Match Bader value 2
Commits >
Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 >
Run spack_foss-2022a_cuda_serial >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-5.938005341547560e-02 | -5.938005341481400e-02 | 7.620000000000000e-13 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)