Match comparison for PBE0 Fock Eigenvalue dn (match type 12504)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -8.208640000000000e-01 | 3.850000000000000e-05 | -8.208926363636365e-01 | 2.012358511016658e-05 | -8.208640000000000e-01 | 3.500000000000725e-05 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.820864, precision: 0.0000385| Run | Value | Difference | Relative difference | Status |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -8.208290000000000e-01 | 3.500000000000725e-05 | 9.090909090910974e-01 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -8.208290000000000e-01 | 3.500000000000725e-05 | 9.090909090910974e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-serial-debug: [foss2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -8.208990000000000e-01 | -3.500000000000725e-05 | -9.090909090910974e-01 | PASS |