Match Eigenvalue [1up]
Commits >
Commit 58dcf5562fbb52d037ca78866f8fd352b3754746 >
Run eb_foss-2022b_libxc6 >
Input 28-carbon_big_box.01-ground_state.inp
Value | Reference | Precision | Status |
-4.545948000000000e+00 | -4.545943000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPFIELD(static/info, '1 up', 3)