Match Bader value 2
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-5.938004748163650e-02 | -5.938003030683320e-02 | 1.890000000000000e-08 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)