Match Bader value 2
Commits >
Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 >
Run spack_foss-2022a_cuda_serial >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-5.937999980022230e-02 | -5.938005341481400e-02 | 7.620000000000000e-13 | FAIL |
Command: LINEFIELD(static/bader.y=0\,z=0, 6, 2)