Input 03-orthorombic.08-spg23.inp
Commits >
Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 >
Run foss-serial-full: [foss2023b-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| Space group | 2.300000000000000e+01 | 2.300000000000000e+01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| No. of symmetries | 4.000000000000000e+00 | 4.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| S1 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| S2 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| S3 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| S4 | 0.000000000000000e+00 | 0.000000000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Total k-points | 6.400000000000000e+01 | 6.400000000000000e+01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| Reduced k-points | 1.800000000000000e+01 | 1.800000000000000e+01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 1 | 1.560000000000000e-02 | 1.563000000000000e-02 | 1.000000000000000e-04 | -3.000000000000225e-05 | PASS |
| kpt 2 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 3 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 4 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 5 | 1.250000000000000e-01 | 1.250000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 6 | 1.250000000000000e-01 | 1.250000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 7 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 8 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 9 | 1.250000000000000e-01 | 1.250000000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 10 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 11 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 12 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 13 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 14 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 15 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 16 | 6.250000000000000e-02 | 6.250000000000000e-02 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| kpt 17 | 3.120000000000000e-02 | 3.125000000000000e-02 | 1.000000000000000e-04 | -5.000000000000143e-05 | PASS |
| kpt 18 | 1.560000000000000e-02 | 1.563000000000000e-02 | 1.000000000000000e-04 | -3.000000000000225e-05 | PASS |