Match comparison for Tot. Maxwell energy [step 300] (match type 20979)
Commits >
Commit eff5280d65f29f89ecacf7a6e9c2d06020a47460 >
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 |
| 1.401724560682102e-06 | 1.000000000000000e-19 | 1.401724560682074e-06 | 4.193570016175744e-20 | 1.401724560682098e-06 | 8.915021769851511e-20 | PASS |
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Detailed information
Reference: 0.000001401724560682102, precision: 0.0000000000000000001| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_min_autotools: [foss2022a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_min_autotools: [foss2023b-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_min_autotools: [foss2023a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_autotools: [foss2023a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_autotools: [foss2022a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_autotools: [foss2023b-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_opt_autotools: [foss2023a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| intel_autotools: [intel2023a-serial] | 1.401724560682070e-06 | -3.176373552203626e-20 | -3.176373552203626e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | 1.401724560682169e-06 | 6.733911930671688e-20 | 6.733911930671688e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | 1.401724560682043e-06 | -5.908054807098745e-20 | -5.908054807098745e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | 1.401724560682043e-06 | -5.908054807098745e-20 | -5.908054807098745e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | 1.401724560682093e-06 | -9.317362419797304e-21 | -9.317362419797304e-02 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | 1.401724560682076e-06 | -2.646977960169689e-20 | -2.646977960169689e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | 1.401724560682079e-06 | -2.265813133905253e-20 | -2.265813133905253e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | 1.401724560682187e-06 | 8.533856943587076e-20 | 8.533856943587076e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | 1.401724560682123e-06 | 2.138758191817108e-20 | 2.138758191817108e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | 1.401724560682068e-06 | -3.388131789017201e-20 | -3.388131789017201e-01 | PASS |
| foss_cmake_ceph: [foss2022a-mpi, foss-min-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_cmake_ceph: [foss2023a-mpi, foss-min-mpi] | 1.401724560682009e-06 | -9.296186596115946e-20 | -9.296186596115946e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | 1.401724560682073e-06 | -2.943439491708694e-20 | -2.943439491708694e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | 1.401724560682104e-06 | 2.117582368135751e-21 | 2.117582368135751e-02 | PASS |