Match comparison for Benzene Multipoles [step 0] (match type 20992)
Commits >
Commit b2c9b4a951ad3e3faeb99c2d543d652f634c0371 >
Input 12-tddft-currents-to-maxwell.05-benzene-extsource-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 0.000000000000000e+00 | 1.000000000000000e-10 | 4.778968374922576e-15 | 7.719315397826099e-15 | 6.772909414546736e-15 | 1.360575608054964e-14 | PASS |
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Detailed information
Reference: 0.0, precision: 0.0000000001| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | -6.359287337397262e-15 | -6.359287337397262e-15 | -6.359287337397261e-05 | PASS |
| spack_foss-2022a_serial_min | 7.659138334358420e-15 | 7.659138334358420e-15 | 7.659138334358420e-05 | PASS |
| spack_foss-2022a_serial | 7.659138334358420e-15 | 7.659138334358420e-15 | 7.659138334358420e-05 | PASS |
| foss-2022a_opt | 9.726179926596289e-15 | 9.726179926596289e-15 | 9.726179926596289e-05 | PASS |
| intel-2022b | -5.048520320902356e-15 | -5.048520320902356e-15 | -5.048520320902356e-05 | PASS |
| intel-2022a | -5.048520320902356e-15 | -5.048520320902356e-15 | -5.048520320902356e-05 | PASS |
| spack_foss-2022a_serial_omp | 2.037866549509638e-14 | 2.037866549509638e-14 | 2.037866549509638e-04 | PASS |
| cmake_foss_2022a_full_serial | 7.659138334358420e-15 | 7.659138334358420e-15 | 7.659138334358420e-05 | PASS |
| spack_foss-2022a_serial_debug | 7.659138334358420e-15 | 7.659138334358420e-15 | 7.659138334358420e-05 | PASS |
| foss-2022a_omp | 4.747030315328332e-15 | 4.747030315328332e-15 | 4.747030315328332e-05 | PASS |
| cmake_foss_2022a_full_mpi | 3.013331882784653e-15 | 3.013331882784653e-15 | 3.013331882784653e-05 | PASS |
| intel-2022a_omp | -6.832846666002902e-15 | -6.832846666002902e-15 | -6.832846666002902e-05 | PASS |
| intel-2022b_impi | -5.418728769161580e-15 | -5.418728769161580e-15 | -5.418728769161579e-05 | PASS |
| intel-2022a_impi | -5.418728769161580e-15 | -5.418728769161580e-15 | -5.418728769161579e-05 | PASS |
| cmake_foss_2022a_min_mpi | 1.713212767803238e-14 | 1.713212767803238e-14 | 1.713212767803238e-04 | PASS |
| cmake_foss_2022a_min_serial | 7.659138334358420e-15 | 7.659138334358420e-15 | 7.659138334358420e-05 | PASS |
| foss-2022a_mpi_omp | 2.277615555334301e-15 | 2.277615555334301e-15 | 2.277615555334301e-05 | PASS |
| eb_fosscuda-2022a_mpi_omp | 4.866904818240664e-15 | 4.866904818240664e-15 | 4.866904818240664e-05 | PASS |
| eb_foss-2022a | 9.726179926596289e-15 | 9.726179926596289e-15 | 9.726179926596289e-05 | PASS |
| eb_foss-2022b_libxc6 | 4.026706130314403e-15 | 4.026706130314403e-15 | 4.026706130314403e-05 | PASS |
| eb_foss-2022a_debug | 9.726179926596289e-15 | 9.726179926596289e-15 | 9.726179926596289e-05 | PASS |
| intel-2022a_omp_impi | -6.545147859013307e-15 | -6.545147859013307e-15 | -6.545147859013307e-05 | PASS |
| eb_foss-2022a_mpi | 1.135836270543870e-14 | 1.135836270543870e-14 | 1.135836270543870e-04 | PASS |
| eb_foss-2022b_libxc6_mpi | 1.674484950681609e-14 | 1.674484950681609e-14 | 1.674484950681609e-04 | PASS |
| eb_foss-2022a_mpi_debug | 1.135836270543870e-14 | 1.135836270543870e-14 | 1.135836270543870e-04 | PASS |
| eb_fosscuda-2022a | 1.546769546122761e-15 | 1.546769546122761e-15 | 1.546769546122761e-05 | PASS |