Match Bader value 2
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run spack_foss-2023a_serial >
Input 08-symmetrization_mgga.01-spg3_sym.inp
| Value | Reference | Precision | Status |
| -5.938005341550190e-02 | -5.938005341481400e-02 | 7.620000000000000e-13 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)