Match comparison for Force 2 (y) (match type 24708)
Commits >
Commit 2ba62b4e5b3c7dac99914e88831daed234f640f9 >
Input 09-symmetrization_gga.01-spg143_nosym.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.665787580000000e-01 | 1.330000000000000e-08 | -2.659114048148148e-01 | 2.359449813454435e-03 | -2.620741240000000e-01 | 4.504634000000007e-03 | FAIL |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -0.266578758, precision: 0.0000000133| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_ppc | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_min | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_opt | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_opt | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022b | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022a | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_full_mpi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_omp | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_debug | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_omp | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_fosscuda-2022a | -2.575694900000000e-01 | 9.009268000000015e-03 | 6.773885714285725e+05 | FAIL |
| intel-2022a_omp | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022b_impi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022a_impi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_fosscuda-2022a_mpi_omp | -2.575694900000000e-01 | 9.009268000000015e-03 | 6.773885714285725e+05 | FAIL |
| cmake_foss_2022a_min_serial | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| foss-2022a_mpi_omp | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| cmake_foss_2022a_min_mpi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022b_libxc6 | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_debug | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| intel-2022a_omp_impi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022b_libxc6_mpi | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi_debug | -2.665787580000000e-01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |