SDFTB.h File Reference

#include "Utils/DataStructures/AtomsOrbitalsIndexes.h"
#include <Utils/Math/AutomaticDifferentiation/MethodsTypesHelper.h>
#include <Utils/Math/DerivOrderEnum.h>
#include <Eigen/Core>
#include <memory>
#include <vector>

Include dependency graph for SDFTB.h:

This graph shows which files directly or indirectly include this file:

Go to the source code of this file.

Classes
class	Scine::Sparrow::dftb::SDFTB

Detailed Description

Copyright

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