Input 04-silicon.03-emresp.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Re Epsilon XX w=0.0 | 1.438332100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 8.449900000000099e-02 | FAIL |
| Re Epsilon YY w=0.0 | 1.438332100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 8.449900000000099e-02 | FAIL |
| Re Epsilon ZZ w=0.0 | 1.438332100000000e+01 | 1.429882200000000e+01 | 7.150000000000000e-06 | 8.449900000000099e-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 | 2.917379300000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 1.079469999999993e-01 | FAIL |
| Re Epsilon YY w=0.1 | 2.917379300000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 1.079469999999993e-01 | FAIL |
| Re Epsilon ZZ w=0.1 | 2.917379300000000e+01 | 2.906584600000000e+01 | 1.450000000000000e-05 | 1.079469999999993e-01 | 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 | 1.528432200000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | 9.975000000000733e-03 | FAIL |
| Im Epsilon YY w=0.1 | 1.528432200000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | 9.975000000000733e-03 | FAIL |
| Im Epsilon ZZ w=0.1 | 1.528432200000000e+01 | 1.527434700000000e+01 | 7.640000000000000e-06 | 9.975000000000733e-03 | 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 | 1.163140000000000e-01 | -1.828300000000000e-02 | 9.140000000000001e-06 | 1.345970000000000e-01 | FAIL |
| Born charge 1 ZZ w=0.0 | 1.163140000000000e-01 | -1.828300000000000e-02 | 9.140000000000001e-06 | 1.345970000000000e-01 | 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 | -8.974699999999999e-02 | -5.479100000000001e-02 | 2.740000000000000e-05 | -3.495599999999999e-02 | FAIL |
| Born charge diff w=0.0 | 1.185500000000000e-02 | -3.653600000000001e-02 | 1.830000000000000e-05 | 4.839100000000000e-02 | FAIL |
| Born charge 1 XX w=0.1 | -2.644840000000000e+00 | -2.812991000000000e+00 | 1.410000000000000e-05 | 1.681510000000004e-01 | FAIL |
| Born charge 1 ZZ w=0.1 | -2.644840000000000e+00 | -2.812991000000000e+00 | 1.410000000000000e-05 | 1.681510000000004e-01 | 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 | -3.138083000000000e+00 | -3.096609000000000e+00 | 1.550000000000000e-05 | -4.147400000000001e-02 | FAIL |
| Born charge diff w=0.1 | -2.892284000000000e+00 | -2.954800000000000e+00 | 1.480000000000000e-05 | 6.251600000000002e-02 | FAIL |
| Born charge diff w=0.1 | -2.427813000000000e+00 | -2.395780000000000e+00 | 1.200000000000000e-05 | -3.203299999999976e-02 | FAIL |