Match comparison for Benzene Dipole Ex Field from Maxwell [step 13] (match type 23466)
Commits >
Commit 917d830e9234ff154f8a96d6b6c157a89a03a450 >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 8.132646076402673e-06 | 1.000000000000000e-10 | 8.132652692163111e-06 | 3.742825088499360e-20 | 8.132652692163127e-06 | 7.453889935837843e-20 | PASS |
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Detailed information
Reference: 0.000008132646076402673, precision: 0.0000000001| Run | Value | Difference | Relative difference | Status |
| foss_min_autotools: [foss2023a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_autotools: [foss2022a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_autotools: [foss2023b-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 8.132652692163154e-06 | 6.615760480540916e-12 | 6.615760480540916e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 8.132652692163059e-06 | 6.615760385673226e-12 | 6.615760385673226e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 8.132652692163144e-06 | 6.615760470376521e-12 | 6.615760470376521e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 8.132652692163144e-06 | 6.615760470376521e-12 | 6.615760470376521e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 8.132652692163201e-06 | 6.615760527974761e-12 | 6.615760527974761e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 8.132652692163052e-06 | 6.615760378896962e-12 | 6.615760378896962e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| foss-cmake: [foss2022a-serial, foss-min] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss-cmake: [foss2022a-serial, foss-full] | 8.132652692163103e-06 | 6.615760429718939e-12 | 6.615760429718939e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 8.132652692163052e-06 | 6.615760378896962e-12 | 6.615760378896962e-02 | PASS |
| foss-cmake: [foss2022a-mpi, foss-min-mpi] | 8.132652692163052e-06 | 6.615760378896962e-12 | 6.615760378896962e-02 | PASS |
| foss-cmake: [foss2023a-mpi, foss-full-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| foss-cmake: [foss2022a-mpi, foss-full-mpi] | 8.132652692163123e-06 | 6.615760450047730e-12 | 6.615760450047729e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 8.132652692163067e-06 | 6.615760394143556e-12 | 6.615760394143555e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 8.132652692163106e-06 | 6.615760433107071e-12 | 6.615760433107071e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 8.132652692163164e-06 | 6.615760490705311e-12 | 6.615760490705311e-02 | PASS |
| foss-cmake: [foss2023a-mpi, foss-min-mpi] | 8.132652692163052e-06 | 6.615760378896962e-12 | 6.615760378896962e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 8.132652692163101e-06 | 6.615760428024873e-12 | 6.615760428024874e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 8.132652692163194e-06 | 6.615760521198498e-12 | 6.615760521198498e-02 | PASS |