Match Bader value 2
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_cuda_autotools: [foss2022a-cuda-mpi] >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-5.938003030681690e-02 | -5.938003030683320e-02 | 2.880000000000000e-14 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)