| 1 | /*
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| 2 | * ion.hpp
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| 3 | *
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| 4 | * Created on: Mar 10, 2014
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef ION_HPP_
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| 9 | #define ION_HPP_
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| 10 |
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| 11 | /*********************************************** includes ***********************************/
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| 12 |
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| 13 | // include config.h
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| 14 | #ifdef HAVE_CONFIG_H
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| 15 | #include <config.h>
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| 16 | #endif
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| 17 |
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| 18 | #include <iosfwd>
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| 19 | #include <string>
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| 20 |
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| 21 | #include "Element/element.hpp"
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| 22 | #include "types.hpp"
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| 23 |
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| 24 | #include "boost/serialization/access.hpp"
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| 25 |
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| 26 | class periodentafel;
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| 27 |
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| 28 | /********************************************** declarations *******************************/
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| 29 |
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| 30 | /** Ion of a chemical element.
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| 31 | *
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| 32 | * This class extends element with an ionization.
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| 33 | */
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| 34 | class ion : public element
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| 35 | {
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| 36 | friend class periodentafel;
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| 37 | public:
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| 38 | ion(const element& _element, const int _ionization);
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| 39 | ion(const element* const _element, const int _ionization);
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| 40 | virtual ~ion();
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| 41 |
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| 42 | ion& operator=(const element &other);
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| 43 | ion& operator=(const ion &other);
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| 44 |
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| 45 | // accessor functions
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| 46 | virtual atomicNumber_t getAtomicNumber() const;
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| 47 | virtual double getCharge() const;
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| 48 | virtual double getValence() const;
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| 49 | virtual int getNoValenceOrbitals() const;
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| 50 |
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| 51 | bool operator==(const element &other) const;
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| 52 | bool operator!=(const element &other) const;
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| 53 | bool operator==(const ion &other) const;
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| 54 | bool operator!=(const ion &other) const {
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| 55 | return !(*this == other);
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| 56 | }
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| 57 |
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| 58 | private:
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| 59 | friend class boost::serialization::access;
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| 60 | // private default cstor, just for serialization
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| 61 | ion();
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| 62 |
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| 63 | // serialization
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| 64 | template<class Archive>
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| 65 | void serialize(Archive & ar, const unsigned int version)
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| 66 | {
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| 67 | ar & boost::serialization::base_object<element>(*this);
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| 68 | ar & const_cast<int &>(ionization);
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| 69 | }
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| 70 |
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| 71 | const int ionization; //!< missing or surplus electrons of this ion
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| 72 | };
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| 73 |
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| 74 | std::ostream &operator<<(std::ostream&,const ion&);
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| 75 |
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| 76 | #endif /* ION_HPP_ */
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