Match Initial energy
Commits >
Commit 85779d3dd9ec6e18544835020e079bae8c405b87 >
Run spack_intel-2022a_impi_omp >
Input 22-td_move_ions_periodic.01-gs.inp
Value | Reference | Precision | Status |
-2.965697183000000e+01 | -2.965697182000000e+01 | 1.480000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)