Match comparison for Partial charge 1 (match type 11785)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.983000000000000e+00 | 1.990000000000000e-02 | 3.983000000000000e+00 | 0.000000000000000e+00 | 3.983000000000000e+00 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 3.9829999999999997, precision: 0.0199| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| foss-2022a_ppc | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| spack_foss-2022a_serial_min | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| spack_foss-2022a_serial | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| cmake_foss_2022a_min_mpi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| foss-2022a_opt | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022b | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022a | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| cmake_foss_2022a_full_mpi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| spack_foss-2022a_serial_omp | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| spack_foss-2022a_serial_debug | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| foss-2022a_omp | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_fosscuda-2022a | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022a_omp | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022b_impi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022a_impi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_fosscuda-2022a_mpi_omp | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| cmake_foss_2022a_min_serial | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| foss-2022a_mpi_omp | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022b_libxc6 | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022a | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022a_debug | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| intel-2022a_omp_impi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022a_mpi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022b_libxc6_mpi | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |
| eb_foss-2022a_mpi_debug | 3.983000000000000e+00 | 4.440892098500626e-16 | 2.231604069598304e-14 | PASS |