Match comparison for Total Energy (match type 18212)
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Input 04-octopus_basics-visualization.01-benzene.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -9.936945015700001e+02 | 3.250000000000000e-02 | -9.937166423050001e+02 | 1.952629288470970e-02 | -9.936945015700001e+02 | 2.952097999997250e-02 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -993.69450157, precision: 0.0325| Run | Value | Difference | Relative difference | Status |
| intel-serial: [intel2023a-serial] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-serial: [foss2023a-serial] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| intel-min-parallel: [intel2022a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| ppc: [foss2023a-serial] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| autotools_foss_mpi_omp: [foss2023a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-parallel-debug: [foss2023a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| intel-parallel: [intel2023a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-parallel: [foss2023a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-min-parallel: [foss2023b-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| autotools_intel_mpi_omp: [intel2023a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| address-sanitizer: [foss2023a-serial, ci-foss-full] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| foss-min-parallel: [foss2022a-mpi] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| intel-serial-debug: [intel2023a-serial] | -9.937240225500000e+02 | -2.952097999991565e-02 | -9.083378461512508e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] | -9.936649805900000e+02 | 2.952098000002934e-02 | 9.083378461547489e-01 | PASS |
| cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] | -9.936649805900000e+02 | 2.952098000002934e-02 | 9.083378461547489e-01 | PASS |