sisi4s
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UPerturbativeTriples.hpp
Go to the documentation of this file.
1#ifndef UPERTURBATIVE_TRIPLES_DEFINED
2#define UPERTURBATIVE_TRIPLES_DEFINED
3
5
6namespace sisi4s {
11public:
13 UPerturbativeTriples(std::vector<Argument> const &argumentList);
14 virtual ~UPerturbativeTriples();
19 virtual void run();
20
24 virtual void dryRun();
25};
26} // namespace sisi4s
27
28#endif
#define ALGORITHM_REGISTRAR_DECLARATION(NAME)
Auxiliary macro declaring the algorithm registrar for the algorithm type of the given name....
Definition Algorithm.hpp:169
Definition Algorithm.hpp:26
Caclulates perturbative triples correction.
Definition UPerturbativeTriples.hpp:10
virtual ~UPerturbativeTriples()
Definition UPerturbativeTriples.cxx:17
virtual void run()
Calculates perturbative triples correction. Routine based on Helgaker book.
Definition UPerturbativeTriples.cxx:19
virtual void dryRun()
Dry run for perturbative triples correction based on Helgaker book.
Definition UPerturbativeTriples.cxx:315
Definition Algorithm.hpp:10