Match comparison for Exchange energy (match type 20687)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.529513600000000e-01 | 3.760000000000000e-07 | -7.529513680769230e-01 | 4.446426662247733e-08 | -7.529513750000001e-01 | 4.500000000406956e-08 | PASS |
Checks for this match
- MPI builders have different values.
- GPU builders have different values.
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Detailed information
Reference: -0.75295136, precision: 0.000000376| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| cmake_foss_2022a_full_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| cmake_foss_2022a_min_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| cmake_foss_2022a_min_mpi | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| cmake_foss_2022a_full_mpi | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2022a_serial_min | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2022a_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2022a_mpi_min | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2022a_mpi | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2023a_mpi | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2023a_mpi_min | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2023a_mpi_debug | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2023a_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023a_serial_min | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2022a_cuda_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023a_mpi_opt | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_foss-2023a_serial_debug | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023a_serial_opt | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023b_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023a_serial_omp | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_foss-2023a_mpi_omp | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_intel-2023a_serial | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_intel-2022a_serial_omp | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_intel-2023a_serial_omp | -7.529513300000000e-01 | 2.999999992869817e-08 | 7.978723385292068e-02 | PASS |
| spack_intel-2023a_impi | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |
| spack_intel-2022a_impi_omp | -7.529514200000000e-01 | -6.000000007944095e-08 | -1.595744682963855e-01 | PASS |