Match Initial energy
Commits >
Commit 567670ad21bfa0dcf9eec7f6790e7f8f129ccb1e >
Run cmake_foss_2022a_full_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)