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Scine::Sparrow
4.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "ZeroOrderMatricesCalculator.h"#include "SKPair.h"#include <Utils/DataStructures/AtomsOrbitalsIndexes.h>#include <Utils/DataStructures/DensityMatrix.h>#include <Utils/Geometry/ElementInfo.h>#include <Utils/Math/AutomaticDifferentiation/MethodsHelpers.h>#include <Utils/Math/DerivOrderEnum.h>#include <Utils/Typenames.h>#include <cmath>