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175 lines
4.2 KiB
175 lines
4.2 KiB
#ifndef SPECTRUM_H
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#define SPECTRUM_H
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/***************************************************************************
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* Copyright (C) 2005 by Carsten Niehaus *
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* cniehaus@kde.org *
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*
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* *
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* This program is free software; you can redistribute it and/or modify *
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* it under the terms of the GNU General Public License as published by *
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* the Free Software Foundation; either version 2 of the License, or *
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* (at your option) any later version. *
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* *
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* This program is distributed in the hope that it will be useful, *
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* but WITHOUT ANY WARRANTY; without even the implied warranty of *
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* MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the *
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* GNU General Public License for more details. *
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* *
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* You should have received a copy of the GNU General Public License *
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* along with this program; if not, write to the *
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* Free Software Foundation, Inc., *
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* 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301, USA. *
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***************************************************************************/
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#include <tqstring.h>
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#include <tqvaluelist.h>
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class TQPixmap;
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class Element;
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/**
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* @author Carsten Niehaus
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*
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* This class represents an spectrum with all its properties
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*/
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class Spectrum
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{
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public:
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/**
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* This spectrum doesn't belong to any element
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*/
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Spectrum(){}
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/**
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* public destructor
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*/
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~Spectrum(){}
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/**
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* a band is one line in the spectrum of an element
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*/
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struct band
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{
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///in nm)
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double wavelength;
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///Transition Probabilities
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///10^8s-1 (1000000000 per second)
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double aki;
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///number of energylevels per centimeter
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double energy1;
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///number of energylevels per centimeter
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double energy2;
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///relative. The highest is per definition 1000
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int intensity;
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TQString electronconfig1;
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TQString electronconfig2;
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TQString term1;
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TQString term2;
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TQString J1;
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TQString J2;
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};
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/**
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* adds the band @p b to the internal
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* lists of bands
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*/
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void addBand( band b ){
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m_bandlist.append( b );
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}
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/**
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* @param min the lowest allowed wavalength in nanometer
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* @param max the highest allowed wavalength in nanometer
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*
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* @returns a spectrum with the wavelength in the range
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* of @p min to @p max. The intensities are readjusted
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* so that the biggest intensity is again 1000 and the
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* others are adopted.
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*/
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Spectrum* adjustToWavelength( double min, double max );
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/**
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* sets the highest intensity to 1000 and adjusts the
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* others
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*/
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void adjustIntensities();
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/**
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* @param min the lowest allowed wavalength in nanometer
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* @param max the highest allowed wavalength in nanometer
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*
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* @return the wavelength in a TQValueList<double>
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*/
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TQValueList<double> wavelengths( double min, double max );
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/**
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* @return the smallest wavelength
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*/
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double min() const{
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return m_min;
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}
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/**
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* @return the highest wavelength
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*/
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double max() const{
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return m_max;
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}
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/**
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* @return the list of bands of the spectrum
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*/
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TQValueList<band>* bandlist(){
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return &m_bandlist;
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}
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/**
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* cache the values of the biggest and
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* smallest wavelenght
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*/
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void adjustMinMax(){
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m_min = minBand();
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m_max = maxBand();
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}
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/**
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* @return the data of a spectrum as HTML code
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*/
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TQString bandsAsHtml();
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/**
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* @return the tqparent element of this spectrum
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*/
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Element* parentElement()
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{ return m_parentElement; }
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private:
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/**
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* @return the smallest wavelength
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*/
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double minBand();
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/**
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* @return the biggest wavelength
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*/
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double maxBand();
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/**
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* the internal dataset
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*/
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TQValueList<band> m_bandlist;
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/**
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* the cached values of the highest and lowest wavelength
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*/
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double m_max, m_min;
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Element* m_parentElement;
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};
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#endif // SPECTRUM_H
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