Match comparison for Hartree-Fock exchange energy (match type 15653)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -6.700426400000000e-01 | 1.000000000000000e-04 | -6.700426399999999e-01 | 1.110223024625157e-16 | -6.700426400000000e-01 | 0.000000000000000e+00 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -0.67004264, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_serial | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_serial | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_mpi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_fosscuda-2022a | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_mpi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_debug | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022b_libxc6 | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022b_libxc6_mpi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022b | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a_omp | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi_debug | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a_impi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_mpi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_min | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022b_impi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_debug | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_omp | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_opt | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_mpi_omp | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a_omp_impi | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_valgrind | -6.700426400000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |