Match comparison for Multipoles [step 83] (match type 30956)
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Input 23-td_qedft_breit_pxlda_adiabatic.03-td_restart.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 5.517961618581718e-04 | 1.400000000000000e-13 | 5.517961618638556e-04 | 8.432736392504023e-14 | 5.517961618581718e-04 | 1.269280362238556e-13 | PASS |
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Detailed information
Reference: 0.0005517961618581718, precision: 0.00000000000014| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | 5.517961617450623e-04 | -1.131095000647675e-13 | -8.079250004626249e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | 5.517961618444413e-04 | -1.373055315279093e-14 | -9.807537966279231e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 5.517961617759838e-04 | -8.218805410548091e-14 | -5.870575293248637e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 5.517961619308366e-04 | 7.266474748301999e-14 | 5.190339105929999e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 5.517961619217391e-04 | 6.356720705369412e-14 | 4.540514789549580e-01 | PASS |
| intel-serial: [intel2023a-serial] | 5.517961618729663e-04 | 1.479448074465095e-14 | 1.056748624617925e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | 5.517961619217391e-04 | 6.356720705369412e-14 | 4.540514789549580e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss-ppc: [foss2022a-serial] | 5.517961618993749e-04 | 4.120304358118387e-14 | 2.943074541513134e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | 5.517961619328828e-04 | 7.471096224315188e-14 | 5.336497303082277e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 5.517961617531895e-04 | -1.049823205798162e-13 | -7.498737184272583e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 5.517961617312439e-04 | -1.269279820137470e-13 | -9.066284429553356e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 5.517961617531895e-04 | -1.049823205798162e-13 | -7.498737184272583e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | 5.517961617368318e-04 | -1.213400040167567e-13 | -8.667143144054050e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 5.517961617531895e-04 | -1.049823205798162e-13 | -7.498737184272583e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 5.517961617312439e-04 | -1.269279820137470e-13 | -9.066284429553356e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 5.517961618873928e-04 | 2.922098327196032e-14 | 2.087213090854309e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 5.517961618268059e-04 | -3.136596885000564e-14 | -2.240426346428974e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 5.517961619850999e-04 | 1.269280904339642e-13 | 9.066292173854589e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 5.517961618063907e-04 | -5.178117049725595e-14 | -3.698655035518282e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 5.517961618368916e-04 | -2.128028656067649e-14 | -1.520020468619749e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 5.517961618991781e-04 | 4.100626088687775e-14 | 2.929018634776983e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 5.517961618276222e-04 | -3.054967303434131e-14 | -2.182119502452950e-01 | PASS |
| valgrind: [foss2023a-serial] | 5.517961617749529e-04 | -8.321891353108013e-14 | -5.944208109362866e-01 | PASS |