Match comparison for B3LYP OEP Total (match type 12235)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.258245950000000e-01 | 2.100000000000000e-05 | -5.258437042307692e-01 | 4.940474038691770e-09 | -5.258437050000000e-01 | 4.999999969612645e-09 | 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: -0.525824595, precision: 0.000021| Run | Value | Difference | Relative difference | Status |
| GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_opt_autotools: [foss2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_opt_autotools: [foss2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-min] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss-cmake: [foss2022a-serial, foss-full] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_intel_autotools: [intel2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_omp_autotools: [foss2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_intel_mpi_autotools: [intel2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_intel_omp_autotools: [intel2022a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_intel_omp_autotools: [intel2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_ppc_autotools: [foss2022a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_min_autotools: [foss2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_min_autotools: [foss2022a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_autotools: [foss2022a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_autotools: [foss2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_min_autotools: [foss2023b-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_autotools: [foss2023b-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_debug_autotools: [foss2023a-serial] | -5.258437000000000e-01 | -1.910500000001925e-05 | -9.097619047628213e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2022a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_min_autotools: [foss2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_autotools: [foss2022a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_omp_autotools: [foss2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_foss_mpi_debug_autotools: [foss2023a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |
| GCI_intel_mpi_omp_autotools: [intel2022a-mpi] | -5.258437100000000e-01 | -1.911499999995847e-05 | -9.102380952361178e-01 | PASS |