RepulsionTerm.cpp File Reference

#include "RepulsionTerm.h"
#include <Utils/Geometry/AtomCollection.h>
#include <Utils/Geometry/ElementInfo.h>
#include <Utils/Math/AutomaticDifferentiation/AutomaticDifferentiationHelpers.h>
#include <Utils/Math/FullSecondDerivativeCollection.h>

Include dependency graph for RepulsionTerm.cpp:

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.