Match comparison for Unnormalized charge (match type 18754)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.158967000000000e+00 | 4.820000000000000e-04 | 6.159402148148148e+00 | 3.027083961683510e-06 | 6.159400500000000e+00 | 5.499999999880600e-06 | PASS |
Checks for this match
- GPU builders have different values. Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 6.158967, precision: 0.000482| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| spack_foss-2022a_serial_min | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| foss-2022a_ppc | 6.159396000000000e+00 | 4.290000000004568e-04 | 8.900414937768814e-01 | PASS |
| spack_foss-2022a_serial_opt | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| spack_foss-2022a_serial | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| foss-2022a_opt | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| intel-2022b | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| intel-2022a | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| spack_foss-2022a_serial_omp | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| cmake_foss_2022a_full_mpi | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| spack_foss-2022a_serial_debug | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| foss-2022a_omp | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| intel-2022a_omp | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| intel-2022b_impi | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| intel-2022a_impi | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | 6.159395000000000e+00 | 4.280000000003170e-04 | 8.879668049799108e-01 | PASS |
| eb_fosscuda-2022a | 6.159395000000000e+00 | 4.280000000003170e-04 | 8.879668049799108e-01 | PASS |
| cmake_foss_2022a_min_serial | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| foss-2022a_mpi_omp | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| cmake_foss_2022a_min_mpi | 6.159403000000000e+00 | 4.360000000005471e-04 | 9.045643153538321e-01 | PASS |
| eb_foss-2022a | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| eb_foss-2022b_libxc6 | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| eb_foss-2022a_debug | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| intel-2022a_omp_impi | 6.159406000000000e+00 | 4.390000000000782e-04 | 9.107883817429009e-01 | PASS |
| eb_foss-2022a_mpi | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |
| eb_foss-2022a_mpi_debug | 6.159401000000000e+00 | 4.340000000002675e-04 | 9.004149377598911e-01 | PASS |