Match comparison for gga_x_g96 Exchange (match type 12316)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.265492950000000e-01 | 4.020000000000000e-06 | -3.265523977777778e-01 | 1.912826749304046e-06 | -3.265492900000000e-01 | 3.660000000016428e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.326549295, precision: 0.00000402| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial_min | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2023a_serial_min | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2023a_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_ppc | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2023a_mpi_min | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2023a_serial_debug | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2023a_mpi_opt | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2022a_mpi | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2023a_mpi | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.265456300000000e-01 | 3.665000000041552e-06 | 9.116915422988935e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.265456400000000e-01 | 3.654999999991304e-06 | 9.092039800973394e-01 | PASS |
| spack_foss-2023a_mpi_debug | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2023a_mpi_omp | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2023a_serial_opt | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2023b_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_intel-2023a_serial | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.265529300000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_intel-2023a_impi | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_intel-2022a_impi_omp | -3.265529500000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |