Match Bader value 1
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run foss_autotools: [foss2023a-serial] >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-3.601191962058850e-02 | -3.601191962058630e-02 | 2.170000000000000e-14 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 5, 2)