Scine::Sparrow
5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include <Core/Interfaces/CalculatorWithReference.h>
#include <Utils/CalculatorBasics/Results.h>
#include <exception>
#include <memory>
#include <ostream>
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Classes | |
class | Scine::Sparrow::MethodNotAvailableException |
Exception thrown if a non available method is requested. More... | |
struct | Scine::Sparrow::FileInaccessibleException |
class | Scine::Sparrow::CalculationHandler |
Class handling the main calculation routines. More... | |