Match SCF convergence
Commits >
Commit 32ddd3547162625b90bad3fe3e58ca7314bc5873 >
Run spack_foss-2022a_serial_debug >
Input 16-sodium_chain_cylinder.03-ground_state_disp.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 5.910000000000000e-06 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')