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1 //
2 // ********************************************************************
3 // * License and Disclaimer *
4 // * *
5 // * The Geant4 software is copyright of the Copyright Holders of *
6 // * the Geant4 Collaboration. It is provided under the terms and *
7 // * conditions of the Geant4 Software License, included in the file *
8 // * LICENSE and available at http://cern.ch/geant4/license . These *
9 // * include a list of copyright holders. *
10 // * *
11 // * Neither the authors of this software system, nor their employing *
12 // * institutes,nor the agencies providing financial support for this *
13 // * work make any representation or warranty, express or implied, *
14 // * regarding this software system or assume any liability for its *
15 // * use. Please see the license in the file LICENSE and URL above *
16 // * for the full disclaimer and the limitation of liability. *
17 // * *
18 // * This code implementation is the result of the scientific and *
19 // * technical work of the GEANT4 collaboration. *
20 // * By using, copying, modifying or distributing the software (or *
21 // * any work based on the software) you agree to acknowledge its *
22 // * use in resulting scientific publications, and indicate your *
23 // * acceptance of all terms of the Geant4 Software license. *
24 // ********************************************************************
25 //
26 // Contact: Mathieu Karamitros (kara (AT) cenbg . in2p3 . fr)
27 //
28 // WARNING : This class is released as a prototype.
29 // It might strongly evolve or even disapear in the next releases.
30 //
31 // The code is developed in the framework of the ESA AO7146
32 //
33 // We would be very happy hearing from you, send us your feedback! :)
34 //
35 // In order for Geant4-DNA to be maintained and still open-source,
36 // article citations are crucial.
37 // If you use Geant4-DNA chemistry and you publish papers about your software,
38 // in addition to the general paper on Geant4-DNA:
39 //
40 // Int. J. Model. Simul. Sci. Comput. 1 (2010) 157–178
41 //
42 // we ask that you please cite the following reference papers on chemistry:
43 //
44 // J. Comput. Phys. 274 (2014) 841-882
45 // Prog. Nucl. Sci. Tec. 2 (2011) 503-508
46 //
47 // ----------------------------------------------------------------
48 // GEANT 4 class header file
49 //
50 // History: first implementation, Alfonso Mantero 6 Mar 2009
51 // ----------------------------------------------------------------
52 //
53
54 #pragma once
55
56 #include <vector>
57 #include <map>
58 #include "G4VMolecularDissociationDisplacer.hh"
59
60 class G4Molecule;
61 class G4MolecularConfiguration;
62
63 class G4MolecularDissociationChannel
64 {
65 public:
66 G4MolecularDissociationChannel();
67 explicit G4MolecularDissociationChannel(const G4String&);
68 ~G4MolecularDissociationChannel() = default;
69 G4MolecularDissociationChannel(const G4MolecularDissociationChannel&) = default;
70
71 G4MolecularDissociationChannel&
72 operator=(const G4MolecularDissociationChannel& right) = default;
73
74 using Product = const G4MolecularConfiguration;
75 using ProductList = std::vector<Product*>;
76
77 public:
78
79 void AddProduct(Product*, G4double displacement = 0.);
80
81 inline void SetName(const G4String&);
82 inline void SetEnergy(G4double);
83 inline void SetProbability(G4double);
84 inline void SetDecayTime(G4double);
85 inline void SetRMSMotherMoleculeDisplacement(G4double);
86 inline void SetDisplacementType(DisplacementType);
87
88
89 inline const G4String& GetName() const;
90 G4int GetNbProducts() const;
91 Product* GetProduct(int) const;
92 inline const std::vector<G4double>& GetRMSProductsDisplacement() const;
93 inline G4double GetEnergy() const;
94 inline G4double GetProbability() const;
95 inline G4double GetDecayTime() const;
96 inline G4double GetRMSMotherMoleculeDisplacement() const;
97 inline DisplacementType GetDisplacementType() const;
98
99 G4double GetRMSRadialDisplacementOfProduct(Product*);
100
101 private:
102 DisplacementType fDisplacementType;
103 G4String fName;
104 ProductList fProductsVector;
105 G4double fReleasedEnergy;
106 G4double fProbability;
107 G4double fDecayTime;
108 // Root Mean Square radial distance jump of the mother molecule
109 G4double fRMSMotherMoleculeDisplacement;
110 std::vector<G4double> fRMSProductsDisplacementVector;
111 };
112
113 //______________________________________________________________________________
114
115 inline void G4MolecularDissociationChannel::SetName(const G4String& value)
116 {
117 fName = value;
118 }
119
120 //______________________________________________________________________________
121
122 inline void G4MolecularDissociationChannel::SetEnergy(G4double value)
123 {
124 fReleasedEnergy = value;
125 }
126
127 //______________________________________________________________________________
128
129 inline void G4MolecularDissociationChannel::SetProbability(G4double value)
130 {
131 fProbability = value;
132 }
133
134 //______________________________________________________________________________
135
136 inline void G4MolecularDissociationChannel::SetDecayTime(G4double value)
137 {
138
139 fDecayTime = value;
140 }
141
142 //______________________________________________________________________________
143
144 inline void G4MolecularDissociationChannel::
145 SetRMSMotherMoleculeDisplacement(G4double value)
146 {
147 fRMSMotherMoleculeDisplacement = value;
148 }
149
150 //______________________________________________________________________________
151
152 inline const G4String& G4MolecularDissociationChannel::GetName() const
153 {
154 return fName;
155 }
156
157 //______________________________________________________________________________
158
159 inline const std::vector<G4double>&
160 G4MolecularDissociationChannel::GetRMSProductsDisplacement() const
161 {
162 return fRMSProductsDisplacementVector;
163 }
164
165 //______________________________________________________________________________
166
167 inline G4double G4MolecularDissociationChannel::GetEnergy() const
168 {
169 return fReleasedEnergy;
170 }
171
172 //______________________________________________________________________________
173
174 inline G4double G4MolecularDissociationChannel::GetProbability() const
175 {
176 return fProbability;
177 }
178
179 //______________________________________________________________________________
180
181 inline G4double G4MolecularDissociationChannel::GetDecayTime() const
182 {
183 return fDecayTime;
184 }
185
186 //______________________________________________________________________________
187
188 inline G4double G4MolecularDissociationChannel::
189 GetRMSMotherMoleculeDisplacement() const
190 {
191 return fRMSMotherMoleculeDisplacement;
192 }
193
194 //______________________________________________________________________________
195
196 inline void G4MolecularDissociationChannel::
197 SetDisplacementType(DisplacementType aDisplacementType)
198 {
199 fDisplacementType = aDisplacementType;
200 }
201
202 //______________________________________________________________________________
203
204 inline DisplacementType G4MolecularDissociationChannel::
205 GetDisplacementType() const
206 {
207 return fDisplacementType;
208 }
209