Match comparison for gga_x_pw86 Int[n*v_xc] (match type 12373)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.089226650000000e-01 | 5.100000000000000e-06 | -4.089272880000001e-01 | 9.797958965975500e-09 | -4.089272900000000e-01 | 9.999999994736442e-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: -0.40892266499999996, precision: 0.0000051| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2023a_serial_min | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2022a_serial | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2023a_serial_opt | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2023a_serial | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2023b_serial | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2022a_ppc | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2022a_mpi_min | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |
| spack_foss-2023a_mpi_min | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |
| spack_foss-2023a_serial_omp | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2023a_mpi_opt | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |
| spack_foss-2023a_serial_debug | -4.089272800000000e-01 | -4.615000000041114e-06 | -9.049019607923753e-01 | PASS |
| spack_foss-2022a_mpi | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |
| spack_foss-2023a_mpi | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |
| spack_foss-2023a_mpi_debug | -4.089273000000000e-01 | -4.635000000030587e-06 | -9.088235294177621e-01 | PASS |