Match comparison for Energy [step 20] (match type 30238)

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Input 14-fullerene_unpacked.02-td-unpacked.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184094654954693e+02 3.380000000000000e-11 -3.184094654954721e+02 7.152210847620794e-12 -3.184094654954746e+02 1.415401129634120e-11 PASS

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Detailed information

Reference: -318.4094654954693, precision: 0.0000000000338
Run Value Difference Relative difference Status
foss_cmake: [foss2022a-serial, foss-min] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_min_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_min_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_min_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
intel_autotools: [intel2023a-serial] -3.184094654954738e+02 -4.490630090003833e-12 -1.328588784024803e-01 PASS
foss_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_opt_autotools: [foss2023a-serial] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184094654954768e+02 -7.446487870765850e-12 -2.203102920344926e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184094654954761e+02 -6.821210263296962e-12 -2.018109545354131e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184094654954778e+02 -8.469669410260394e-12 -2.505819352148045e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184094654954665e+02 2.842170943040401e-12 8.408789772308878e-02 PASS
foss_omp_autotools: [foss2023a-serial] -3.184094654954627e+02 6.593836587853730e-12 1.950839227175659e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184094654954758e+02 -6.536993168992922e-12 -1.934021647631042e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184094654954769e+02 -7.617018127348274e-12 -2.253555658978779e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184094654954662e+02 3.126388037344441e-12 9.249668749539765e-02 PASS
intel_omp_autotools: [intel2023a-serial] -3.184094654954678e+02 1.534772309241816e-12 4.540746477046794e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.184094654954766e+02 -7.332801033044234e-12 -2.169467761255690e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184094654954775e+02 -8.242295734817162e-12 -2.438549033969575e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184094654954748e+02 -5.456968210637569e-12 -1.614487636283304e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184094654954716e+02 -2.330580173293129e-12 -6.895207613293279e-02 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184094654954749e+02 -5.627498467219993e-12 -1.664940374917158e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184094654954608e+02 8.526512829121202e-12 2.522636931692663e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184094654954788e+02 -9.492850949754938e-12 -2.808535783951165e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184094654954773e+02 -7.958078640513122e-12 -2.354461136246486e-01 PASS