Match comparison for Exchange energy (match type 29668)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.639931878000000e+01 | 1.050000000000000e-02 | -1.640802314750000e+01 | 3.798086536107216e-03 | -1.639931582000000e+01 | 9.507489999998953e-03 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -16.399318779999998, precision: 0.0105| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2022a_serial_min | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_foss-2022a_serial | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_foss-2022a_mpi_min | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2022a_mpi | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2023a_mpi | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2023a_serial | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_foss-2023a_mpi_opt | -1.640882316000000e+01 | -9.504380000002755e-03 | -9.051790476193099e-01 | PASS |
| spack_foss-2023a_serial_min | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_foss-2023a_serial_opt | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_foss-2023a_serial_omp | -1.640877967000000e+01 | -9.460890000003275e-03 | -9.010371428574547e-01 | PASS |
| spack_foss-2023a_mpi_omp | -1.640881668000000e+01 | -9.497900000003057e-03 | -9.045619047621958e-01 | PASS |
| spack_foss-2023b_serial | -1.640882331000000e+01 | -9.504530000000955e-03 | -9.051933333334242e-01 | PASS |
| spack_intel-2022a_serial_omp | -1.640880977000000e+01 | -9.490990000003308e-03 | -9.039038095241245e-01 | PASS |
| spack_intel-2023a_serial | -1.640881096000000e+01 | -9.492180000002293e-03 | -9.040171428573611e-01 | PASS |
| spack_intel-2023a_serial_omp | -1.640880794000000e+01 | -9.489160000001107e-03 | -9.037295238096291e-01 | PASS |
| spack_intel-2023a_impi | -1.640881096000000e+01 | -9.492180000002293e-03 | -9.040171428573611e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.638980833000000e+01 | 9.510449999996951e-03 | 9.057571428568524e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.640875261000000e+01 | -9.433830000002530e-03 | -8.984600000002408e-01 | PASS |
| spack_intel-2022a_impi_omp | -1.640881002000000e+01 | -9.491240000002676e-03 | -9.039276190478739e-01 | PASS |