setup_dm.h

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#ifndef SETUP_DM_H
#define SETUP_DM_H 
 
#include "source_cell/klist.h" 
#include "source_basis/module_ao/parallel_orbitals.h"
#include "source_estate/module_dm/density_matrix.h"
 
#include <vector>
 
namespace LCAO_domain
{
template <typename TK>
class Setup_DM
{
    public:
 
    Setup_DM()
    {
    } // will be called by ElecStateLCAO_TDDFT
 
    ~Setup_DM()
    {
        if (this->dm != nullptr)
        {
            delete this->dm;
        }
    }
 
    // allocate density matrix
    void allocate_dm(const K_Vectors* kv, const Parallel_Orbitals* pv, const int nspin);
 
    elecstate::DensityMatrix<TK, double>* dm = nullptr;
 
};
 
 
} // namespace elecstate
 
#endif