Match comparison for Exchange energy (match type 12054)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -9.198630448000000e+01 | 2.160000000000000e-06 | -9.198630437444444e+01 | 1.578638242480665e-07 | -9.198630451500000e+01 | 3.149999940887938e-07 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -91.98630448, precision: 0.00000216| Run | Value | Difference | Relative difference | Status |
| spack_foss-2023a_serial_min | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2022a_serial_min | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2023a_serial_opt | -9.198630436000001e+01 | 1.199999957179898e-07 | 5.555555357314343e-02 | PASS |
| spack_foss-2022a_serial | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2023b_serial | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2023a_serial | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2022a_ppc | -9.198630434000000e+01 | 1.399999973727972e-07 | 6.481481359851723e-02 | PASS |
| spack_foss-2022a_mpi_min | -9.198630437000000e+01 | 1.100000019960135e-07 | 5.092592685000623e-02 | PASS |
| spack_foss-2023a_mpi_min | -9.198630437000000e+01 | 1.100000019960135e-07 | 5.092592685000623e-02 | PASS |
| spack_foss-2023a_serial_omp | -9.198630435000000e+01 | 1.300000036508209e-07 | 6.018518687538003e-02 | PASS |
| spack_foss-2023a_serial_debug | -9.198630420000001e+01 | 2.799999947455944e-07 | 1.296296271970345e-01 | PASS |
| spack_foss-2022a_cuda_serial | -9.198630432000000e+01 | 1.599999990276046e-07 | 7.407407362389104e-02 | PASS |
| spack_foss-2023a_mpi_opt | -9.198630430999999e+01 | 1.700000069604357e-07 | 7.870370692612765e-02 | PASS |
| spack_foss-2022a_mpi | -9.198630472000001e+01 | -2.400000056468343e-07 | -1.111111137253863e-01 | PASS |
| spack_foss-2023a_mpi | -9.198630433000000e+01 | 1.500000053056283e-07 | 6.944444690075384e-02 | PASS |
| cmake_foss_2022a_full_mpi | -9.198630437000000e+01 | 1.100000019960135e-07 | 5.092592685000623e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -9.198630446999999e+01 | 1.000000793283107e-08 | 4.629633302236605e-03 | PASS |
| spack_foss-2023a_mpi_debug | -9.198630451000000e+01 | -2.999999537678377e-08 | -1.388888674851100e-02 | PASS |
| spack_foss-2023a_mpi_omp | -9.198630439999999e+01 | 8.000000661922968e-08 | 3.703704010149522e-02 | PASS |
| cmake_foss_2022a_min_serial | -9.198630436000001e+01 | 1.199999957179898e-07 | 5.555555357314343e-02 | PASS |
| cmake_foss_2022a_full_serial | -9.198630436000001e+01 | 1.199999957179898e-07 | 5.555555357314343e-02 | PASS |
| cmake_foss_2022a_min_mpi | -9.198630455999999e+01 | -7.999999240837496e-08 | -3.703703352239582e-02 | PASS |
| spack_intel-2023a_serial | -9.198630464000000e+01 | -1.599999990276046e-07 | -7.407407362389104e-02 | PASS |
| spack_intel-2022a_serial_omp | -9.198630438000001e+01 | 9.999999406318238e-08 | 4.629629354776962e-02 | PASS |
| spack_intel-2023a_serial_omp | -9.198630430000000e+01 | 1.800000006824121e-07 | 8.333333364926485e-02 | PASS |
| spack_intel-2023a_impi | -9.198630426000000e+01 | 2.200000039920269e-07 | 1.018518537000125e-01 | PASS |
| spack_intel-2022a_impi_omp | -9.198630482999999e+01 | -3.499999934319931e-07 | -1.620370339962931e-01 | PASS |