Match comparison for Energy [step 0] (match type 30241)
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Input 14-fullerene_unpacked.03-td-packed.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.184216450128310e+02 | 6.500000000000000e-12 | -3.184216450128294e+02 | 2.586219390213347e-12 | -3.184216450128305e+02 | 4.774847184307873e-12 | PASS |
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Detailed information
Reference: -318.421645012831, precision: 0.0000000000065| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2023a_serial_opt | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| spack_foss-2022a_serial | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2022a_serial_min | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2022a_ppc | -3.184216450128264e+02 | 4.604316927725449e-12 | 7.083564504192998e-01 | PASS |
| spack_foss-2023a_serial | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2023b_serial | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.184216450128283e+02 | 2.728484105318785e-12 | 4.197667854336592e-01 | PASS |
| spack_foss-2023a_mpi_min | -3.184216450128283e+02 | 2.728484105318785e-12 | 4.197667854336592e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| spack_foss-2023a_mpi_opt | -3.184216450128288e+02 | 2.216893335571513e-12 | 3.410605131648481e-01 | PASS |
| spack_foss-2022a_mpi | -3.184216450128264e+02 | 4.547473508864641e-12 | 6.996113090560986e-01 | PASS |
| spack_foss-2023a_mpi | -3.184216450128353e+02 | -4.320099833421409e-12 | -6.646307436032937e-01 | PASS |
| spack_foss-2023a_serial_debug | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| spack_foss-2023a_mpi_debug | -3.184216450128339e+02 | -2.955857780762017e-12 | -4.547473508864641e-01 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | -3.184216450128265e+02 | 4.490630090003833e-12 | 6.908661676928974e-01 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | -3.184216450128296e+02 | 1.421085471520200e-12 | 2.186285340800308e-01 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | -3.184216450128280e+02 | 3.012701199622825e-12 | 4.634924922496653e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | -3.184216450128264e+02 | 4.604316927725449e-12 | 7.083564504192998e-01 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | -3.184216450128287e+02 | 2.330580173293129e-12 | 3.585507958912506e-01 | PASS |
| spack_foss-2023a_mpi_omp | -3.184216450128285e+02 | 2.444267011014745e-12 | 3.760410786176530e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | -3.184216450128353e+02 | -4.263256414560601e-12 | -6.558856022400925e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | -3.184216450128294e+02 | 1.591615728102624e-12 | 2.448639581696345e-01 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -3.184216450128282e+02 | 2.842170943040401e-12 | 4.372570681600617e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -3.184216450128282e+02 | 2.842170943040401e-12 | 4.372570681600617e-01 | PASS |
| cmake_foss_2022a_full_serial | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.184216450128337e+02 | -2.671640686457977e-12 | -4.110216440704579e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.184216450128284e+02 | 2.557953848736361e-12 | 3.935313613440555e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.184216450128315e+02 | -5.115907697472721e-13 | -7.870627226881109e-02 | PASS |
| spack_intel-2022a_impi_omp | -3.184216450128289e+02 | 2.103206497849897e-12 | 3.235702304384456e-01 | PASS |
| spack_intel-2023a_serial | -3.184216450128265e+02 | 4.490630090003833e-12 | 6.908661676928974e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.184216450128280e+02 | 3.012701199622825e-12 | 4.634924922496653e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.184216450128296e+02 | 1.421085471520200e-12 | 2.186285340800308e-01 | PASS |
| spack_intel-2023a_impi | -3.184216450128280e+02 | 3.012701199622825e-12 | 4.634924922496653e-01 | PASS |
| GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] | -3.184216450128258e+02 | 5.229594535194337e-12 | 8.045530054145135e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.184216450128284e+02 | 2.557953848736361e-12 | 3.935313613440555e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -3.184216450128292e+02 | 1.762145984685048e-12 | 2.710993822592382e-01 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -3.184216450128270e+02 | 4.035882739117369e-12 | 6.209050367872875e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -3.184216450128280e+02 | 3.012701199622825e-12 | 4.634924922496653e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -3.184216450128280e+02 | 3.012701199622825e-12 | 4.634924922496653e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.184216450128258e+02 | 5.229594535194337e-12 | 8.045530054145135e-01 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | -3.184216450128267e+02 | 4.263256414560601e-12 | 6.558856022400925e-01 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -3.184216450128275e+02 | 3.467448550509289e-12 | 5.334536231552752e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -3.184216450128323e+02 | -1.307398633798584e-12 | -2.011382513536284e-01 | PASS |