Match comparison for Ex (x= 0.76,y= 0,z=0) [step 400] (match type 25758)
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 9.344493696214700e-05 | 8.479999999999999e-12 | 9.344493696237842e-05 | 5.017621203923473e-16 | 9.344493696243790e-05 | 9.885010019729246e-16 | PASS |
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Detailed information
Reference: 0.000093444936962147, precision: 0.00000000000848| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | 9.344493696342640e-05 | 1.279399221114363e-15 | 1.508725496597127e-04 | PASS |
| cmake_foss_2022a_full_serial | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| cmake_foss_2022a_min_serial | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| cmake_foss_2022a_full_mpi | 9.344493696193100e-05 | -2.160001778134246e-16 | -2.547171908177177e-05 | PASS |
| eb_fosscuda-2022a | 9.344493696221540e-05 | 6.839960455667926e-17 | 8.065991103381988e-06 | PASS |
| cmake_foss_2022a_min_mpi | 9.344493696261750e-05 | 4.705030852772407e-16 | 5.548385439590103e-05 | PASS |
| eb_foss-2022a_debug | 9.344493696215709e-05 | 1.009663273127126e-17 | 1.190640652272554e-06 | PASS |
| eb_foss-2022b_libxc6 | 9.344493696188440e-05 | -2.625937661759892e-16 | -3.096624601131948e-05 | PASS |
| eb_intel-2022a | 9.344493696204790e-05 | -9.909607856517511e-17 | -1.168585832136499e-05 | PASS |
| eb_foss-2022b_libxc6_mpi | 9.344493696144939e-05 | -6.976027828314857e-16 | -8.226447910748652e-05 | PASS |
| intel-2022b | 9.344493696204790e-05 | -9.909607856517511e-17 | -1.168585832136499e-05 | PASS |
| eb_intel-2022a_omp | 9.344493696230860e-05 | 1.616003338089644e-16 | 1.905664313784958e-05 | PASS |
| eb_foss-2022a_mpi_debug | 9.344493696221900e-05 | 7.200457678019356e-17 | 8.491105752381318e-06 | PASS |
| eb_intel-2022a_impi | 9.344493696288290e-05 | 7.359022245745361e-16 | 8.678092270926134e-05 | PASS |
| spack_foss-2022a_serial | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| spack_foss-2022a_mpi | 9.344493696193100e-05 | -2.160001778134246e-16 | -2.547171908177177e-05 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 9.344493696180959e-05 | -3.374037160774890e-16 | -3.978817406574163e-05 | PASS |
| spack_foss-2022a_serial_min | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| intel-2022b_impi | 9.344493696288290e-05 | 7.359022245745361e-16 | 8.678092270926134e-05 | PASS |
| spack_foss-2022a_serial_debug | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| spack_foss-2022a_serial_omp | 9.344493696247990e-05 | 3.329042770616741e-16 | 3.925757984217856e-05 | PASS |
| spack_foss-2022a_serial_opt | 9.344493696264719e-05 | 5.001966722761875e-16 | 5.898545663634287e-05 | PASS |
| spack_foss-2022a_mpi_omp | 9.344493696339401e-05 | 1.247008681211359e-15 | 1.470529105202074e-04 | PASS |
| eb_intel-2022a_omp_impi | 9.344493696151390e-05 | -6.330927535685982e-16 | -7.465716433591960e-05 | PASS |