Match comparison for Eigenvalue (match type 11363)
Commits >
Commit 119356330ffc33ec037b7259f31bc868121af1f1 >
Input 01-octopus_basics-getting_started.02-H_atom_spin.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.690730000000000e-01 | 1.000000000000000e-04 | -2.691027500000000e-01 | 3.307189138834046e-06 | -2.690990000000000e-01 | 5.000000000005000e-06 | PASS |
Checks for this match
- GPU builders have different values. Intel® builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.269073, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| spack_foss-2022a_serial_min | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2023a_serial_min | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_serial_opt | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_serial | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_ppc | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_mpi_min | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2023a_mpi_min | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_mpi_opt | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_serial_debug | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_intel-2022a_serial_omp | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_mpi | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_intel-2023a_impi | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_mpi_debug | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |
| spack_foss-2022a_cuda_serial | -2.690940000000000e-01 | -2.099999999999325e-05 | -2.099999999999325e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -2.690940000000000e-01 | -2.099999999999325e-05 | -2.099999999999325e-01 | PASS |
| spack_intel-2022a_impi_omp | -2.691040000000000e-01 | -3.100000000000325e-05 | -3.100000000000325e-01 | PASS |