Match comparison for Ion-ion energy (match type 23545)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.817934720000000e+00 | 3.910000000000000e-07 | -7.817934599999999e+00 | 8.881784197001252e-16 | -7.817934600000000e+00 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -7.81793472, precision: 0.000000391| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_min | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_serial_opt | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| intel-2022b | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022b_libxc6 | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022a_ppc | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_intel-2022a | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022a | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022a_mpi_min | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_fosscuda-2022a | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_intel-2022a_omp | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_foss-2022a_mpi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| intel-2022b_impi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_intel-2022a_impi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_mpi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_serial | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_mpi_omp | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_serial_min | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_serial_debug | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| spack_foss-2022a_serial_omp | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |
| eb_intel-2022a_omp_impi | -7.817934600000000e+00 | 1.200000001588819e-07 | 3.069053712503373e-01 | PASS |