Match comparison for Exchange energy (match type 21509)
Commits >
Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 >
Input 37-sternheimer_polarized.01-gs.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.743574180000000e+00 | 2.370000000000000e-07 | -4.743574180000000e+00 | 0.000000000000000e+00 | -4.743574180000000e+00 | 0.000000000000000e+00 | PASS |
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Detailed information
Reference: -4.7435741799999995, precision: 0.000000237| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_ppc | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| cmake_foss_2022a_min_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| cmake_foss_2022a_min_mpi | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| cmake_foss_2022a_full_mpi | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_mpi_min | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_mpi | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_serial_min | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_mpi | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_mpi_min | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_serial_min | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_mpi_opt | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_mpi_debug | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_serial_opt | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023b_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_serial_debug | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_serial_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_intel-2022a_serial_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_mpi_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_intel-2023a_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_intel-2023a_impi | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2023a_valgrind | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_intel-2023a_serial_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_intel-2022a_impi_omp | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |
| spack_foss-2022a_cuda_serial | -4.743574180000000e+00 | -8.881784197001252e-16 | -3.747588268776900e-09 | PASS |