Match comparison for Multipoles [step 83] (match type 30956)

Commits > Commit 584f61e8603689505e758f366f49c21c2e481def > Input 23-td_qedft_breit_pxlda_adiabatic.03-td_restart.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
5.517961618275108e-04 1.210000000000000e-13 5.517961618042175e-04 7.736538890712126e-14 5.517961618275108e-04 1.099807636455175e-13 PASS
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Detailed information

Reference: 0.0005517961618275108, precision: 0.000000000000121
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 5.517961618661694e-04 3.865852950257764e-14 3.194919793601458e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 5.517961617739427e-04 -5.356815251794655e-14 -4.427120042805501e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 5.517961617271905e-04 -1.003203596583457e-13 -8.290938814739318e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 5.517961619222810e-04 9.477022031717519e-14 7.832249612989686e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss-serial-min: [foss2023a-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss-serial-min: [foss2022a-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 5.517961619374916e-04 1.099808178556261e-13 9.089323789721164e-01 PASS
foss-serial-min: [foss2023b-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss_autotools: [foss2022a-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss_autotools: [foss2023a-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
intel_autotools: [intel2023a-serial] 5.517961619330924e-04 1.055815591205489e-13 8.725748687648670e-01 PASS
foss_autotools: [foss2023b-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
foss-opt-full: [foss2023a-serial] 5.517961619374916e-04 1.099808178556261e-13 9.089323789721164e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 5.517961617555479e-04 -7.196294341677012e-14 -5.947350695600837e-01 PASS
foss-serial-debug: [foss2023a-serial] 5.517961617327049e-04 -9.480589056864996e-14 -7.835197567657023e-01 PASS
intel_omp_autotools: [intel2022a-serial] 5.517961617175301e-04 -1.099807094354088e-13 -9.089314829372631e-01 PASS
intel_omp_autotools: [intel2023a-serial] 5.517961617175301e-04 -1.099807094354088e-13 -9.089314829372631e-01 PASS
foss-omp-full: [foss2023a-serial] 5.517961617459836e-04 -8.152723288135100e-14 -6.737787841433968e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 5.517961617461357e-04 -8.137511931655128e-14 -6.725216472442255e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 5.517961617555479e-04 -7.196294341677012e-14 -5.947350695600837e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 5.517961617461357e-04 -8.137511931655128e-14 -6.725216472442255e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] 5.517961617461357e-04 -8.137511931655128e-14 -6.725216472442255e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 5.517961619146681e-04 8.715727792263372e-14 7.203080820052374e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 5.517961618434159e-04 1.590502902992785e-14 1.314465209084947e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 5.517961618434159e-04 1.590502902992785e-14 1.314465209084947e-01 PASS
foss-mpi-min: [foss2022a-mpi] 5.517961618434159e-04 1.590502902992785e-14 1.314465209084947e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 5.517961617966483e-04 -3.086257378132062e-14 -2.550625932340548e-01 PASS
foss-mpi-min: [foss2023a-mpi] 5.517961618434159e-04 1.590502902992785e-14 1.314465209084947e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 5.517961617461357e-04 -8.137511931655128e-14 -6.725216472442255e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 5.517961618489789e-04 2.146807037695098e-14 1.774220692309998e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 5.517961618672371e-04 3.972625180204137e-14 3.283161305953832e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] 5.517961619224864e-04 9.497556820864395e-14 7.849220513111070e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 5.517961619125148e-04 8.500394398786026e-14 7.025119337839691e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 5.517961618754331e-04 4.792227812494554e-14 3.960518853301285e-01 PASS