Match comparison for Exchange energy (match type 21130)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.259799677000000e+01 | 1.690000000000000e-02 | -1.260182710125000e+01 | 6.758561505991358e-04 | -1.260080827000000e+01 | 1.222730000000283e-03 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -12.59799677, precision: 0.0169| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.260203079000000e+01 | -4.034020000000638e-03 | -2.386994082840614e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2022a_mpi | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| spack_foss-2022a_mpi_min | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| spack_foss-2022a_serial | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2022a_serial_min | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2023a_mpi | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| spack_foss-2023a_mpi_min | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| spack_foss-2022a_cuda_serial | -1.260203080000000e+01 | -4.034029999999689e-03 | -2.386999999999816e-01 | PASS |
| spack_foss-2023a_serial | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2023a_mpi_opt | -1.260203100000000e+01 | -4.034230000000250e-03 | -2.387118343195414e-01 | PASS |
| spack_foss-2023a_serial_min | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2023a_mpi_omp | -1.260203087000000e+01 | -4.034100000000151e-03 | -2.387041420118433e-01 | PASS |
| spack_foss-2023a_serial_opt | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_foss-2023a_serial_omp | -1.260203089000000e+01 | -4.034120000000030e-03 | -2.387053254437888e-01 | PASS |
| spack_foss-2023b_serial | -1.260203084000000e+01 | -4.034069999999446e-03 | -2.387023668638726e-01 | PASS |
| spack_intel-2023a_serial | -1.260203087000000e+01 | -4.034100000000151e-03 | -2.387041420118433e-01 | PASS |
| spack_intel-2022a_serial_omp | -1.259958554000000e+01 | -1.588769999999684e-03 | -9.401005917157895e-02 | PASS |
| spack_intel-2023a_impi | -1.260203076000000e+01 | -4.033989999999932e-03 | -2.386976331360907e-01 | PASS |
| spack_intel-2023a_serial_omp | -1.259958554000000e+01 | -1.588769999999684e-03 | -9.401005917157895e-02 | PASS |
| spack_intel-2022a_impi_omp | -1.260203081000000e+01 | -4.034040000000516e-03 | -2.387005917160069e-01 | PASS |