Match Initial energy
Commits >
Commit 701869cc1eb5c6c77a64efba9e1ed1058e4204f9 >
Run intel-min-parallel: [intel2022a-mpi] >
Input 22-td_move_ions_periodic.01-gs.inp
Value | Reference | Precision | Status |
-2.965691066000000e+01 | -2.965691066000000e+01 | 1.480000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)