MultipoleMultipoleTerm.h File Reference

#include <Utils/Math/AutomaticDifferentiation/AutomaticDifferentiationHelpers.h>

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Classes
class	Scine::Sparrow::nddo::multipole::MultipoleMultipoleTerm
	This header-only class defines an object for the calculation of an interaction between two charges in a multipole. More...

Functions
template<>
Utils::AutomaticDifferentiation::Value1DType < Utils::DerivativeOrder::Zero >	Scine::Sparrow::nddo::multipole::MultipoleMultipoleTerm::expr< Utils::DerivativeOrder::Zero > (double f, double, double invsqrt) const
template<>
Utils::AutomaticDifferentiation::Value1DType < Utils::DerivativeOrder::One >	Scine::Sparrow::nddo::multipole::MultipoleMultipoleTerm::expr< Utils::DerivativeOrder::One > (double f, double dz, double invsqrt) const
template<>
Utils::AutomaticDifferentiation::Value1DType < Utils::DerivativeOrder::Two >	Scine::Sparrow::nddo::multipole::MultipoleMultipoleTerm::expr< Utils::DerivativeOrder::Two > (double f, double dz, double invsqrt) const

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.