Match comparison for Hartree energy (match type 17006)
Commits >
Commit 995bec41f97239ed4859b75e5397558b96cd16ab >
Input 12-intersite_spinors.01-Na2_gs.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.189202900000000e-01 | 1.000000000000000e-04 | 4.189201500000000e-01 | 0.000000000000000e+00 | 4.189201500000000e-01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: 0.41892029, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_ppc | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| cmake_foss_2022a_min_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| cmake_foss_2022a_full_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| cmake_foss_2022a_min_mpi | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| cmake_foss_2022a_full_mpi | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_mpi_min | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_mpi | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_serial_min | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2022a_cuda_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_mpi | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_mpi_min | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_serial_min | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_mpi_opt | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_serial_opt | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_mpi_debug | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_serial_debug | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023b_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_serial_omp | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_intel-2022a_serial_omp | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_mpi_omp | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_intel-2023a_serial | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_foss-2023a_valgrind | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_intel-2023a_impi | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |
| spack_intel-2022a_impi_omp | 4.189201500000000e-01 | -1.399999999818213e-07 | -1.399999999818213e-03 | PASS |