Match comparison for Hartree energy (match type 26857)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 3.356150013750000e+02 | 1.700000000000000e-07 | 3.356150015070371e+02 | 8.118632410602303e-08 | 3.356150013750000e+02 | 1.549999808503344e-07 | PASS |
Checks for this match
- GPU builders have different values.
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Detailed information
Reference: 335.615001375, precision: 0.00000017| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_ppc | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| cmake_foss_2022a_min_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| cmake_foss_2022a_min_mpi | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| cmake_foss_2022a_full_mpi | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_mpi_min | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_mpi | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_serial_min | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_mpi | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_mpi_min | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_serial_min | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_mpi_opt | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_mpi_debug | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_serial_opt | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023b_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_serial_debug | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_serial_omp | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_intel-2022a_serial_omp | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2023a_mpi_omp | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_intel-2023a_serial | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_intel-2023a_impi | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 3.356150012200000e+02 | -1.550000092720438e-07 | -9.117647604237873e-01 | PASS |
| spack_intel-2023a_serial_omp | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_intel-2022a_impi_omp | 3.356150015300000e+02 | 1.549999524286250e-07 | 9.117644260507352e-01 | PASS |
| spack_foss-2022a_cuda_serial | 3.356150012200000e+02 | -1.550000092720438e-07 | -9.117647604237873e-01 | PASS |