Match comparison for Energy [step 0] (match type 30237)

Commits > Commit 91746b7e50d5ea0025b393f8233f16beebc5d069 > Input 14-fullerene_unpacked.02-td-unpacked.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.184216450128310e+02 1.570000000000000e-11 -3.184216450128290e+02 2.760913439478508e-12 -3.184216450128289e+02 5.314859663485549e-12 PASS

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Detailed information

Reference: -318.421645012831, precision: 0.0000000000157
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.184216450128318e+02 -8.526512829121202e-13 -5.430899891160001e-02 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.184216450128318e+02 -8.526512829121202e-13 -5.430899891160001e-02 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.184216450128293e+02 1.648459146963432e-12 1.049973978957600e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.184216450128280e+02 3.012701199622825e-12 1.918917961543200e-01 PASS
foss-serial-min: [foss2023a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.184216450128337e+02 -2.671640686457977e-12 -1.701681965896800e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184216450128337e+02 -2.671640686457977e-12 -1.701681965896800e-01 PASS
foss-serial-min: [foss2022a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss-serial-min: [foss2023b-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss-serial-full: [foss2023b-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss-opt-full: [foss2023a-serial] -3.184216450128337e+02 -2.671640686457977e-12 -1.701681965896800e-01 PASS
intel_autotools: [intel2023a-serial] -3.184216450128265e+02 4.490630090003833e-12 2.860273942677600e-01 PASS
foss-serial-full: [foss2023a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216450128262e+02 4.831690603168681e-12 3.077509938324001e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216450128272e+02 3.808509063674137e-12 2.425801951384800e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216450128296e+02 1.421085471520200e-12 9.051499818600002e-02 PASS
foss-serial-debug: [foss2023a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] -3.184216450128263e+02 4.718003765447065e-12 3.005097939775200e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.184216450128280e+02 3.012701199622825e-12 1.918917961543200e-01 PASS
foss-omp-full: [foss2023a-serial] -3.184216450128337e+02 -2.671640686457977e-12 -1.701681965896800e-01 PASS
foss_ppc_autotools: [foss2022a-serial] -3.184216450128264e+02 4.604316927725449e-12 2.932685941226401e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.184216450128283e+02 2.728484105318785e-12 1.737887965171200e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.184216450128283e+02 2.728484105318785e-12 1.737887965171200e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.184216450128272e+02 3.751665644813329e-12 2.389595952110400e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.184216450128306e+02 3.979039320256561e-13 2.534419949208000e-02 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.184216450128291e+02 1.875832822406664e-12 1.194797976055200e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.184216450128236e+02 7.389644451905042e-12 4.706779905672001e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.184216450128236e+02 7.389644451905042e-12 4.706779905672001e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] -3.184216450128342e+02 -3.240074875066057e-12 -2.063741958640800e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216450128306e+02 3.979039320256561e-13 2.534419949208000e-02 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184216450128258e+02 5.229594535194337e-12 3.330951933244801e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184216450128285e+02 2.501110429875553e-12 1.593063968073600e-01 PASS