Atom.C 1.65 KB
Newer Older
Francois Gygi committed
1 2
////////////////////////////////////////////////////////////////////////////////
//
Francois Gygi committed
3 4 5 6
// Copyright (c) 2008 The Regents of the University of California
//
// This file is part of Qbox
//
Francois Gygi committed
7 8
// Qbox is distributed under the terms of the GNU General Public License
// as published by the Free Software Foundation, either version 2 of
Francois Gygi committed
9 10 11 12 13 14
// the License, or (at your option) any later version.
// See the file COPYING in the root directory of this distribution
// or <http://www.gnu.org/licenses/>.
//
////////////////////////////////////////////////////////////////////////////////
//
Francois Gygi committed
15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50
// Atom.C:
//
////////////////////////////////////////////////////////////////////////////////

#include "Atom.h"
#include <iomanip>
using namespace std;

Atom::Atom (string newname, string newspecies, D3vector pos, D3vector vel)
{
  name_ = newname;
  species_ = newspecies;
  position_ = pos;
  velocity_ = vel;
}

ostream& operator << ( ostream &os, Atom &a )
{
  os.setf(ios::left,ios::adjustfield);
  os << "  <atom name=\"" << a.name() << "\""
     << " species=\"" << a.species() << "\">\n"
     << "    <position> ";
  os.setf(ios::fixed,ios::floatfield);
  os.setf(ios::right,ios::adjustfield);
  os << setw(12) << setprecision(8) << a.position().x << " "
     << setw(12) << setprecision(8) << a.position().y << " "
     << setw(12) << setprecision(8) << a.position().z << "  "
     << " </position>\n"
     << "    <velocity> ";
  os.setf(ios::scientific,ios::floatfield);
  os << setw(13) << setprecision(6) << a.velocity().x << " "
     << setw(13) << setprecision(6) << a.velocity().y << " "
     << setw(13) << setprecision(6) << a.velocity().z
     << " </velocity>\n  </atom>" << endl;
  return os;
}