Match comparison for gga_x_xpbe Exchange (match type 12388)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.207269800000000e-01 | 4.040000000000000e-06 | -3.207300955555556e-01 | 1.920683391760254e-06 | -3.207269750000000e-01 | 3.675000000008533e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.32072698, precision: 0.00000404| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2022a_serial_min | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2023a_serial_min | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2023a_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2022a_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2022a_ppc | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2023a_mpi_min | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2023a_serial_debug | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2023a_mpi_opt | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2022a_mpi | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2023a_mpi | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.207233000000000e-01 | 3.680000000005901e-06 | 9.108910891103714e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.207233100000000e-01 | 3.670000000011164e-06 | 9.084158415869218e-01 | PASS |
| spack_foss-2023a_mpi_debug | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2023a_mpi_omp | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_foss-2023a_serial_opt | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2023b_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_intel-2023a_serial | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.207306300000000e-01 | -3.650000000021691e-06 | -9.034653465400225e-01 | PASS |
| spack_intel-2023a_impi | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |
| spack_intel-2022a_impi_omp | -3.207306500000000e-01 | -3.670000000011164e-06 | -9.084158415869218e-01 | PASS |