Match SCF convergence
Commits >
Commit f4bc596bdcf3afff33b833944576bfd5457df1bc >
Run valgrind: [foss2023a-serial] >
Input 16-platinum_psp8.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 1.000000000000000e-04 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')