Match comparison for Total energy (match type 3411)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.575421500000000e-01 | 3.000000000000000e-05 | -4.575391592857144e-01 | 7.236856488660705e-07 | -4.575379550000000e-01 | 1.405000000009871e-06 | 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: -0.45754215, precision: 0.00003| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_ppc | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| cmake_foss_2022a_min_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| cmake_foss_2022a_min_mpi | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| cmake_foss_2022a_full_mpi | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_mpi_min | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_mpi | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_serial_min | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_mpi | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_mpi_min | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_serial_min | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_mpi_opt | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_mpi_debug | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_serial_opt | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023b_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_serial_debug | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_serial_omp | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_intel-2022a_serial_omp | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_mpi_omp | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_intel-2023a_serial | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_intel-2023a_impi | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2023a_valgrind | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -4.575365500000000e-01 | 5.599999999994498e-06 | 1.866666666664833e-01 | PASS |
| spack_intel-2023a_serial_omp | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_intel-2022a_impi_omp | -4.575393600000000e-01 | 2.789999999974757e-06 | 9.299999999915856e-02 | PASS |
| spack_foss-2022a_cuda_serial | -4.575365500000000e-01 | 5.599999999994498e-06 | 1.866666666664833e-01 | PASS |