Match comparison for Total Energy (match type 22688)
Commits >
Commit d6f4833c99197407842d58e82c91c418d3d73b88 >
Input 06-octopus_basics-periodic_systems.02-silicon_converged.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.935492050000001e+00 | 3.970000000000000e-07 | -7.935491950000000e+00 | 0.000000000000000e+00 | -7.935491950000000e+00 | 0.000000000000000e+00 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -7.935492050000001, precision: 0.000000397| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_serial_min | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_serial_opt | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023b_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_ppc | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_mpi_min | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_mpi_min | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_serial_debug | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_serial_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_mpi_opt | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_mpi | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_mpi | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| cmake_foss_2022a_full_mpi | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_cuda_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_mpi_debug | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_foss-2023a_mpi_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| cmake_foss_2022a_min_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| cmake_foss_2022a_full_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| cmake_foss_2022a_min_mpi | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_intel-2023a_serial | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_intel-2022a_serial_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_intel-2023a_serial_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_intel-2023a_impi | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |
| spack_intel-2022a_impi_omp | -7.935491950000000e+00 | 1.000000002804313e-07 | 2.518891694721192e-01 | PASS |