Match SCF convergence
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run cuda-mpi-omp: [foss2022a-cuda-mpi] >
Input 39-adsic.02-polarized.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 4.640000000000000e-01 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')