Match comparison for Energy [step 1] (match type 14080)
Commits >
Commit 69bdc22e524ab1df7701119670aff9b913714e90 >
Input 05-time_propagation.06-td_fast_md.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.791009280177380e+01 | 1.900000000000000e-12 | -3.791009280177386e+01 | 6.953072777706999e-14 | -3.791009280177386e+01 | 1.385558334732195e-13 | PASS |
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Detailed information
Reference: -37.9100928017738, precision: 0.0000000000019| Run | Value | Difference | Relative difference | Status |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.791009280177371e+01 | 8.526512829121202e-14 | 4.487638331116423e-02 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -3.791009280177379e+01 | 1.421085471520200e-14 | 7.479397218527370e-03 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -3.791009280177376e+01 | 3.552713678800501e-14 | 1.869849304631842e-02 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -3.791009280177393e+01 | -1.278976924368180e-13 | -6.731457496674634e-02 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -3.791009280177376e+01 | 3.552713678800501e-14 | 1.869849304631842e-02 | PASS |
| foss_autotools: [foss2022a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -3.791009280177381e+01 | -7.105427357601002e-15 | -3.739698609263685e-03 | PASS |
| foss_autotools: [foss2023b-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss_autotools: [foss2023a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -3.791009280177389e+01 | -8.526512829121202e-14 | -4.487638331116423e-02 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -3.791009280177390e+01 | -9.947598300641403e-14 | -5.235578052969159e-02 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -3.791009280177390e+01 | -9.947598300641403e-14 | -5.235578052969159e-02 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -3.791009280177394e+01 | -1.421085471520200e-13 | -7.479397218527370e-02 | PASS |
| intel_autotools: [intel2023a-serial] | -3.791009280177399e+01 | -1.918465386552271e-13 | -1.009718624501195e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -3.791009280177394e+01 | -1.421085471520200e-13 | -7.479397218527370e-02 | PASS |
| foss-serial-min: [foss2022a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss-serial-min: [foss2023b-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -3.791009280177393e+01 | -1.278976924368180e-13 | -6.731457496674634e-02 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss-serial-min: [foss2023a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss-opt-full: [foss2023a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss-serial-debug: [foss2023a-serial] | -3.791009280177381e+01 | -1.421085471520200e-14 | -7.479397218527370e-03 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -3.791009280177394e+01 | -1.421085471520200e-13 | -7.479397218527370e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -3.791009280177393e+01 | -1.278976924368180e-13 | -6.731457496674634e-02 | PASS |
| foss-omp-full: [foss2023a-serial] | -3.791009280177391e+01 | -1.136868377216160e-13 | -5.983517774821896e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -3.791009280177393e+01 | -1.278976924368180e-13 | -6.731457496674634e-02 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.791009280177371e+01 | 8.526512829121202e-14 | 4.487638331116423e-02 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -3.791009280177389e+01 | -8.526512829121202e-14 | -4.487638331116423e-02 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -3.791009280177389e+01 | -8.526512829121202e-14 | -4.487638331116423e-02 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -3.791009280177391e+01 | -1.136868377216160e-13 | -5.983517774821896e-02 | PASS |