Match comparison for Exchange energy (match type 30217)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -9.198639570000000e+01 | 4.600000000000000e-06 | -9.198639569555559e+01 | 1.381714798103781e-07 | -9.198639565500000e+01 | 2.450000025078225e-07 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -91.9863957, precision: 0.0000046| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2023a_serial_opt | -9.198639590000001e+01 | -2.000000023372195e-07 | -4.347826137765641e-02 | PASS |
| spack_foss-2023a_serial | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2023a_serial_min | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2023b_serial | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2022a_serial | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2022a_mpi_min | -9.198639549000001e+01 | 2.099999960591958e-07 | 4.565217305634692e-02 | PASS |
| spack_foss-2022a_ppc | -9.198639550000000e+01 | 2.000000023372195e-07 | 4.347826137765641e-02 | PASS |
| spack_foss-2023a_mpi_min | -9.198639549000001e+01 | 2.099999960591958e-07 | 4.565217305634692e-02 | PASS |
| spack_foss-2023a_serial_omp | -9.198639579000000e+01 | -9.000000034120603e-08 | -1.956521746547957e-02 | PASS |
| spack_foss-2022a_mpi | -9.198639571000000e+01 | -9.999993721976352e-09 | -2.173911678690512e-03 | PASS |
| spack_foss-2023a_mpi | -9.198639565000001e+01 | 4.999999703159119e-08 | 1.086956457208504e-02 | PASS |
| spack_foss-2023a_serial_debug | -9.198639578000000e+01 | -7.999999240837496e-08 | -1.739130269747282e-02 | PASS |
| spack_foss-2023a_mpi_debug | -9.198639566000000e+01 | 4.000000330961484e-08 | 8.695652893394530e-03 | PASS |
| spack_foss-2023a_mpi_omp | -9.198639566000000e+01 | 4.000000330961484e-08 | 8.695652893394530e-03 | PASS |
| cmake_foss_2022a_full_serial | -9.198639590000001e+01 | -2.000000023372195e-07 | -4.347826137765641e-02 | PASS |
| cmake_foss_2022a_min_serial | -9.198639590000001e+01 | -2.000000023372195e-07 | -4.347826137765641e-02 | PASS |
| cmake_foss_2022a_min_mpi | -9.198639572000000e+01 | -2.000000165480742e-08 | -4.347826446697265e-03 | PASS |
| cmake_foss_2022a_full_mpi | -9.198639552000000e+01 | 1.800000006824121e-07 | 3.913043493095914e-02 | PASS |
| spack_intel-2023a_serial | -9.198639554000000e+01 | 1.599999990276046e-07 | 3.478260848426188e-02 | PASS |
| spack_intel-2022a_impi_omp | -9.198639563000000e+01 | 6.999999868639861e-08 | 1.521739101878231e-02 | PASS |
| spack_intel-2022a_serial_omp | -9.198639555000000e+01 | 1.500000053056283e-07 | 3.260869680557137e-02 | PASS |
| spack_intel-2023a_serial_omp | -9.198639586000000e+01 | -1.599999990276046e-07 | -3.478260848426188e-02 | PASS |
| spack_intel-2023a_impi | -9.198639570000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2023a_mpi_opt | -9.198639568000000e+01 | 2.000000165480742e-08 | 4.347826446697265e-03 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -9.198639584000000e+01 | -1.399999973727972e-07 | -3.043478203756462e-02 | PASS |
| spack_foss-2022a_cuda_serial | -9.198639541000000e+01 | 2.900000026784255e-07 | 6.304347884313598e-02 | PASS |