Input 04-silicon.03-emresp.inp
Commits >
Commit 9a893b9dbe73f1d3f49cd24e2707361da541a5ca >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Re Epsilon XX w=0.0 | 1.431408100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 1.525900000000036e-02 | FAIL |
| Re Epsilon YY w=0.0 | 1.431408100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 1.525900000000036e-02 | FAIL |
| Re Epsilon ZZ w=0.0 | 1.431408100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 1.525900000000036e-02 | FAIL |
| Re Epsilon XY w=0.0 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Re Epsilon XX w=0.1 | 2.912097400000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 5.512799999999984e-02 | FAIL |
| Re Epsilon YY w=0.1 | 2.912097400000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 5.512799999999984e-02 | FAIL |
| Re Epsilon ZZ w=0.1 | 2.912097400000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 5.512799999999984e-02 | FAIL |
| Re Epsilon XY w=0.1 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Im Epsilon XX w=0.1 | 1.525467500000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | -1.967199999999814e-02 | FAIL |
| Im Epsilon YY w=0.1 | 1.525467500000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | -1.967199999999814e-02 | FAIL |
| Im Epsilon ZZ w=0.1 | 1.525467500000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | -1.967199999999814e-02 | FAIL |
| Im Epsilon XY w=0.1 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Born charge 1 XX w=0.0 | 1.410000000000000e-04 | -1.828300000000000e-02 | 9.140000000000001e-06 | 1.842400000000000e-02 | FAIL |
| Born charge 1 ZZ w=0.0 | 1.410000000000000e-04 | -1.828300000000000e-02 | 9.140000000000001e-06 | 1.842400000000000e-02 | FAIL |
| Born charge 1 XZ w=0.0 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Born charge 5 XX w=0.0 | 5.498700000000000e-02 | -5.479100000000001e-02 | 2.740000000000000e-05 | 1.097780000000000e-01 | FAIL |
| Born charge diff w=0.0 | 2.946400000000000e-02 | -3.653600000000001e-02 | 1.830000000000000e-05 | 6.600000000000000e-02 | FAIL |
| Born charge 1 XX w=0.1 | -2.803637000000000e+00 | -2.812991000000000e+00 | 1.410000000000000e-05 | 9.354000000000084e-03 | FAIL |
| Born charge 1 ZZ w=0.1 | -2.803637000000000e+00 | -2.812991000000000e+00 | 1.410000000000000e-05 | 9.354000000000084e-03 | FAIL |
| Born charge 1 XZ w=0.1 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Born charge 5 XX w=0.1 | -2.954584000000000e+00 | -3.096609000000000e+00 | 1.550000000000000e-05 | 1.420249999999998e-01 | FAIL |
| Born charge diff w=0.1 | -2.877991000000000e+00 | -2.954800000000000e+00 | 1.480000000000000e-05 | 7.680899999999991e-02 | FAIL |
| Born charge diff w=0.1 | -2.366054000000000e+00 | -2.395780000000000e+00 | 1.200000000000000e-05 | 2.972600000000014e-02 | FAIL |