Match comparison for Eigenvalues sum (match type 12946)
Commits >
Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a >
Input 03-sodium_chain.01-ground_state.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.455995490000000e+00 | 1.730000000000000e-07 | -3.455995613333334e+00 | 3.457680660839723e-08 | -3.455995560000000e+00 | 7.000000001866624e-08 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -3.45599549, precision: 0.000000173| Run | Value | Difference | Relative difference | Status |
| foss_cmake: [foss2022a-serial, foss-min] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_min_autotools: [foss2022a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_min_autotools: [foss2023a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_min_autotools: [foss2023b-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_opt_autotools: [foss2023a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_autotools: [foss2022a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_autotools: [foss2023b-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| intel_autotools: [intel2023a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_autotools: [foss2023a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_mpi_min_autotools: [foss2022a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_mpi_min_autotools: [foss2023a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_debug_autotools: [foss2023a-serial] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_omp_autotools: [foss2023a-serial] | -3.455995620000000e+00 | -1.300000000981072e-07 | -7.514450872722959e-01 | PASS |
| foss_mpi_opt_autotools: [foss2023a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| intel_omp_autotools: [intel2022a-serial] | -3.455995560000000e+00 | -7.000000001866624e-08 | -4.046242775645448e-01 | PASS |
| intel_omp_autotools: [intel2023a-serial] | -3.455995560000000e+00 | -7.000000001866624e-08 | -4.046242775645448e-01 | PASS |
| foss_ppc_autotools: [foss2022a-serial] | -3.455995590000000e+00 | -1.000000002804313e-07 | -5.780346837019151e-01 | PASS |
| foss_mpi_autotools: [foss2022a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_mpi_autotools: [foss2023a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_mpi_debug_autotools: [foss2023a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -3.455995630000000e+00 | -1.400000000373325e-07 | -8.092485551290896e-01 | PASS |
| foss_mpi_omp_autotools: [foss2023a-mpi] | -3.455995620000000e+00 | -1.300000000981072e-07 | -7.514450872722959e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -3.455995560000000e+00 | -7.000000001866624e-08 | -4.046242775645448e-01 | PASS |
| foss_cuda_autotools: [foss2022a-cuda-mpi] | -3.455995490000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] | -3.455995540000000e+00 | -5.000000014021566e-08 | -2.890173418509576e-01 | PASS |