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NuclearRepulsionEnergy.cxx File Reference
#include <string>
#include <algorithms/NuclearRepulsionEnergy.hpp>
#include <util/Libint.hpp>
#include <util/Tensor.hpp>
#include <Sisi4s.hpp>
#include <util/Log.hpp>
#include <iostream>
#include <util/Emitter.hpp>
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Macros

#define LOGGER(_l)   LOG(_l, "NuclearRepulsionEnergy")
 

Functions

double getEnergy (const std::vector< libint2::Atom > &structure)
 

Macro Definition Documentation

◆ LOGGER

#define LOGGER (   _l)    LOG(_l, "NuclearRepulsionEnergy")

Function Documentation

◆ getEnergy()

double getEnergy ( const std::vector< libint2::Atom > &  structure)
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