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#ifndef _LATTICE_H_ |
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#define _LATTICE_H_ |
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#ifndef APPLICATIONS_SIMPLEBUILDER_LATTICE_HPP |
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#define APPLICATIONS_SIMPLEBUILDER_LATTICE_HPP |
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#include "applications/simpleBuilder/BaseLattice.hpp" |
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#include <string> |
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#include <vector> |
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namespace oopse { |
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const std::stringFCCLatticeType = "FCC"; |
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const std::stringBCCLatticeType = "BCC"; |
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const std::stringHCPCLatticeType = "HCP"; |
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const std::stringOrthorhombicLatticeType = "ORTHORHOMBIC"; |
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const std::string FCCLatticeType = "FCC"; |
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const std::string BCCLatticeType = "BCC"; |
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const std::string HCPCLatticeType = "HCP"; |
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const std::string OrthorhombicLatticeType = "ORTHORHOMBIC"; |
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class CubicLattice : public BaseLattice{ |
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CubicLattice(); |
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public: |
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//get lattice constant of unit cell |
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virtual vector<double> getLatticeConstant(); |
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virtual std::vector<double> getLatticeConstant(); |
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//set lattice constant of unit cell |
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virtual void setLatticeConstant(const vector<double>& lc); |
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virtual void setLatticeConstant(const std::vector<double>& lc); |
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protected: |
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double latticeParam; |
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}; |
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class FCCLattice : public CubicLattice{ |
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public: |
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FCCLattice(); |
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virtual const std::stringgetLatticeType() {return FCCLatticeType;} |
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virtual const std::string getLatticeType() {return FCCLatticeType;} |
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virtual void update(); |
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}; |
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/* |
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class BCCLattice : public CubicLattice{ |
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public: |
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BCCLattice(); |
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virtual const std::stringgetLatticeType() {return BCCLatticeType;} |
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}; |
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class HCPLattice : public BaseLattice{ |
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public: |
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HCPLattice(); |
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virtual const std::stringgetLatticeType() {return HCPCLatticeType;} |
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}; |
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class OrthorhombicLattice : public BaseLattice{ |
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public: |
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OrthorhombicLattice(); |
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virtual const std::stringgetLatticeType() {return OrthorhombicLatticeType;} |
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}; |
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*/ |
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} |
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#endif |
