/*
* Project: MoleCuilder
* Description: creates and alters molecular systems
* Copyright (C) 2013 University of Bonn. All rights reserved.
*
*
* This file is part of MoleCuilder.
*
* MoleCuilder is free software: you can redistribute it and/or modify
* it under the terms of the GNU General Public License as published by
* the Free Software Foundation, either version 2 of the License, or
* (at your option) any later version.
*
* MoleCuilder is distributed in the hope that it will be useful,
* but WITHOUT ANY WARRANTY; without even the implied warranty of
* MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
* GNU General Public License for more details.
*
* You should have received a copy of the GNU General Public License
* along with MoleCuilder. If not, see .
*/
/*
* Eigenvalues.cpp
*
* Created on: Mar 8, 2013
* Author: heber
*/
// include config.h
#ifdef HAVE_CONFIG_H
#include
#endif
#include "CodePatterns/MemDebug.hpp"
#include "Eigenvalues.hpp"
#include
void Eigenvalues::superposeOtherEigenvalues(const Eigenvalues &other, const double prefactor)
{
for (sorted_samples_t::const_iterator otheriter = other.samples.begin();
otheriter != other.samples.end();
++otheriter) {
sorted_samples_t::iterator iter = samples.find(*otheriter);
if (iter == samples.end())
samples.insert((*otheriter));
else
samples.erase(iter);
}
}
std::ostream & operator<<(std::ostream &ost, const Eigenvalues &eigenvalues)
{
for (Eigenvalues::sorted_samples_t::const_iterator iter = eigenvalues.samples.begin();
iter != eigenvalues.samples.end(); ++iter)
ost << "(" << *iter << ",1.) ";
return ost;
}
template<> Eigenvalues ZeroInstance()
{
Eigenvalues returnvalue;
return returnvalue;
}