Match SCF convergence
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run valgrind: [foss2023a-serial] >
Input 06-carbon_dojo_pbe.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')