Match comparison for Total Energy (match type 17891)
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Input 02-octopus_basics-basic_input_options.01-N_atom.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.622403158000000e+02 | 9.829999999999999e-04 | -2.622410212273684e+02 | 5.484378527853623e-04 | -2.622403158050000e+02 | 8.935350000172093e-04 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -262.2403158, precision: 0.000983| Run | Value | Difference | Relative difference | Status |
| foss-serial-zen4: [foss2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-parallel-zen4: [foss2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-min-parallel-zen4: [foss2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-serial: [foss2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| ppc: [foss2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -2.622394222700000e+02 | 8.935300000416646e-04 | 9.089827060444198e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| intel-parallel-debug: [intel2023a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -2.622394222700000e+02 | 8.935300000416646e-04 | 9.089827060444198e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -2.622412093400000e+02 | -8.935399999927540e-04 | -9.089928789346430e-01 | PASS |