source/scf/diis_general.cc File Reference
General DIISManager class that can be used as a base class in implementations of direct inversion in the iterative subspace (DIIS) for restricted and unrestricted cases.
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#include <unistd.h>
#include "diis_general.h"
#include "utilities.h"
#include "output.h"
#include "memorymanag.h"
Detailed Description
General DIISManager class that can be used as a base class in implementations of direct inversion in the iterative subspace (DIIS) for restricted and unrestricted cases.
- Author:
- : Elias Rudberg responsible.
Typedef Documentation