Scine::Sparrow
5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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#include <Sparrow/Implementations/Nddo/Am1/AM1Method.h>
#include <Sparrow/Implementations/Nddo/NDDOMethodWrapper.h>
#include <Utils/CalculatorBasics/PropertyList.h>
#include <string>
Go to the source code of this file.
Classes | |
class | Scine::Sparrow::AM1TypeMethodWrapper< AM1Type > |
A parent class for all AM1-type methods using the same formalism but different parameters (AM1, RM1, PM3). This class uses the curiously recurrent template pattern to have compile-time resolution of the model names, as well as the use of the right constructor. The constructors are method-dependant, having independent classes would lead to unwanted code duplication. More... | |
class | Scine::Sparrow::AM1MethodWrapper |
class | Scine::Sparrow::RM1MethodWrapper |
class | Scine::Sparrow::PM3MethodWrapper |