ergo
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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. More...
#include <unistd.h>
#include "diis_general.h"
#include "utilities.h"
#include "output.h"
#include "memorymanag.h"
Typedefs | |
typedef symmMatrix * | symmMatrixPtr |
typedef normalMatrix * | normalMatrixPtr |
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.
typedef normalMatrix* normalMatrixPtr |
typedef symmMatrix* symmMatrixPtr |