Match comparison for Energy [step 0] (match type 30237)
Commits >
Commit 368be28936f76d73ed8ffdbffb2589aae6837ea5 >
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 | -3.184216450128288e+02 | 2.581953276429441e-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-mpi, foss-min-mpi] | -3.184216450128298e+02 | 1.193711796076968e-12 | 7.603259847624001e-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] | -3.184216450128282e+02 | 2.842170943040401e-12 | 1.810299963720000e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -3.184216450128264e+02 | 4.604316927725449e-12 | 2.932685941226401e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -1.701681965896800e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -1.701681965896800e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -3.184216450128236e+02 | 7.389644451905042e-12 | 4.706779905672001e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -3.184216450128236e+02 | 7.389644451905042e-12 | 4.706779905672001e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -3.184216450128337e+02 | -2.671640686457977e-12 | -1.701681965896800e-01 | PASS |
| intel-serial: [intel2023a-serial] | -3.184216450128265e+02 | 4.490630090003833e-12 | 2.860273942677600e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -3.184216450128337e+02 | -2.671640686457977e-12 | -1.701681965896800e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -3.184216450128303e+02 | 6.821210263296962e-13 | 4.344719912928001e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -3.184216450128265e+02 | 4.490630090003833e-12 | 2.860273942677600e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -3.184216450128280e+02 | 3.012701199622825e-12 | 1.918917961543200e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -3.184216450128296e+02 | 1.421085471520200e-12 | 9.051499818600002e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -3.184216450128247e+02 | 6.252776074688882e-12 | 3.982659920184001e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -3.184216450128279e+02 | 3.126388037344441e-12 | 1.991329960092000e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -3.184216450128271e+02 | 3.922195901395753e-12 | 2.498213949933600e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -3.184216450128300e+02 | 9.663381206337363e-13 | 6.155019876648001e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.184216450128307e+02 | 3.410605131648481e-13 | 2.172359956464000e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -3.184216450128282e+02 | 2.785327524179593e-12 | 1.774093964445600e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.184216450128289e+02 | 2.103206497849897e-12 | 1.339621973152800e-01 | 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] | -3.184216450128287e+02 | 2.330580173293129e-12 | 1.484445970250400e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -3.184216450128280e+02 | 3.012701199622825e-12 | 1.918917961543200e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -3.184216450128272e+02 | 3.751665644813329e-12 | 2.389595952110400e-01 | PASS |