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atom.h

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00001 /**************************************************************************************************
00002 *****           Copyright (C) 2005  John Schneiderman <JohnMS@member.fsf.org>                  *****
00003 *****                                                                                          *****
00004 *****           This program is free software; you can redistribute it and/or modify           *****
00005 *****           it under the terms of the GNU General Public License as published by           *****
00006 *****           the Free Software Foundation; either version 2 of the License, or              *****
00007 *****           (at your option) any later version.                                            *****
00008 *****                                                                                          *****
00009 *****           This program is distributed in the hope that it will be useful,                *****
00010 *****           but WITHOUT ANY WARRANTY; without even the implied warranty of                 *****
00011 *****           MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the                  *****
00012 *****           GNU General Public License for more details.                                   *****
00013 *****                                                                                          *****
00014 *****           You should have received a copy of the GNU General Public License              *****
00015 *****           along with this program; if not, write to the Free Software                    *****
00016 *****           Foundation, Inc., 51 Franklin St, Fifth Floor, Boston, MA  02110-1301  USA     *****
00017 ***************************************************************************************************/
00018 #ifndef _ATOM_H_
00019 #define _ATOM_H_
00020 
00021 #include "coordinate.h"
00022 
00028 class Atom
00029 {
00030 public:
00034     struct atom_t
00035     {
00037         Coordinate position;
00039         Coordinate velocity;
00041         Coordinate acceleration;
00043         double potentialEnergy;
00045         double kineticEnergy;
00046     };
00050     atom_t properties;
00051 
00055     Atom();
00060     Atom(const Atom &atom);
00066     Atom& operator=(const Atom &rhs);
00073     bool operator==(const Atom &rhs) const;
00080     bool operator!=(const Atom &rhs) const;
00081 };
00082 #endif

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