Match Bader value 1
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_intel-2022a_impi >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-3.601189489255310e-02 | -3.601189489308860e-02 | 6.140000000000000e-13 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 5, 2)