Match comparison for Energy [step 0] (match type 30241)
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.184216450128310e+02 | 8.130000000000000e-12 | -3.184216450128287e+02 | 2.548208745087668e-12 | -3.184216450128287e+02 | 5.030642569181509e-12 | PASS |
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Detailed information
Reference: -318.421645012831, precision: 0.00000000000813| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -3.286150905852370e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -3.184216450128265e+02 | 4.490630090003833e-12 | 5.523530246007174e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -3.286150905852370e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -3.184216450128280e+02 | 3.012701199622825e-12 | 3.705659532131396e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 2.866642279573344e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -3.184216450128296e+02 | 1.421085471520200e-12 | 1.747952609495941e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -3.184216450128264e+02 | 4.604316927725449e-12 | 5.663366454766851e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -3.184216450128236e+02 | 7.389644451905042e-12 | 9.089353569378895e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -3.184216450128275e+02 | 3.524291969370097e-12 | 4.334922471549935e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -3.184216450128301e+02 | 9.094947017729282e-13 | 1.118689670077403e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -3.184216450128284e+02 | 2.557953848736361e-12 | 3.146314697092694e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -3.184216450128291e+02 | 1.875832822406664e-12 | 2.307297444534643e-01 | PASS |
| foss-cmake: [foss2022a-serial, foss-min] | -3.184216450128337e+02 | -2.671640686457977e-12 | -3.286150905852370e-01 | PASS |
| foss-cmake: [foss2022a-serial, foss-full] | -3.184216450128337e+02 | -2.671640686457977e-12 | -3.286150905852370e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -3.184216450128236e+02 | 7.389644451905042e-12 | 9.089353569378895e-01 | PASS |
| foss-cmake: [foss2022a-mpi, foss-min-mpi] | -3.184216450128278e+02 | 3.240074875066057e-12 | 3.985331949650746e-01 | PASS |
| foss-cmake: [foss2023a-mpi, foss-full-mpi] | -3.184216450128264e+02 | 4.604316927725449e-12 | 5.663366454766851e-01 | PASS |
| foss-cmake: [foss2022a-mpi, foss-full-mpi] | -3.184216450128293e+02 | 1.648459146963432e-12 | 2.027625027015292e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.184216450128316e+02 | -5.684341886080801e-13 | -6.991810437983766e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -3.184216450128270e+02 | 4.035882739117369e-12 | 4.964185410968474e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.184216450128278e+02 | 3.240074875066057e-12 | 3.985331949650746e-01 | PASS |
| foss-cmake: [foss2023a-mpi, foss-min-mpi] | -3.184216450128276e+02 | 3.353761712787673e-12 | 4.125168158410422e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -3.184216450128258e+02 | 5.229594535194337e-12 | 6.432465602945064e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -3.184216450128295e+02 | 1.534772309241816e-12 | 1.887788818255617e-01 | PASS |