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

Commits > Commit 18848dd43b1805cec78813204483223eec09e06c > Input 14-fullerene_unpacked.03-td-packed.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184094654954693e+02 5.150000000000000e-11 -3.184094654954716e+02 8.042295461648589e-12 -3.184094654954719e+02 1.693933882052079e-11 PASS
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Detailed information

Reference: -318.4094654954693, precision: 0.0000000000515
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.184094654954549e+02 1.438138497178443e-11 2.792501936268821e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184094654954549e+02 1.438138497178443e-11 2.792501936268821e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184094654954768e+02 -7.503331289626658e-12 -1.456957531966341e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184094654954729e+02 -3.581135388230905e-12 -6.953660948021174e-02 PASS
foss_min_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_min_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_autotools: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_mpi_min_autotools: [foss2022a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -3.785882071700417e-01 PASS
foss_debug_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_min_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184094654954605e+02 8.810729923425242e-12 1.710821344354416e-01 PASS
foss_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_opt_autotools: [foss2023a-serial] -3.184094654954605e+02 8.810729923425242e-12 1.710821344354416e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184094654954605e+02 8.810729923425242e-12 1.710821344354416e-01 PASS
intel_autotools: [intel2023a-serial] -3.184094654954738e+02 -4.490630090003833e-12 -8.719670077677345e-02 PASS
foss_mpi_min_autotools: [foss2023a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -3.785882071700417e-01 PASS
foss_omp_autotools: [foss2023a-serial] -3.184094654954627e+02 6.593836587853730e-12 1.280356619000724e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184094654954656e+02 3.694822225952521e-12 7.174412089228195e-02 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184094654954750e+02 -5.684341886080801e-12 -1.103755706035107e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184094654954775e+02 -8.242295734817162e-12 -1.600445773750905e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184094654954756e+02 -6.309619493549690e-12 -1.225168833698969e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184094654954795e+02 -1.017497197608463e-11 -1.975722713802842e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184094654954781e+02 -8.753886504564434e-12 -1.699783787294065e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184094654954678e+02 1.534772309241816e-12 2.980140406294789e-02 PASS
intel_omp_autotools: [intel2022a-serial] -3.184094654954766e+02 -7.332801033044234e-12 -1.423844860785288e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184094654954748e+02 -5.513811629498377e-12 -1.070643034854054e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184094654954770e+02 -7.673861546209082e-12 -1.490070203147394e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184094654954760e+02 -6.650680006714538e-12 -1.291394176061075e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184094654954760e+02 -6.707523425575346e-12 -1.302431733121426e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184094654954798e+02 -1.051603248924948e-11 -2.041948056164948e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184094654954654e+02 3.922195901395753e-12 7.615914371642238e-02 PASS