Match Initial energy
Commits >
Commit 705c4760eef009c58a165e8716adc8057257a566 >
Run intel-serial: [intel2023a-serial] >
Input 19-td_move_ions.01-gs.inp
Value | Reference | Precision | Status |
-2.964437820000000e+01 | -2.964437820000000e+01 | 1.480000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)