Match comparison for Energy [step 20] (match type 30242)

Commits > Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 > Input 14-fullerene_unpacked.03-td-packed.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184094654954693e+02 3.380000000000000e-11 -3.184094654954729e+02 6.793846853074638e-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: [foss2022a-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: [foss2023a-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: [foss2023a-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_opt_autotools: [foss2023a-serial] -3.184094654954605e+02 8.810729923425242e-12 2.606724829415752e-01 PASS
intel_autotools: [intel2023a-serial] -3.184094654954738e+02 -4.490630090003833e-12 -1.328588784024803e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184094654954768e+02 -7.503331289626658e-12 -2.219920499889544e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184094654954687e+02 6.252776074688882e-13 1.849933749907953e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184094654954769e+02 -7.560174708487466e-12 -2.236738079434161e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -5.768429783803890e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184094654954711e+02 -1.762145984685048e-12 -5.213449658831504e-02 PASS
foss_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_omp_autotools: [foss2023a-serial] -3.184094654954627e+02 6.593836587853730e-12 1.950839227175659e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184094654954716e+02 -2.330580173293129e-12 -6.895207613293279e-02 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184094654954734e+02 -4.092726157978177e-12 -1.210865727212478e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184094654954782e+02 -8.924416761146858e-12 -2.640359988504988e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.184094654954766e+02 -7.332801033044234e-12 -2.169467761255690e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184094654954678e+02 1.534772309241816e-12 4.540746477046794e-02 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184094654954775e+02 -8.242295734817162e-12 -2.438549033969575e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -2.858988522585018e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184094654954773e+02 -7.958078640513122e-12 -2.354461136246486e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184094654954794e+02 -1.011812855722383e-11 -2.993529158941960e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184094654954775e+02 -8.242295734817162e-12 -2.438549033969575e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184094654954755e+02 -6.195932655828074e-12 -1.833116170363335e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184094654954781e+02 -8.810729923425242e-12 -2.606724829415752e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184094654954746e+02 -5.286437954055145e-12 -1.564034897649451e-01 PASS