NDDODipoleMatrixCalculator.h File Reference

#include "Sparrow/Implementations/Nddo/Utils/DipoleUtils/GTODipoleMatrixBlock.h"
#include <Sparrow/Implementations/DipoleMatrixCalculator.h>
#include <Utils/DataStructures/DipoleMatrix.h>
#include <Eigen/Core>
#include <memory>
#include <vector>

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Classes
class	Scine::Sparrow::NDDODipoleMatrixCalculator< NDDOMethod >
	Class responsible for the calculation of the dipole matrix. More...

Detailed Description

Copyright

This code is licensed under the 3-clause BSD license.
Copyright ETH Zurich, Laboratory of Physical Chemistry, Reiher Group.
See LICENSE.txt for details.