| [358ddb] | 1 | /*
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| 2 | * VMGDataMap.hpp
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| 3 | *
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| 4 | * Created on: Aug 8, 2012
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| 5 | * Author: heber
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| 6 | */
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| 7 |
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| 8 | #ifndef VMGDATAMAP_HPP_
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| 9 | #define VMGDATAMAP_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/fusion/container/map.hpp>
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| 18 | #include <boost/mpl/list.hpp>
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| 19 |
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| [d200ae] | 20 | #include <vector>
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| 21 |
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| [fbf143] | 22 | #include "Fragmentation/Summation/Containers/VMGDataFused.hpp"
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| [358ddb] | 23 |
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| 24 | class SamplingGrid;
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| [d200ae] | 25 | class IndexedVectors;
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| [358ddb] | 26 |
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| 27 | /** This boost::fusion map defines key-value or rather key-type pairs with
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| 28 | * which we associate all sampled_grid data members in VMGData and their type.
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| 29 | *
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| 30 | * This lets us resolves any ambiguitites of types in VMGData, e.g.
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| 31 | * to know vector<double> is forces or energy_eigenvalues.
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| 32 | *
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| 33 | */
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| 34 | typedef boost::fusion::map<
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| [e2925fd] | 35 | boost::fusion::pair<VMGDataFused::nuclei_long, double >,
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| [d200ae] | 36 | boost::fusion::pair<VMGDataFused::electron_long, double >,
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| 37 | boost::fusion::pair<VMGDataFused::particle_forces, IndexedVectors >
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| [358ddb] | 38 | > VMGDataMap_t;
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| 39 |
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| 40 | typedef boost::mpl::list<
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| [e2925fd] | 41 | VMGDataFused::nuclei_long,
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| [d200ae] | 42 | VMGDataFused::electron_long,
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| 43 | VMGDataFused::particle_forces
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| [358ddb] | 44 | > VMGDataVector_t;
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| 45 |
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| [83a425] | 46 | typedef boost::fusion::map<
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| 47 | boost::fusion::pair<VMGDataFused::sampled_potential, SamplingGrid >,
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| 48 | boost::fusion::pair<VMGDataFused::both_sampled_potential, SamplingGrid >
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| 49 | > VMGDataGridMap_t;
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| 50 |
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| 51 | typedef boost::mpl::list<
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| 52 | VMGDataFused::sampled_potential,
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| 53 | VMGDataFused::both_sampled_potential
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| 54 | > VMGDataGridVector_t;
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| 55 |
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| [a2295a] | 56 | /** This boost::fusion map defines key-value or rather key-type pairs with
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| 57 | * which we associate all sampled_grid data members in VMGData and their type.
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| 58 | *
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| 59 | * This lets us resolves any ambiguitites of types in VMGData, e.g.
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| 60 | * to know vector<double> is forces or energy_eigenvalues.
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| 61 | *
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| 62 | */
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| 63 | typedef boost::fusion::map<
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| [67fec1] | 64 | boost::fusion::pair<VMGDataFused::electron_longrange, double >,
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| 65 | boost::fusion::pair<VMGDataFused::electron_shortrange, double >,
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| [e2925fd] | 66 | boost::fusion::pair<VMGDataFused::mixed_longrange, double >,
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| 67 | boost::fusion::pair<VMGDataFused::mixed_shortrange, double >,
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| [67fec1] | 68 | boost::fusion::pair<VMGDataFused::nuclei_longrange, double >,
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| 69 | boost::fusion::pair<VMGDataFused::nuclei_shortrange, double >,
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| 70 | boost::fusion::pair<VMGDataFused::total_longrange, double >,
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| 71 | boost::fusion::pair<VMGDataFused::total_shortrange, double >
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| [a2295a] | 72 | > VMGDataLongRangeMap_t;
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| 73 |
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| 74 | typedef boost::mpl::list<
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| [67fec1] | 75 | VMGDataFused::electron_longrange,
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| 76 | VMGDataFused::electron_shortrange,
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| [e2925fd] | 77 | VMGDataFused::mixed_longrange,
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| 78 | VMGDataFused::mixed_shortrange,
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| [67fec1] | 79 | VMGDataFused::nuclei_longrange,
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| 80 | VMGDataFused::nuclei_shortrange,
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| 81 | VMGDataFused::total_longrange,
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| 82 | VMGDataFused::total_shortrange
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| [a2295a] | 83 | > VMGDataLongRangeVector_t;
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| 84 |
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| [358ddb] | 85 |
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| 86 | #endif /* VMGDATAMAP_HPP_ */
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