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

Commits > Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c > 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 -3.184216450128289e+02 2.695009073974717e-12 -3.184216450128287e+02 5.030642569181509e-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] -3.184216450128292e+02 1.762145984685048e-12 1.122385977506400e-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-serial-full: [foss2023b-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-serial-full: [foss2023a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
intel_autotools: [intel2023a-serial] -3.184216450128265e+02 4.490630090003833e-12 2.860273942677600e-01 PASS
foss-serial-min: [foss2022a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.184216450128337e+02 -2.671640686457977e-12 -1.701681965896800e-01 PASS
foss-serial-min: [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
foss-ppc: [foss2022a-serial] -3.184216450128264e+02 4.604316927725449e-12 2.932685941226401e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.184216450128287e+02 2.330580173293129e-12 1.484445970250400e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.184216450128279e+02 3.126388037344441e-12 1.991329960092000e-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_cmake: [foss2023a-mpi, foss-full-mpi] -3.184216450128270e+02 4.035882739117369e-12 2.570625948482401e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.184216450128328e+02 -1.762145984685048e-12 -1.122385977506400e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.184216450128263e+02 4.718003765447065e-12 3.005097939775200e-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
intel_mpi_autotools: [intel2023a-mpi] -3.184216450128323e+02 -1.307398633798584e-12 -8.327379833112002e-02 PASS
foss-mpi-min: [foss2022a-mpi] -3.184216450128236e+02 7.389644451905042e-12 4.706779905672001e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] -3.184216450128258e+02 5.229594535194337e-12 3.330951933244801e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -3.184216450128283e+02 2.671640686457977e-12 1.701681965896800e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.184216450128236e+02 7.389644451905042e-12 4.706779905672001e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.184216450128271e+02 3.922195901395753e-12 2.498213949933600e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.184216450128299e+02 1.080024958355352e-12 6.879139862136001e-02 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.184216450128285e+02 2.501110429875553e-12 1.593063968073600e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.184216450128296e+02 1.421085471520200e-12 9.051499818600002e-02 PASS