Match comparison for Tot. Maxwell energy [step 300] (match type 30139)
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 |
| 1.401555572859941e-06 | 1.030000000000000e-19 | 1.401555572859941e-06 | 3.917017625778836e-20 | 1.401555572859937e-06 | 9.592648127654951e-20 | PASS |
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Detailed information
Reference: 0.0000014015555728599411, precision: 0.000000000000000000103| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | 1.401555572859932e-06 | -8.893845946170154e-21 | -8.634801889485585e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | 1.401555572859932e-06 | -9.529120656610879e-21 | -9.251573453020270e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 1.401555572859955e-06 | 1.418780186650953e-20 | 1.377456491894129e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 1.401555572859971e-06 | 2.943439491708694e-20 | 2.857708244377373e-01 | PASS |
| foss-ppc: [foss2022a-serial] | 1.401555572859968e-06 | 2.731681254895119e-20 | 2.652117723199144e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 1.401555572860002e-06 | 6.098637220230962e-20 | 5.921007009932974e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 1.401555572860002e-06 | 6.098637220230962e-20 | 5.921007009932974e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 1.401555572859870e-06 | -7.157428404298838e-20 | -6.948959615824114e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | 1.401555572860033e-06 | 9.211483301390516e-20 | 8.943187671252928e-01 | PASS |
| intel-serial: [intel2023a-serial] | 1.401555572859883e-06 | -5.844527336054672e-20 | -5.674298384519100e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | 1.401555572859937e-06 | -4.446922973085077e-21 | -4.317400944742793e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 1.401555572859937e-06 | -4.446922973085077e-21 | -4.317400944742793e-02 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | 1.401555572859937e-06 | -4.446922973085077e-21 | -4.317400944742793e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 1.401555572859937e-06 | -4.446922973085077e-21 | -4.317400944742793e-02 | PASS |
| foss-mpi-min: [foss2022a-mpi] | 1.401555572859989e-06 | 4.764560328305439e-20 | 4.625786726510135e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | 1.401555572859989e-06 | 4.764560328305439e-20 | 4.625786726510135e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | 1.401555572859937e-06 | -4.446922973085077e-21 | -4.317400944742793e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 1.401555572859989e-06 | 4.764560328305439e-20 | 4.625786726510135e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 1.401555572859989e-06 | 4.764560328305439e-20 | 4.625786726510135e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 1.401555572859841e-06 | -9.973812953919386e-20 | -9.683313547494550e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | 1.401555572859919e-06 | -2.223461486542538e-20 | -2.158700472371397e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 1.401555572859922e-06 | -1.926999955003533e-20 | -1.870873742721877e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | 1.401555572859925e-06 | -1.630538423464528e-20 | -1.583047013072357e-01 | PASS |