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25 // 25 //
26 // neutron_hp -- source file 26 // neutron_hp -- source file
27 // J.P. Wellisch, Nov-1996 27 // J.P. Wellisch, Nov-1996
28 // A prototype of the low energy neutron trans 28 // A prototype of the low energy neutron transport model.
29 // 29 //
30 // 24-Jan-07 Enable to use exact data only and 30 // 24-Jan-07 Enable to use exact data only and add warnig when substitute file is used T. Koi
31 // 30-Jan-07 Modified method of searching subs 31 // 30-Jan-07 Modified method of searching substitute isotope data by T. Koi
32 // 07-06-12 fix memory leaking by T. Koi 32 // 07-06-12 fix memory leaking by T. Koi
33 // 07-06-25 Change data selection logic when G 33 // 07-06-25 Change data selection logic when G4NEUTRONHP_SKIP_MISSING_ISOTOPES is turn on
34 // Natural Abundance data are allowed 34 // Natural Abundance data are allowed. by T. Koi
35 // 07-07-06 Allow _nat_ final state even for i 35 // 07-07-06 Allow _nat_ final state even for isotoped cross sections by T. Koi
36 // 08-09-01 Add protection that deuteron data 36 // 08-09-01 Add protection that deuteron data do not selected for hydrogen and so on by T. Koi
37 // 37 //
38 // P. Arce, June-2014 Conversion neutron_hp to 38 // P. Arce, June-2014 Conversion neutron_hp to particle_hp
39 // June-2019 - E. Mendoza --> Modification to 39 // June-2019 - E. Mendoza --> Modification to allow using an incomplete data library if the
40 // G4NEUTRONHP_SKIP_MISSING_ISOTOPES environme 40 // G4NEUTRONHP_SKIP_MISSING_ISOTOPES environmental flag is defined. The missing XS are set to 0.
41 // Oct-2019 - E. Mendoza --> remove restrictio 41 // Oct-2019 - E. Mendoza --> remove restriction of using isotopes with Z>92
42 // 42 //
43 // V. Ivanchenko, July-2023 Basic revision of 43 // V. Ivanchenko, July-2023 Basic revision of particle HP classes
44 44
45 #include "G4ParticleHPNames.hh" 45 #include "G4ParticleHPNames.hh"
46 46
47 #include "G4HadronicException.hh" 47 #include "G4HadronicException.hh"
48 #include "G4HadronicParameters.hh" 48 #include "G4HadronicParameters.hh"
49 #include "G4ParticleHPManager.hh" 49 #include "G4ParticleHPManager.hh"
50 #include "G4SandiaTable.hh" 50 #include "G4SandiaTable.hh"
51 #include "G4ios.hh" 51 #include "G4ios.hh"
52 52
53 #include <fstream> 53 #include <fstream>
54 54
55 const G4String G4ParticleHPNames::theString[10 55 const G4String G4ParticleHPNames::theString[100] = {
56 "Hydrogen", "Helium", "Lithium", 56 "Hydrogen", "Helium", "Lithium", "Berylium", "Boron", "Carbon",
57 "Nitrogen", "Oxygen", "Fluorine", 57 "Nitrogen", "Oxygen", "Fluorine", "Neon", "Sodium", "Magnesium",
58 "Aluminum", "Silicon", "Phosphorous" 58 "Aluminum", "Silicon", "Phosphorous", "Sulfur", "Chlorine", "Argon",
59 "Potassium", "Calcium", "Scandium", 59 "Potassium", "Calcium", "Scandium", "Titanium", "Vanadium", "Chromium",
60 "Manganese", "Iron", "Cobalt", 60 "Manganese", "Iron", "Cobalt", "Nickel", "Copper", "Zinc",
61 "Gallium", "Germanium", "Arsenic", 61 "Gallium", "Germanium", "Arsenic", "Selenium", "Bromine", "Krypton",
62 "Rubidium", "Strontium", "Yttrium", 62 "Rubidium", "Strontium", "Yttrium", "Zirconium", "Niobium", "Molybdenum",
63 "Technetium", "Ruthenium", "Rhodium", 63 "Technetium", "Ruthenium", "Rhodium", "Palladium", "Silver", "Cadmium",
64 "Indium", "Tin", "Antimony", 64 "Indium", "Tin", "Antimony", "Tellurium", "Iodine", "Xenon",
65 "Cesium", "Barium", "Lanthanum", 65 "Cesium", "Barium", "Lanthanum", "Cerium", "Praseodymium", "Neodymium",
66 "Promethium", "Samarium", "Europium", 66 "Promethium", "Samarium", "Europium", "Gadolinium", "Terbium", "Dysprosium",
