Go to the source code of this file.
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module | qs_scf |
| Routines for the Quickstep SCF run.
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subroutine, public | qs_scf::scf (qs_env, has_converged, total_scf_steps) |
| perform an scf procedure in the given qs_env More...
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subroutine, public | qs_scf::scf_env_do_scf (scf_env, scf_control, qs_env, converged, should_stop, total_scf_steps) |
| perform an scf loop More...
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subroutine, public | qs_scf::scf_env_cleanup (scf_env) |
| perform cleanup operations (like releasing temporary storage) at the end of the scf More...
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subroutine, public | qs_scf::cdft_scf (qs_env, should_stop) |
| perform a CDFT scf procedure in the given qs_env More...
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