Match comparison for gga_x_b88 Exchange (match type 12292)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.228328750000000e-01 | 4.020000000000000e-06 | -3.228359759259259e-01 | 1.913717071980510e-06 | -3.228328650000000e-01 | 3.665000000013796e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.322832875, precision: 0.00000402| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial_min | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| foss-2022a_ppc | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| foss-2022a_opt | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| intel-2022b | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| intel-2022a | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| spack_foss-2022a_serial_omp | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| foss-2022a_omp | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| intel-2022a_omp | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| intel-2022b_impi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| intel-2022a_impi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -3.228292200000000e-01 | 3.655000000046815e-06 | 9.092039801111481e-01 | PASS |
| eb_fosscuda-2022a | -3.228292000000000e-01 | 3.675000000036288e-06 | 9.141791044866390e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| foss-2022a_mpi_omp | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| eb_foss-2022a | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| eb_foss-2022b_libxc6 | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| eb_foss-2022a_debug | -3.228365100000000e-01 | -3.635000000001831e-06 | -9.042288557218486e-01 | PASS |
| intel-2022a_omp_impi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| eb_foss-2022a_mpi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |
| eb_foss-2022a_mpi_debug | -3.228365300000000e-01 | -3.654999999991304e-06 | -9.092039800973394e-01 | PASS |