Match Eigenvalue [1up]
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run foss-serial-full: [foss2023b-serial] >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
-4.545927000000000e+00 | -4.545943000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, '1 up', 3)