SKPair.h File Reference

#include "RepulsionParameters.h"
#include "Sparrow/Implementations/Dftb/Utils/SkfParser.h"
#include "Utils/Math/DerivOrderEnum.h"
#include <Utils/Math/AutomaticDifferentiation/MethodsHelpers.h>
#include <vector>

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Classes
struct	Scine::Sparrow::dftb::InterpolationValues< O >
class	Scine::Sparrow::dftb::SKPair
struct	Scine::Sparrow::dftb::SKPair::GammaTerms
struct	Scine::Sparrow::dftb::SKPair::GammaDerivativeTerms

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.