Match eigenvalue [2]
Commits >
Commit 995bec41f97239ed4859b75e5397558b96cd16ab >
Run spack_foss-2023a_mpi_opt >
Input 29-pcm_chlorine_anion.01-ground_state-n60.inp
Value | Reference | Precision | Status |
-5.576121000000000e+00 | -5.576105000000000e+00 | 2.790000000000000e-05 | PASS |
Command: GREPFIELD(static/info, '2 --', 3)