Match SCF convergence
Commits >
Commit 0eb882d93dcc47f8554e98f5f256d6c6053dae9c >
Run spack_foss-2023a_serial >
Input 04-ACBN0_isolated.02-H_packed.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 7.020000000000000e-06 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')