Match comparison for gga_x_pbe_jsjr Exchange (match type 12352)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.072079250000000e-01 | 3.750000000000000e-06 | -3.072108151851852e-01 | 1.780574959937437e-06 | -3.072079200000000e-01 | 3.410000000009239e-06 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: -0.307207925, precision: 0.00000375| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2022a_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2022a_cuda_serial | -3.072045100000000e-01 | 3.415000000006607e-06 | 9.106666666684285e-01 | PASS |
| spack_foss-2022a_ppc | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| cmake_foss_2022a_full_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2022a_mpi_min | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023a_mpi_min | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2022a_mpi | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023a_mpi | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023a_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.072045300000000e-01 | 3.395000000017134e-06 | 9.053333333379024e-01 | PASS |
| spack_foss-2023a_mpi_debug | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023a_mpi_opt | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023a_serial_min | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2023a_serial_debug | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2023a_serial_opt | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2023a_mpi_omp | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_foss-2023b_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_foss-2023a_serial_omp | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_intel-2023a_serial | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_intel-2022a_serial_omp | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_intel-2023a_serial_omp | -3.072113100000000e-01 | -3.385000000022398e-06 | -9.026666666726394e-01 | PASS |
| spack_intel-2022a_impi_omp | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| spack_intel-2023a_impi | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.072113300000000e-01 | -3.405000000011871e-06 | -9.080000000031655e-01 | PASS |