B.3.3 SCF Control
(July 14, 2022)
| BASIS2 |
BASISPROJTYPE |
| DIIS_PRINT |
DIIS_SUBSPACE_SIZE |
| DIRECT_SCF |
INCFOCK |
| MAX_DIIS_CYCLES |
MAX_SCF_CYCLES |
| PSEUDO_CANONICAL |
SCF_ALGORITHM |
| SCF_CONVERGENCE |
SCF_FINAL_PRINT |
| SCF_GUESS |
SCF_GUESS_MIX |
| SCF_GUESS_PRINT |
SCF_PRINT |
| THRESH |
THRESH_DIIS_SWITCH |
| UNRESTRICTED |
VARTHRESH |
| S2THRESH |
|
