Match comparison for Exchange energy (match type 3416)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.407176500000000e-01 | 3.000000000000000e-05 | -2.407261325925926e-01 | 9.454279555903838e-07 | -2.407245950000000e-01 | 1.805000000007495e-06 | PASS |
Checks for this match
- MPI builders have different values.
- GPU builders have different values. Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
Zen 4 builders have different values.
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Detailed information
Reference: -0.24071765, precision: 0.00003| Run | Value | Difference | Relative difference | Status |
| foss-ppc: [foss2022a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, ci-foss-min] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| valgrind: [foss2023a-serial] | -2.407264000000000e-01 | -8.750000000001812e-06 | -2.916666666667271e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -2.407227900000000e-01 | -5.139999999986822e-06 | -1.713333333328940e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -2.407227900000000e-01 | -5.139999999986822e-06 | -1.713333333328940e-01 | PASS |