.020306534821012e+00 3.860515258580222e-07 2.412822036612638e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -2.020306592109653e+00 3.287628844717005e-07 2.054768027948128e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.020306545447327e+00 3.754252113630230e-07 2.346407571018894e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -2.020306566785567e+00 3.540869708551497e-07 2.213043567844686e-01 PASS
foss_cmake_ceph: [foss2022a-mpi, foss-min-mpi] -2.020306488996168e+00 4.318763702215733e-07 2.699227313884833e-01 PASS
foss_cmake_ceph: [foss2023a-mpi, foss-min-mpi] -2.020306554519991e+00 3.663525474095763e-07 2.289703421309852e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.020307317223366e+00 -3.963508277138317e-07 -2.477192673211448e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -2.020306507896946e+00 4.129755919457523e-07 2.581097449660952e-01 PASS