| [238868] | 1 | /*
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 | 2 |  * VMGDebugGridJob.hpp
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 | 3 |  *
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 | 4 |  *  Created on: Aug 31, 2012
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 | 5 |  *      Author: heber
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 | 6 |  */
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 | 7 | 
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 | 8 | #ifndef VMGDEBUGGRIDJOB_HPP_
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 | 9 | #define VMGDEBUGGRIDJOB_HPP_
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 | 10 | 
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 | 11 | 
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 | 12 | // include config.h
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 | 13 | #ifdef HAVE_CONFIG_H
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 | 14 | #include <config.h>
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 | 15 | #endif
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 | 16 | 
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 | 17 | #include "boost/serialization/export.hpp"
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 | 18 | #include "boost/serialization/vector.hpp"
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 | 19 | 
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 | 20 | #include "JobMarket/Jobs/FragmentJob.hpp"
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| [fbf143] | 21 | #include "Fragmentation/Summation/SetValues/SamplingGrid.hpp"
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| [238868] | 22 | 
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 | 23 | #include <vector>
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 | 24 | 
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 | 25 | /** This class encapsulates a Debug Grid Job.
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 | 26 |  *
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 | 27 |  *  VMGDebugGridJob just stores the sampled grid into a VMG job and lets VMG
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 | 28 |  *  print the grid in a VTK compatible format to make use of its grid_viewer
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 | 29 |  *  for debugging purposes.
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 | 30 |  *
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 | 31 |  */
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 | 32 | class VMGDebugGridJob : public FragmentJob
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 | 33 | {
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 | 34 | public:
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 | 35 |   /** Constructor for class VMGDebugGridJob.
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 | 36 |    *
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 | 37 |    * @param _JobId id of the job
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 | 38 |    * @param _density_grid sampled electron charge density from short-range solutions
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| [f6c19d] | 39 |    * @param OpenBoundaryConditions states whether we have open (true) or periodic
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 | 40 |    *        (false) boundary conditions
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| [238868] | 41 |    */
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 | 42 |   VMGDebugGridJob(const JobId_t _JobId,
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| [f6c19d] | 43 |       const SamplingGrid &density_grid,
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 | 44 |       const bool _OpenBoundaryConditions = false);
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| [238868] | 45 |   virtual ~VMGDebugGridJob();
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 | 46 | 
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 | 47 |   FragmentResult::ptr Work();
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 | 48 | 
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 | 49 | private:
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 | 50 |   void InitVMG();
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 | 51 | 
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 | 52 | private:
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 | 53 |   //!> sampled density required as input
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 | 54 |   const SamplingGrid density_grid;
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| [f6c19d] | 55 |   //!> states whether we have open (true) or periodic (false) boundary conditions
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 | 56 |   const bool OpenBoundaryConditions;
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| [238868] | 57 | 
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 | 58 | private:
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 | 59 |   /** private default cstor for serialization only
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 | 60 |    */
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 | 61 |   VMGDebugGridJob();
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 | 62 | 
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 | 63 |   friend class boost::serialization::access;
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 | 64 |   // serialization
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 | 65 |   template <typename Archive>
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 | 66 |   void serialize(Archive& ar, const unsigned int version)
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 | 67 |   {
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 | 68 |     ar & boost::serialization::base_object<FragmentJob>(*this);
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 | 69 |     ar & const_cast< SamplingGrid &>(density_grid);
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 | 70 |   }
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 | 71 | };
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 | 72 | 
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 | 73 | // we need to give this class a unique key for serialization
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 | 74 | // its is only serialized through its base class FragmentJob
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 | 75 | BOOST_CLASS_EXPORT_KEY(VMGDebugGridJob)
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 | 76 | 
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 | 77 | #endif /* VMGDEBUGGRIDJOB_HPP_ */
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