Match comparison for Benzene Dipole Ex Field from Maxwell [step 13] (match type 23466)
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
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 | 8.132652692163032e-06 | 8.054109777174020e-20 | 8.132652692163050e-06 | 1.626303258728257e-19 | PASS |
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Detailed information
Reference: 0.000008132646076402673, precision: 0.0000000001| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_autotools: [foss2022a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_autotools: [foss2023b-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 8.132652692163137e-06 | 6.615760463600257e-12 | 6.615760463600256e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 8.132652692163042e-06 | 6.615760368732567e-12 | 6.615760368732566e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 8.132652692163084e-06 | 6.615760411084214e-12 | 6.615760411084214e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 8.132652692163084e-06 | 6.615760411084214e-12 | 6.615760411084214e-02 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 8.132652692163023e-06 | 6.615760350097842e-12 | 6.615760350097842e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 8.132652692163213e-06 | 6.615760539833222e-12 | 6.615760539833222e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 8.132652692163133e-06 | 6.615760460212125e-12 | 6.615760460212125e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 8.132652692163052e-06 | 6.615760378896962e-12 | 6.615760378896962e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 8.132652692163066e-06 | 6.615760392449490e-12 | 6.615760392449489e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 8.132652692163072e-06 | 6.615760399225753e-12 | 6.615760399225754e-02 | PASS |
| foss_cmake_ceph: [foss2022a-mpi, foss-min-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_cmake_ceph: [foss2023a-mpi, foss-min-mpi] | 8.132652692162888e-06 | 6.615760214572571e-12 | 6.615760214572571e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 8.132652692163137e-06 | 6.615760463600257e-12 | 6.615760463600256e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 8.132652692163042e-06 | 6.615760368732567e-12 | 6.615760368732566e-02 | PASS |