Match Bader value 1
Commits >
Commit 2b00e292f829221e67a290b840b53bb41bb59499 >
Run cmake_foss_2022a_full_serial >
Input 08-symmetrization_mgga.01-spg3_sym.inp
Value | Reference | Precision | Status |
-3.601189489254740e-02 | -3.601189489308860e-02 | 6.140000000000000e-13 | PASS |
Command: LINEFIELD(static/bader.y=0\,z=0, 5, 2)