votca 2026-dev
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podcoupling.h File Reference
#include "logger.h"
#include "votca/xtp/orbitals.h"
#include <votca/tools/types.h>
#include <votca/xtp/aobasis.h>
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Classes

class  votca::xtp::PODCoupling

Namespaces

namespace  votca
 Provides a means for comparing floating point numbers.
namespace  votca::xtp
 Charge transport classes.

Macros

#define VOTCA_XTP_PODCOUPLING_H

Functions

std::vector< Indexvotca::xtp::MapAtomsToAOIndices (const std::vector< Index > &atom_indices, const std::vector< Index > &func_per_atom)

Macro Definition Documentation

◆ VOTCA_XTP_PODCOUPLING_H

#define VOTCA_XTP_PODCOUPLING_H

Definition at line 22 of file podcoupling.h.