Match comparison for Total energy (match type 29829)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -7.004666172100000e+02 | 1.210000000000000e-06 | -7.004666174185716e+02 | 4.237899941402576e-07 | -7.004666171550000e+02 | 7.649999815839692e-07 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -700.46661721, precision: 0.00000121| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_serial_min | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_serial | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_serial | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_serial_opt | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023b_serial | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_ppc | -7.004666171000000e+02 | 1.099999735743040e-07 | 9.090906906967273e-02 | PASS |
| spack_foss-2023a_mpi_min | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_mpi_min | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_serial_debug | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_serial_omp | -7.004666163900000e+02 | 8.199999683711212e-07 | 6.776859242736538e-01 | PASS |
| spack_foss-2023a_mpi_opt | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_mpi | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2023a_mpi | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| cmake_foss_2022a_full_mpi | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_cuda_serial | -7.004666170900000e+02 | 1.199999815071351e-07 | 9.917353843564883e-02 | PASS |
| spack_foss-2023a_mpi_debug | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -7.004666165700000e+02 | 6.399999392669997e-07 | 5.289255696421485e-01 | PASS |
| spack_foss-2023a_mpi_omp | -7.004666164000000e+02 | 8.099999604382901e-07 | 6.694214549076778e-01 | PASS |
| cmake_foss_2022a_min_serial | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| cmake_foss_2022a_full_serial | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| cmake_foss_2022a_min_mpi | -7.004666176900000e+02 | -4.800000397153781e-07 | -3.966942476986596e-01 | PASS |
| spack_intel-2023a_serial | -7.004666171500000e+02 | 5.999993391014868e-08 | 4.958672223979230e-02 | PASS |
| spack_intel-2022a_serial_omp | -7.004666170900000e+02 | 1.199999815071351e-07 | 9.917353843564883e-02 | PASS |
| spack_intel-2023a_serial_omp | -7.004666170600000e+02 | 1.500000053056283e-07 | 1.239669465335771e-01 | PASS |
| spack_intel-2023a_impi | -7.004666171300000e+02 | 7.999994977581082e-08 | 6.611566097174447e-02 | PASS |
| spack_intel-2022a_impi_omp | -7.004666170900000e+02 | 1.199999815071351e-07 | 9.917353843564883e-02 | PASS |
| spack_foss-2023a_valgrind | -7.004666179200000e+02 | -7.099999947968172e-07 | -5.867768552039812e-01 | PASS |