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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 "NDDOInitializer.h"#include <Sparrow/Implementations/Nddo/Utils/IntegralsEvaluationUtils/oneCenterTwoElectronIntegrals.h>#include <Sparrow/Implementations/Nddo/Utils/ParameterUtils/AtomicParameters.h>#include <Sparrow/Implementations/Nddo/Utils/ParameterUtils/PM6DiatomicParameters.h>#include <Sparrow/Implementations/Nddo/Utils/ParameterUtils/RawParameterProcessor.h>#include <Utils/Geometry/ElementInfo.h>#include <Utils/Scf/MethodExceptions.h>#include <Utils/Typenames.h>#include <cmath>