Scine::Sparrow
5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include "GenericMethodWrapper.h"
#include "DipoleMatrixCalculator.h"
#include "DipoleMomentCalculator.h"
#include "MoldenFileGenerator.h"
#include "Sto6gParameters.h"
#include "Utils/Scf/LcaoUtils/SpinMode.h"
#include <Utils/CalculatorBasics/PropertyList.h>
#include <Core/Exceptions.h>
#include <Sparrow/StatesHandling/SparrowState.h>
#include <Utils/CalculatorBasics.h>
#include <Utils/GeometricDerivatives/NumericalHessianCalculator.h>
#include <Utils/Geometry/AtomCollection.h>
#include <Utils/Geometry/ElementInfo.h>
#include <Utils/IO/NativeFilenames.h>
#include <Utils/Scf/MethodExceptions.h>
#include <Utils/Scf/MethodInterfaces/LcaoMethod.h>
#include <Utils/Settings.h>
#include <Utils/UniversalSettings/SettingsNames.h>
#include <boost/filesystem.hpp>
#include <fstream>
#include <memory>