Match comparison for MO Re eps (w/o G=0) (match type 28904)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.393539750000000e-03 | 5.660000000000000e-09 | -1.393539262962963e-03 | 4.283313717901079e-09 | -1.393542750000000e-03 | 7.950000000000491e-09 | 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: -0.0013935397499999999, precision: 0.00000000566| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| foss-2022a_ppc | -1.393537200000000e-03 | 2.549999999785363e-09 | 4.505300352977673e-01 | PASS |
| spack_foss-2022a_serial_min | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| spack_foss-2022a_serial_opt | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| spack_foss-2022a_serial | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| foss-2022a_opt | -1.393534800000000e-03 | 4.949999999953256e-09 | 8.745583038786671e-01 | PASS |
| intel-2022b | -1.393544900000000e-03 | -5.150000000021457e-09 | -9.098939929366532e-01 | PASS |
| intel-2022a | -1.393544900000000e-03 | -5.150000000021457e-09 | -9.098939929366532e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.393536200000000e-03 | 3.549999999909528e-09 | 6.272084805493866e-01 | PASS |
| spack_foss-2022a_serial_omp | -1.393536500000000e-03 | 3.249999999807227e-09 | 5.742049469624075e-01 | PASS |
| spack_foss-2022a_serial_debug | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| foss-2022a_omp | -1.393535700000000e-03 | 4.049999999863191e-09 | 7.155477031560408e-01 | PASS |
| eb_fosscuda-2022a | -1.393550700000000e-03 | -1.095000000004773e-08 | -1.934628975273450e+00 | FAIL |
| intel-2022a_omp | -1.393537300000000e-03 | 2.449999999968103e-09 | 4.328621908070853e-01 | PASS |
| intel-2022b_impi | -1.393536100000000e-03 | 3.649999999943629e-09 | 6.448763250783797e-01 | PASS |
| intel-2022a_impi | -1.393536100000000e-03 | 3.649999999943629e-09 | 6.448763250783797e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.393547800000000e-03 | -8.050000000143012e-09 | -1.422261484124207e+00 | FAIL |
| cmake_foss_2022a_min_serial | -1.393540000000000e-03 | -2.500000000852515e-10 | -4.416961132248259e-02 | PASS |
| foss-2022a_mpi_omp | -1.393535500000000e-03 | 4.249999999931392e-09 | 7.508833922140269e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.393536200000000e-03 | 3.549999999909528e-09 | 6.272084805493866e-01 | PASS |
| eb_foss-2022a | -1.393534800000000e-03 | 4.949999999953256e-09 | 8.745583038786671e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.393537100000000e-03 | 2.649999999819463e-09 | 4.681978798267603e-01 | PASS |
| eb_foss-2022a_debug | -1.393534800000000e-03 | 4.949999999953256e-09 | 8.745583038786671e-01 | PASS |
| intel-2022a_omp_impi | -1.393537300000000e-03 | 2.449999999968103e-09 | 4.328621908070853e-01 | PASS |
| eb_foss-2022a_mpi | -1.393545000000000e-03 | -5.250000000055557e-09 | -9.275618374656462e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.393536200000000e-03 | 3.549999999909528e-09 | 6.272084805493866e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.393545000000000e-03 | -5.250000000055557e-09 | -9.275618374656462e-01 | PASS |