Match comparison for Benzene Energy [step 20] (match type 23475)

Commits > Commit 45adf9b0e5ec0c590d65885bc40efffc0d377767 > Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.744565859608992e+01 3.740000000000000e-13 -3.744565859608979e+01 1.148054354307002e-13 -3.744565859608994e+01 2.415845301584341e-13 PASS

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Detailed information

Reference: -37.44565859608992, precision: 0.000000000000374
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.744565859608971e+01 2.060573933704291e-13 5.509555972471365e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.744565859608971e+01 2.060573933704291e-13 5.509555972471365e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.744565859608976e+01 1.563194018672220e-13 4.179663151530001e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.744565859608973e+01 1.918465386552271e-13 5.129586595059547e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-serial-min: [foss2022a-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-serial-min: [foss2023a-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-serial-min: [foss2023b-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-opt-full: [foss2023a-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-serial-full: [foss2023b-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
foss-serial-full: [foss2023a-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
intel_autotools: [intel2023a-serial] -3.744565859609015e+01 -2.344791028008331e-13 -6.269494727295001e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.744565859608993e+01 -7.105427357601002e-15 -1.899846887059091e-02 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.744565859608978e+01 1.421085471520200e-13 3.799693774118182e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.744565859608993e+01 -7.105427357601002e-15 -1.899846887059091e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
foss-omp-full: [foss2023a-serial] -3.744565859608983e+01 9.237055564881302e-14 2.469800953176819e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.744565859608974e+01 1.776356839400250e-13 4.749617217647728e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.744565859608974e+01 1.776356839400250e-13 4.749617217647728e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.744565859609018e+01 -2.629008122312371e-13 -7.029433482118638e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.744565859608971e+01 2.060573933704291e-13 5.509555972471365e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.744565859608974e+01 1.776356839400250e-13 4.749617217647728e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.744565859608974e+01 1.776356839400250e-13 4.749617217647728e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.744565859608983e+01 9.237055564881302e-14 2.469800953176819e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.744565859608970e+01 2.202682480856311e-13 5.889525349883183e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.744565859608988e+01 3.552713678800501e-14 9.499234435295456e-02 PASS
foss-ppc: [foss2022a-serial] -3.744565859608986e+01 6.394884621840902e-14 1.709862198353182e-01 PASS