Match comparison for Tot. Maxwell energy [step 300] (match type 20973)
Commits >
Commit 584f61e8603689505e758f366f49c21c2e481def >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 1.401527129922635e-06 | 6.000000000000000e-11 | 1.401532253100686e-06 | 3.838136726750876e-20 | 1.401532253100679e-06 | 9.846758011831241e-20 | PASS |
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Detailed information
Reference: 0.0000014015271299226352, precision: 0.00000000006| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | 1.401532253100683e-06 | 5.123178047439109e-12 | 8.538630079065181e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | 1.401532253100683e-06 | 5.123178047439109e-12 | 8.538630079065181e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 1.401532253100719e-06 | 5.123178083438009e-12 | 8.538630139063348e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 1.401532253100696e-06 | 5.123178060991636e-12 | 8.538630101652726e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss-serial-min: [foss2023a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss-serial-min: [foss2022a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss-serial-min: [foss2023b-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss_autotools: [foss2022a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 1.401532253100625e-06 | 5.123177990052626e-12 | 8.538629983421044e-02 | PASS |
| foss_autotools: [foss2023b-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss-opt-full: [foss2023a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss-serial-debug: [foss2023a-serial] | 1.401532253100668e-06 | 5.123178032616032e-12 | 8.538630054360054e-02 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 1.401532253100740e-06 | 5.123178104613833e-12 | 8.538630174356387e-02 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 1.401532253100740e-06 | 5.123178104613833e-12 | 8.538630174356387e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | 1.401532253100778e-06 | 5.123178142730315e-12 | 8.538630237883858e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 1.401532253100712e-06 | 5.123178076449987e-12 | 8.538630127416645e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 1.401532253100736e-06 | 5.123178100802184e-12 | 8.538630168003640e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 1.401532253100736e-06 | 5.123178100802184e-12 | 8.538630168003640e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 1.401532253100736e-06 | 5.123178100802184e-12 | 8.538630168003640e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 1.401532253100620e-06 | 5.123177984758671e-12 | 8.538629974597785e-02 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 1.401532253100736e-06 | 5.123178100802184e-12 | 8.538630168003640e-02 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 1.401532253100689e-06 | 5.123178054215372e-12 | 8.538630090358953e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 1.401532253100660e-06 | 5.123178024780977e-12 | 8.538630041301629e-02 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 1.401532253100581e-06 | 5.123177945795155e-12 | 8.538629909658592e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 1.401532253100660e-06 | 5.123178025204494e-12 | 8.538630042007490e-02 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 1.401532253100672e-06 | 5.123178036427680e-12 | 8.538630060712801e-02 | PASS |