67 "Holmium", "Erbium", "Thulium", 67 "Holmium", "Erbium", "Thulium", "Ytterbium", "Lutetium", "Hafnium",
68 "Tantalum", "Tungsten", "Rhenium", 68 "Tantalum", "Tungsten", "Rhenium", "Osmium", "Iridium", "Platinium",
69 "Gold", "Mercury", "Thallium", 69 "Gold", "Mercury", "Thallium", "Lead", "Bismuth", "Polonium",
70 "Astatine", "Radon", "Francium", 70 "Astatine", "Radon", "Francium", "Radium", "Actinium", "Thorium",
71 "Protactinium", "Uranium", "Neptunium", 71 "Protactinium", "Uranium", "Neptunium", "Plutonium", "Americium", "Curium",
72 "Berkelium", "Californium", "Einsteinium" 72 "Berkelium", "Californium", "Einsteinium", "Fermium"};
73 73
74 G4ParticleHPNames::G4ParticleHPNames(G4int max 74 G4ParticleHPNames::G4ParticleHPNames(G4int maxOffSet) : theMaxOffSet(maxOffSet)
75 { 75 {
76 fManager = G4ParticleHPManager::GetInstance( 76 fManager = G4ParticleHPManager::GetInstance();
77 } 77 }
78 78
79 G4String G4ParticleHPNames::GetName(G4int i) c << 79 G4String G4ParticleHPNames::GetName(G4int i)
80 { 80 {
81 return (i > 0 && i < 100) ? theString[i] : G 81 return (i > 0 && i < 100) ? theString[i] : G4String("");
82 } 82 }
83 83
84 G4String G4ParticleHPNames::itoa(G4int current << 84 G4String G4ParticleHPNames::itoa(G4int current)
85 { 85 {
86 const char theDigits[11] = "0123456789"; 86 const char theDigits[11] = "0123456789";
87 G4String result; 87 G4String result;
88 G4int digit; 88 G4int digit;
89 do { 89 do {
90 digit = current - 10 * (current / 10); 90 digit = current - 10 * (current / 10);
91 result = theDigits[digit] + result; 91 result = theDigits[digit] + result;
92 current /= 10; 92 current /= 10;
93 } while (current != 0); // Loop checking, 1 93 } while (current != 0); // Loop checking, 11.05.2015, T. Koi
94 return result; 94 return result;
95 } 95 }
96 96
97 G4ParticleHPDataUsed G4ParticleHPNames::GetNam 97 G4ParticleHPDataUsed G4ParticleHPNames::GetName(G4int A, G4int Z, G4int M, const G4String& base,
98 << 98 const G4String& rest, G4bool& aFlag)
99 { 99 {
100 // G4cout << Z << " " << A << " " << M << " 100 // G4cout << Z << " " << A << " " << M << " " << base << " " << rest << G4endl;
101 101
102 // Excited isomer indicator 102 // Excited isomer indicator
103 std::stringstream ss; 103 std::stringstream ss;
104 G4String sM; 104 G4String sM;
105 if (M > 0) { 105 if (M > 0) {
106 ss << "m"; 106 ss << "m";
107 ss << M; 107 ss << M;
108 ss >> sM; 108 ss >> sM;
109 ss.clear(); 109 ss.clear();
110 } 110 }
111 111
112 G4ParticleHPDataUsed result; 112 G4ParticleHPDataUsed result;
113 aFlag = true; 113 aFlag = true;
114 114
115 #ifdef G4VERBOSE 115 #ifdef G4VERBOSE
116 if (fManager->GetDEBUG()) 116 if (fManager->GetDEBUG())
117 G4cout << "Names::GetName entered for Z = 117 G4cout << "Names::GetName entered for Z = " << Z << ", A = " << A << G4endl;
118 #endif 118 #endif
119 119
120 G4int myA = A; 120 G4int myA = A;
121 G4int myZ = Z; 121 G4int myZ = Z;
122 122
123 G4String* theName = nullptr; 123 G4String* theName = nullptr;
124 G4String theFileName(""); 124 G4String theFileName("");
125 125
126 // G4int inc = 1; 126 // G4int inc = 1;
127 127
128 G4int flip_Z = 1; 128 G4int flip_Z = 1;
129 G4int delta_Z = 0; 129 G4int delta_Z = 0;
130 130
131 G4int flip_A = 1; 131 G4int flip_A = 1;
132 G4int delta_A = 0; 132 G4int delta_A = 0;
133 133
134 std::istringstream* check = nullptr; 134 std::istringstream* check = nullptr;
135 G4bool first = true; 135 G4bool first = true;
136 136
137 #ifdef G4VERBOSE 137 #ifdef G4VERBOSE
138 if (fManager->GetDEBUG()) 138 if (fManager->GetDEBUG())
139 G4cout << "entered GetName!!!" << G4endl; 139 G4cout << "entered GetName!!!" << G4endl;
