Match comparison for Multipoles [step 100] (match type 29348)

Commits > Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 > Input 24-adsic_freeze_orbitals.02-td.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.612839439176902e+00 1.660000000000000e-13 -1.612839439177028e+00 2.906202160273182e-14 -1.612839439176968e+00 8.726352973553730e-14 PASS

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Detailed information

Reference: -1.6128394391769019, precision: 0.000000000000166
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -1.612839439177031e+00 -1.294520046712933e-13 -7.798313534415257e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -1.612839439177031e+00 -1.294520046712933e-13 -7.798313534415257e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -1.612839439177020e+00 -1.179056852151916e-13 -7.102752121397086e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -1.612839439177047e+00 -1.447730824111204e-13 -8.721270024766290e-01 PASS
foss-serial-min: [foss2023b-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss-serial-min: [foss2022a-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss-serial-min: [foss2023a-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -1.612839439177047e+00 -1.447730824111204e-13 -8.721270024766290e-01 PASS
foss-serial-full: [foss2023a-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss-opt-full: [foss2023a-serial] -1.612839439177047e+00 -1.447730824111204e-13 -8.721270024766290e-01 PASS
intel-serial: [intel2023a-serial] -1.612839439177038e+00 -1.363353874239692e-13 -8.212975146022242e-01 PASS
foss-serial-full: [foss2023b-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -1.612839439177010e+00 -1.085798118083403e-13 -6.540952518574717e-01 PASS
foss-ppc: [foss2022a-serial] -1.612839439176880e+00 2.153832667772804e-14 1.297489558899279e-01 PASS
foss-serial-debug: [foss2023a-serial] -1.612839439177032e+00 -1.301181384860683e-13 -7.838442077473997e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -1.612839439177017e+00 -1.147970607462412e-13 -6.915485587122963e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -1.612839439177017e+00 -1.147970607462412e-13 -6.915485587122963e-01 PASS
intel-omp: [intel2023a-serial] -1.612839439177037e+00 -1.352251643993441e-13 -8.146094240924341e-01 PASS
intel-omp: [intel2022a-serial] -1.612839439177046e+00 -1.438849039914203e-13 -8.667765300687970e-01 PASS
foss-omp-full: [foss2023a-serial] -1.612839439177036e+00 -1.345590305845690e-13 -8.105965697865600e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -1.612839439177017e+00 -1.147970607462412e-13 -6.915485587122963e-01 PASS
foss-mpi-full: [foss2023a-mpi] -1.612839439177010e+00 -1.085798118083403e-13 -6.540952518574717e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -1.612839439177050e+00 -1.481037514849959e-13 -8.921912740059993e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -1.612839439177050e+00 -1.481037514849959e-13 -8.921912740059993e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] -1.612839439177031e+00 -1.294520046712933e-13 -7.798313534415257e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -1.612839439177020e+00 -1.183497744250417e-13 -7.129504483436246e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -1.612839439177010e+00 -1.085798118083403e-13 -6.540952518574717e-01 PASS
foss-mpi-min: [foss2023a-mpi] -1.612839439177038e+00 -1.356692536091941e-13 -8.172846602963502e-01 PASS
foss-mpi-min: [foss2022a-mpi] -1.612839439177038e+00 -1.356692536091941e-13 -8.172846602963502e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -1.612839439177055e+00 -1.529887327933466e-13 -9.216188722490757e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -1.612839439177054e+00 -1.521005543736464e-13 -9.162683998412436e-01 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] -1.612839439177040e+00 -1.378896996584444e-13 -8.306608413159304e-01 PASS
valgrind: [foss2023a-serial] -1.612839439177014e+00 -1.119104808822158e-13 -6.741595233868420e-01 PASS