Match Initial energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run spack_foss-2022a_serial >
Input 19-td_move_ions.01-gs.inp
Value | Reference | Precision | Status |
-2.964437839000000e+01 | -2.964437839000000e+01 | 1.480000000000000e-09 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)