140 #endif 140 #endif
141 141
142 do { 142 do {
143 aFlag = true; 143 aFlag = true;
144 auto biff = new G4String(); // delete her 144 auto biff = new G4String(); // delete here as theName
145 *biff = base + "/CrossSection/" + itoa(myZ 145 *biff = base + "/CrossSection/" + itoa(myZ) + "_" + itoa(myA) + sM + "_" + theString[myZ - 1];
146 146
147 delete theName; 147 delete theName;
148 theName = biff; 148 theName = biff;
149 result.SetName(*theName); 149 result.SetName(*theName);
150 result.SetA(myA); 150 result.SetA(myA);
151 result.SetZ(myZ); 151 result.SetZ(myZ);
152 result.SetM(M); 152 result.SetM(M);
153 delete check; 153 delete check;
154 154
155 check = new std::istringstream(std::ios::i 155 check = new std::istringstream(std::ios::in);
156 fManager->GetDataStream2(*theName, *check) 156 fManager->GetDataStream2(*theName, *check);
157 if (!(*check)) { 157 if (!(*check)) {
158 delete check; 158 delete check;
159 check = nullptr; 159 check = nullptr;
160 aFlag = false; 160 aFlag = false;
161 if (first) { 161 if (first) {
162 aFlag = true; 162 aFlag = true;
163 first = false; 163 first = false;
164 biff = new G4String(); // delete here 164 biff = new G4String(); // delete here as theName
165 *biff = base + "/CrossSection/" + itoa 165 *biff = base + "/CrossSection/" + itoa(myZ) + "_" + "nat" + "_" + theString[myZ - 1];
166 delete theName; 166 delete theName;
167 theName = biff; 167 theName = biff;
168 result.SetName(*theName); 168 result.SetName(*theName);
169 G4double natA = myZ / G4SandiaTable::G 169 G4double natA = myZ / G4SandiaTable::GetZtoA(myZ);
170 result.SetA(natA); 170 result.SetA(natA);
171 result.SetZ(myZ); 171 result.SetZ(myZ);
172 result.SetM(M); 172 result.SetM(M);
173 // check = new std::ifstream(*theName) 173 // check = new std::ifstream(*theName);
174 check = new std::istringstream(std::io 174 check = new std::istringstream(std::ios::in);
175 fManager->GetDataStream2(*theName, *ch 175 fManager->GetDataStream2(*theName, *check);
176 if (!(*check)) { 176 if (!(*check)) {
177 // check->close(); 177 // check->close();
178 delete check; 178 delete check;
179 check = nullptr; 179 check = nullptr;
180 aFlag = false; 180 aFlag = false;
181 } 181 }
182 else { 182 else {
183 biff = new G4String(); // delete he 183 biff = new G4String(); // delete here as theName
184 *biff = base + "/" + rest + "/" + it 184 *biff = base + "/" + rest + "/" + itoa(myZ) + "_" + "nat" + "_" + theString[myZ - 1];
185 if (rest == "/CrossSection") 185 if (rest == "/CrossSection")
186 *biff = base + rest + "/" + itoa(m 186 *biff = base + rest + "/" + itoa(myZ) + "_" + "nat" + "_" + theString[myZ - 1];
187 delete theName; 187 delete theName;
188 theName = biff; 188 theName = biff;
189 result.SetName(*theName); 189 result.SetName(*theName);
190 natA = myZ / G4SandiaTable::GetZtoA( 190 natA = myZ / G4SandiaTable::GetZtoA(myZ);
191 result.SetA(natA); 191 result.SetA(natA);
192 result.SetZ(myZ); 192 result.SetZ(myZ);
193 result.SetM(M); 193 result.SetM(M);
194 result.SetNaturalAbundanceFlag(); 194 result.SetNaturalAbundanceFlag();
195 } 195 }
196 } 196 }
197 } 197 }
198 else { 198 else {
199 G4double tmpA = myA; 199 G4double tmpA = myA;
200 std::istringstream* file = nullptr; 200 std::istringstream* file = nullptr;
201 G4String fileName; 201 G4String fileName;
202 202
203 if (rest == "/CrossSection") { 203 if (rest == "/CrossSection") {
204 fileName = base + rest + "/" + itoa(my 204 fileName = base + rest + "/" + itoa(myZ) + "_" + itoa(myA) + sM + "_" + theString[myZ - 1];
205 // if(fManager->GetDEBUG()) G4cout <<" 205 // if(fManager->GetDEBUG()) G4cout <<"HPWD 4a "<<*theName<<G4endl;
