Match SCF convergence
Commits >
Commit e2663e21d2b19b776c1ae6497ca3d74f14dbf310 >
Run eb_foss-2022a_mpi >
Input 14-carbon_dojo_psp8.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')