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

Commits > Commit 08a5f74afd5d598cfac916cc3bce9be78be030c2 > 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 -3.184094654954727e+02 8.114111075027230e-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-mpi, foss-full-mpi] -3.184094654954808e+02 -1.153921402874403e-11 -2.240624083251267e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184094654954549e+02 1.438138497178443e-11 2.792501936268821e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.184094654954549e+02 1.438138497178443e-11 2.792501936268821e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184094654954605e+02 8.810729923425242e-12 1.710821344354416e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184094654954712e+02 -1.875832822406664e-12 -3.642393829915853e-02 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184094654954605e+02 8.810729923425242e-12 1.710821344354416e-01 PASS
foss-serial-min: [foss2022a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss-serial-min: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss-serial-min: [foss2023b-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-opt-full: [foss2023a-serial] -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_autotools: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss_autotools: [foss2023b-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
foss-ppc: [foss2022a-serial] -3.184094654954775e+02 -8.242295734817162e-12 -1.600445773750905e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184094654954762e+02 -6.878053682157770e-12 -1.335544404302479e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.184094654954703e+02 -9.663381206337363e-13 -1.876384700259682e-02 PASS
intel_omp_autotools: [intel2023a-serial] -3.184094654954678e+02 1.534772309241816e-12 2.980140406294789e-02 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184094654954757e+02 -6.423306331271306e-12 -1.247243947819671e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.184094654954766e+02 -7.332801033044234e-12 -1.423844860785288e-01 PASS
foss-omp-full: [foss2023a-serial] -3.184094654954627e+02 6.593836587853730e-12 1.280356619000724e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184094654954764e+02 -7.048583938740194e-12 -1.368657075483533e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] -3.184094654954771e+02 -7.787548383930698e-12 -1.512145317268097e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] -3.184094654954793e+02 -9.947598300641403e-12 -1.931572485561437e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184094654954799e+02 -1.062971932697110e-11 -2.064023170285650e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184094654954799e+02 -1.062971932697110e-11 -2.064023170285650e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184094654954776e+02 -8.299139153677970e-12 -1.611483330811256e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -3.785882071700417e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184094654954785e+02 -9.208633855450898e-12 -1.788084243776873e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.184094654954888e+02 -1.949729266925715e-11 -3.785882071700417e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184094654954763e+02 -6.991740519879386e-12 -1.357619518423182e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184094654954773e+02 -7.958078640513122e-12 -1.545257988449150e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184094654954755e+02 -6.195932655828074e-12 -1.203093719578267e-01 PASS