Match comparison for Total current (x=-0.38, y= 0,z=0) [step 20] (match type 23481)
Commits >
Commit bb161c2d0107cec853e686df3a469ebc444968d7 >
Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 9.833499753902589e-05 | 2.000000000000000e-10 | 9.833495411998338e-05 | 2.905393456345269e-17 | 9.833495411997121e-05 | 5.569411034786476e-17 | PASS |
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Detailed information
Reference: 0.0000983349975390259, precision: 0.0000000002| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_autotools: [foss2022a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_cmake_mpi_min: [foss2023a-mpi] | 9.833495411996059e-05 | -4.341906529952387e-11 | -2.170953264976193e-01 | PASS |
| foss_cmake_mpi_min: [foss2022a-mpi] | 9.833495411996059e-05 | -4.341906529952387e-11 | -2.170953264976193e-01 | PASS |
| foss_autotools: [foss2023b-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| intel_autotools: [intel2023a-serial] | 9.833495412002689e-05 | -4.341899900056102e-11 | -2.170949950028051e-01 | PASS |
| foss_autotools: [foss2023a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 9.833495411996059e-05 | -4.341906529952387e-11 | -2.170953264976193e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 9.833495411991551e-05 | -4.341911038878172e-11 | -2.170955519439086e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 9.833495411996059e-05 | -4.341906529952387e-11 | -2.170953264976193e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 9.833495411997331e-05 | -4.341905258725340e-11 | -2.170952629362670e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 9.833495411997331e-05 | -4.341905258725340e-11 | -2.170952629362670e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 9.833495411996080e-05 | -4.341906509623596e-11 | -2.170953254811798e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 9.833495412001680e-05 | -4.341900909719375e-11 | -2.170950454859688e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 9.833495412002689e-05 | -4.341899900056102e-11 | -2.170949950028051e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 9.833495412001161e-05 | -4.341901428781166e-11 | -2.170950714390583e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 9.833495412001440e-05 | -4.341901149599106e-11 | -2.170950574799553e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 9.833495412001140e-05 | -4.341901449109956e-11 | -2.170950724554978e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 9.833495412002470e-05 | -4.341900119607042e-11 | -2.170950059803521e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 9.833495411999750e-05 | -4.341902839599242e-11 | -2.170951419799621e-01 | PASS |