Match comparison for Multipoles [step 0] (match type 30239)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
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 | -1.207652512489845e-03 | 1.132197763981577e-06 | -1.209002947875938e-03 | 2.224631081799988e-06 | PASS |
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Detailed information
Reference: -0.001211520628226222, precision: 0.00000848| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -1.208835305738704e-03 | 2.685322487518344e-06 | 3.166653876790499e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -1.208835305738704e-03 | 2.685322487518344e-06 | 3.166653876790499e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -1.207063797924138e-03 | 4.456830302084153e-06 | 5.255696110948294e-01 | PASS |
| foss_autotools: [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_mpi_min_autotools: [foss2023a-mpi] | -1.211227578957738e-03 | 2.930492684837752e-07 | 3.455769675516217e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -1.208811838704527e-03 | 2.708789521695338e-06 | 3.194327266150162e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | -1.206938831423379e-03 | 4.581796802842703e-06 | 5.403062267503187e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -1.207316229673239e-03 | 4.204398552983208e-06 | 4.958017161536801e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -1.211227578957738e-03 | 2.930492684837752e-07 | 3.455769675516217e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -1.206778316794138e-03 | 4.742311432083752e-06 | 5.592348386891216e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -1.207072598819997e-03 | 4.448029406224846e-06 | 5.245317696019866e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -1.206905980078915e-03 | 4.614648147306883e-06 | 5.441802060503399e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -1.207369550066020e-03 | 4.151078160201599e-06 | 4.895139339860377e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | -1.206846073040099e-03 | 4.674555186122637e-06 | 5.512447153446506e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -1.206814309999291e-03 | 4.706318226931289e-06 | 5.549903569494444e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -1.207625528450398e-03 | 3.895099775823524e-06 | 4.593278037527741e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -1.207583600842527e-03 | 3.937027383695219e-06 | 4.642720971338701e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -1.206862964333325e-03 | 4.657663892897396e-06 | 5.492528175586552e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -1.206918857527342e-03 | 4.601770698879843e-06 | 5.426616390188493e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -1.207170859410189e-03 | 4.349768816032601e-06 | 5.129444358529011e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -1.207302816143591e-03 | 4.217812082631328e-06 | 4.973835003102982e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -1.206870077190808e-03 | 4.650551035413836e-06 | 5.484140371950278e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -1.207017698006241e-03 | 4.502930219981100e-06 | 5.310059221675825e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -1.207127070739486e-03 | 4.393557486735917e-06 | 5.181081941905562e-01 | PASS |