Match Bader value 1
Commits >
Commit 6fea4ae0129736a1dfe4fc8183ca68b9f7403b45 >
Run foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] >
Input 09-symmetrization_gga.01-spg143_nosym.inp
Value | Reference | Precision | Status |
9.938291578683469e-03 | 9.938291578682999e-03 | 4.970000000000000e-14 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)