Match comparison for H2 Multipole y (match type 15309)
Commits >
Commit b5af8743e2ea06a4f564dab9b293c80c368f10c2 >
Input 30-local_multipoles.02-multipoles.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
-3.942026147098386e-01 | 3.940000000000000e-15 | -3.942026147098416e-01 | 7.385278330912554e-16 | -3.942026147098414e-01 | 8.326672684688674e-16 | PASS |
Checks for this match
- MPI builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.3942026147098386, precision: 0.00000000000000394Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-full-mpi] | -3.942026147098420e-01 | -3.386180225106727e-15 | -8.594366053570374e-01 | PASS |
foss-cmake-zen4: [foss2023a-mpi, ci-foss-min-mpi] | -3.942026147098422e-01 | -3.608224830031759e-15 | -9.157931040689743e-01 | PASS |
foss-cmake-zen4: [foss2023a-serial, ci-foss-full] | -3.942026147098405e-01 | -1.942890293094024e-15 | -4.931193637294477e-01 | PASS |