Match comparison for Exchange energy (match type 30348)
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-3.446109045000000e+00 | 8.700000000000000e-06 | -3.446102470000000e+00 | 0.000000000000000e+00 | -3.446102470000000e+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: -3.446109045, precision: 0.0000087Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -3.446102470000000e+00 | 6.575000000008657e-06 | 7.557471264377768e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -3.446102470000000e+00 | 6.575000000008657e-06 | 7.557471264377768e-01 | PASS |