Match Initial energy
Commits >
Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 >
Run spack_foss-2022a_serial >
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)