Match Initial energy
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Run spack_foss-2022a_serial_debug >
Input 13-absorption-spin.01-gs.inp
| Value | Reference | Precision | Status |
| -6.134127260000000e+00 | -6.134127260000000e+00 | 3.070000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)