Scine::Sparrow
5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "OverlapMatrix.h"
#include <Sparrow/Implementations/Nddo/Utils/ParameterUtils/ElementParameters.h>
#include <Utils/DataStructures/AtomsOrbitalsIndexes.h>
#include <Utils/Math/AutomaticDifferentiation/AutomaticDifferentiationHelpers.h>