Match comparison for Multipoles [step 83] (match type 29269)
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Input 23-td_qedft_breit_pxlda_adiabatic.03-td_restart.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.218975443429170e-04 | 3.000000000000000e-13 | 6.218975443296144e-04 | 1.254285175096333e-13 | 6.218975443488331e-04 | 2.228055522197903e-13 | PASS |
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Detailed information
Reference: 0.000621897544342917, precision: 0.0000000000003| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2022a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 6.218975442041908e-04 | -1.387262700547343e-13 | -4.624209001824475e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 6.218975442481705e-04 | -9.474658470981501e-14 | -3.158219490327167e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 6.218975445716387e-04 | 2.287216640042833e-13 | 7.624055466809443e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 6.218975444368745e-04 | 9.395750236868006e-14 | 3.131916745622669e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 6.218975445716387e-04 | 2.287216640042833e-13 | 7.624055466809443e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 6.218975443212334e-04 | -2.168360976884109e-14 | -7.227869922947032e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 6.218975445716387e-04 | 2.287216640042833e-13 | 7.624055466809443e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 6.218975443212334e-04 | -2.168360976884109e-14 | -7.227869922947032e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 6.218975443212334e-04 | -2.168360976884109e-14 | -7.227869922947032e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 6.218975444481741e-04 | 1.052570574103240e-13 | 3.508568580344133e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 6.218975442168033e-04 | -1.261137461822104e-13 | -4.203791539407013e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 6.218975445716387e-04 | 2.287216640042833e-13 | 7.624055466809443e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 6.218975443104193e-04 | -3.249776749786326e-14 | -1.083258916595442e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 6.218975443104193e-04 | -3.249776749786326e-14 | -1.083258916595442e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 6.218975444481741e-04 | 1.052570574103240e-13 | 3.508568580344133e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 6.218975441260276e-04 | -2.168894404352972e-13 | -7.229648014509908e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 6.218975443212334e-04 | -2.168360976884109e-14 | -7.227869922947032e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 6.218975443803523e-04 | 3.743522419136225e-14 | 1.247840806378742e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 6.218975443783449e-04 | 3.542782386900534e-14 | 1.180927462300178e-01 | PASS |
| foss_valgrind_autotools: [foss2023a-serial] | 6.218975442439697e-04 | -9.894732602711009e-14 | -3.298244200903670e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 6.218975444297714e-04 | 8.685435183564127e-14 | 2.895145061188042e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 6.218975444343692e-04 | 9.145212798850055e-14 | 3.048404266283352e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 6.218975442960681e-04 | -4.684891797418489e-14 | -1.561630599139496e-01 | PASS |