Match Eigenvalue [1up]
Commits >
Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d >
Run spack_intel-2023a_serial_omp >
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)