Match Bader value 1
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run spack_foss-2023a_mpi_opt >
Input 07-symmetrization_lda.03-spg75_sym.inp
Value | Reference | Precision | Status |
4.403399221302770e-02 | 4.403399221249041e-02 | 2.210000000000000e-12 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)