Match comparison for Ex (x= 0.76,y= 0,z=0) [step 400] (match type 30140)
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 9.344499835338481e-05 | 1.000000000000000e-14 | 9.344499835406254e-05 | 4.784559330533370e-16 | 9.344499835408645e-05 | 1.034850644846680e-15 | PASS |
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Detailed information
Reference: 0.00009344499835338481, precision: 0.00000000000001| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | 9.344499835377490e-05 | 3.900959416602845e-16 | 3.900959416602845e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | 9.344499835377639e-05 | 3.915867196474521e-16 | 3.915867196474521e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 9.344499835420170e-05 | 8.168921268592033e-16 | 8.168921268592033e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 9.344499835420711e-05 | 8.222995851944748e-16 | 8.222995851944748e-02 | PASS |
| foss-ppc: [foss2022a-serial] | 9.344499835305160e-05 | -3.332024326591077e-16 | -3.332024326591077e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 9.344499835464000e-05 | 1.255194407613625e-15 | 1.255194407613625e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-serial-min: [foss2023a-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 9.344499835464000e-05 | 1.255194407613625e-15 | 1.255194407613625e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-serial-full: [foss2023b-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-serial-min: [foss2023b-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-opt-full: [foss2023a-serial] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 9.344499835395971e-05 | 5.748982019604387e-16 | 5.748982019604387e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | 9.344499835466750e-05 | 1.282692485213288e-15 | 1.282692485213288e-01 | PASS |
| intel-serial: [intel2023a-serial] | 9.344499835412160e-05 | 7.367966913668367e-16 | 7.367966913668367e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 9.344499835420581e-05 | 8.209985425874922e-16 | 8.209985425874922e-02 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 9.344499835327051e-05 | -1.143020140342843e-16 | -1.143020140342843e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 9.344499835327051e-05 | -1.143020140342843e-16 | -1.143020140342843e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 9.344499835327051e-05 | -1.143020140342843e-16 | -1.143020140342843e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 9.344499835327051e-05 | -1.143020140342843e-16 | -1.143020140342843e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 9.344499835409980e-05 | 7.149906751727220e-16 | 7.149906751727220e-02 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 9.344499835409980e-05 | 7.149906751727220e-16 | 7.149906751727220e-02 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 9.344499835327051e-05 | -1.143020140342843e-16 | -1.143020140342843e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 9.344499835409980e-05 | 7.149906751727220e-16 | 7.149906751727220e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 9.344499835409980e-05 | 7.149906751727220e-16 | 7.149906751727220e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 9.344499835447570e-05 | 1.090897120900602e-15 | 1.090897120900602e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 9.344499835512131e-05 | 1.736498857034252e-15 | 1.736498857034252e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 9.344499835403971e-05 | 6.548987697627129e-16 | 6.548987697627129e-02 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 9.344499835472021e-05 | 1.335398263323240e-15 | 1.335398263323240e-01 | PASS |