Match SCF convergence
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 32-tdpcm_methane.01-ground_state.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')