Match comparison for Energy [step 10] (match type 17736)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.042949458890970e+01 | 5.210000000000000e-13 | -1.042949458890976e+01 | 5.966020788060670e-15 | -1.042949458890975e+01 | 1.065814103640150e-14 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -10.4294945889097, precision: 0.000000000000521| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | -1.042949458890977e+01 | -6.572520305780927e-14 | -1.261520212242020e-01 | PASS |
| spack_foss-2022a_serial | -1.042949458890976e+01 | -6.394884621840902e-14 | -1.227425071370614e-01 | PASS |
| foss-2022a_opt | -1.042949458890976e+01 | -6.394884621840902e-14 | -1.227425071370614e-01 | PASS |
| intel-2022b | -1.042949458890976e+01 | -6.039613253960852e-14 | -1.159234789627803e-01 | PASS |
| intel-2022a | -1.042949458890976e+01 | -6.039613253960852e-14 | -1.159234789627803e-01 | PASS |
| cmake_foss_2022a_full_serial | -1.042949458890976e+01 | -6.039613253960852e-14 | -1.159234789627803e-01 | PASS |
| foss-2022a_omp | -1.042949458890975e+01 | -4.973799150320701e-14 | -9.546639443993668e-02 | PASS |
| cmake_foss_2022a_full_mpi | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| intel-2022a_omp | -1.042949458890975e+01 | -4.973799150320701e-14 | -9.546639443993668e-02 | PASS |
| intel-2022b_impi | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| intel-2022a_impi | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| eb_foss-2022a | -1.042949458890976e+01 | -6.217248937900877e-14 | -1.193329930499209e-01 | PASS |
| foss-2022a_mpi_omp | -1.042949458890976e+01 | -5.684341886080801e-14 | -1.091044507884991e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.042949458890974e+01 | -4.440892098500626e-14 | -8.523785217851490e-02 | PASS |
| eb_foss-2022a_debug | -1.042949458890976e+01 | -6.217248937900877e-14 | -1.193329930499209e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.042949458890976e+01 | -6.217248937900877e-14 | -1.193329930499209e-01 | PASS |
| spack_foss-2022a_serial_min | -1.042949458890976e+01 | -6.394884621840902e-14 | -1.227425071370614e-01 | PASS |
| spack_foss-2022a_serial_opt | -1.042949458890976e+01 | -6.039613253960852e-14 | -1.159234789627803e-01 | PASS |
| spack_foss-2022a_serial_debug | -1.042949458890976e+01 | -6.394884621840902e-14 | -1.227425071370614e-01 | PASS |
| intel-2022a_omp_impi | -1.042949458890976e+01 | -5.684341886080801e-14 | -1.091044507884991e-01 | PASS |
| eb_foss-2022a_mpi | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| spack_foss-2022a_serial_omp | -1.042949458890975e+01 | -4.618527782440651e-14 | -8.864736626565549e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.042949458890975e+01 | -5.329070518200751e-14 | -1.022854226142179e-01 | PASS |
| eb_foss-2022a_valgrind | -1.042949458890976e+01 | -6.217248937900877e-14 | -1.193329930499209e-01 | PASS |