Match SCF convergence
Commits >
Commit 16cdfcecc1be9b3eac0dbe4ff8b1dc79e6b9a001 >
Run foss_min_autotools: [foss2023a-serial] >
Input 23-td_qedft_breit_pxlda_adiabatic.01-gs.inp
Value | Reference | Precision | Status |
1.000000000000000e+00 | 1.000000000000000e+00 | 2.000000000000000e-08 | PASS |
Command: GREPCOUNT(static/info, 'SCF converged')