206 } 206 }
207 else { 207 else {
208 // For FS 208 // For FS
209 fileName = 209 fileName =
210 base + "/" + rest + "/" + itoa(myZ) 210 base + "/" + rest + "/" + itoa(myZ) + "_" + itoa(myA) + sM + "_" + theString[myZ - 1];
211 file = new std::istringstream(std::ios 211 file = new std::istringstream(std::ios::in);
212 fManager->GetDataStream2(fileName, *fi 212 fManager->GetDataStream2(fileName, *file);
213 213
214 if (*file) { 214 if (*file) {
215 // isotope FS 215 // isotope FS
216 // if(fManager->GetDEBUG()) G4cout < 216 // if(fManager->GetDEBUG()) G4cout <<"HPWD 4b1 "<<*theName<<G4endl;
217 } 217 }
218 else { 218 else {
219 // _nat_ FS 219 // _nat_ FS
220 fileName = base + "/" + rest + "/" + 220 fileName = base + "/" + rest + "/" + itoa(myZ) + "_" + "nat" + "_" + theString[myZ - 1];
221 221
222 delete file; 222 delete file;
223 file = new std::istringstream(std::i 223 file = new std::istringstream(std::ios::in);
224 G4ParticleHPManager::GetInstance()-> 224 G4ParticleHPManager::GetInstance()->GetDataStream2(fileName, *file);
225 if (*file) { 225 if (*file) {
226 // FS neither isotope nor _nat_ 226 // FS neither isotope nor _nat_
227 // if(fManager->GetDEBUG()) G4cout 227 // if(fManager->GetDEBUG()) G4cout <<"HPWD 4b2a "<<*theName<<G4endl;
228 G4double natA = myZ / G4SandiaTabl 228 G4double natA = myZ / G4SandiaTable::GetZtoA(myZ);
229 tmpA = natA; 229 tmpA = natA;
230 } 230 }
231 else { 231 else {
232 // if(fManager->GetDEBUG()) G4cout 232 // if(fManager->GetDEBUG()) G4cout <<"HPWD 4b2c "<<*theName<<G4endl;
233 fileName = "INVALID"; 233 fileName = "INVALID";
234 } 234 }
235 } 235 }
236 delete file; 236 delete file;
237 } 237 }
238 238
239 result.SetName(fileName); 239 result.SetName(fileName);
240 result.SetA(tmpA); 240 result.SetA(tmpA);
241 result.SetZ(myZ); 241 result.SetZ(myZ);
242 result.SetM(M); 242 result.SetM(M);
243 } 243 }
244 244
245 do { 245 do {
246 if (delta_Z > theMaxOffSet) { 246 if (delta_Z > theMaxOffSet) {
247 if (!fManager->GetSkipMissingIsotopes( 247 if (!fManager->GetSkipMissingIsotopes()) {
248 #ifdef G4VERBOSE 248 #ifdef G4VERBOSE
249 if (fManager->GetVerboseLevel() > 0) 249 if (fManager->GetVerboseLevel() > 0) {
250 G4cout << "G4ParticleHPNames: Ther 250 G4cout << "G4ParticleHPNames: There are no data available for some isotopes in this "
251 "material " 251 "material "
252 << G4endl; 252 << G4endl;
253 G4cout << "G4ParticleHPNames: nor 253 G4cout << "G4ParticleHPNames: nor are there data for nearby isotopes." << G4endl;
254 G4cout << "G4ParticleHPNames: Plea 254 G4cout << "G4ParticleHPNames: Please make sure G4NEUTRONHPDATA points to the directory "
255 << G4endl; 255 << G4endl;
256 G4cout << "G4ParticleHPNames: in w 256 G4cout << "G4ParticleHPNames: in which the neutron scattering data are located."
257 << G4endl; 257 << G4endl;
258 G4cout << "G4ParticleHPNames: The 258 G4cout << "G4ParticleHPNames: The material was A = " << A << ", Z = " << Z << G4endl;
259 } 259 }
260 #endif 260 #endif
261 G4ExceptionDescription ed; 261 G4ExceptionDescription ed;
262 ed << "Data for Z=" << Z << " A=" << A << 262 ed << "Data for Z=" << Z << " A=" << A << " M=" << M << " does not exist in G4NEUTRONHPDATA";
263 G4Exception("G4ParticleHPName::Init(...)", 263 G4Exception("G4ParticleHPName::Init(...)","hadhp01",
264 JustWarning, ed, ""); 264 JustWarning, ed, "");
265 } 265 }
266 check = new std::istringstream(std::io 266 check = new std::istringstream(std::ios::in);
267 break; 267 break;
268 } 268 }
269 if (delta_A > 2 * theMaxOffSet) { 269 if (delta_A > 2 * theMaxOffSet) {
270 delta_A = 0; 270 delta_A = 0;
271 flip_A = 1; 271 flip_A = 1;
272 272
273 first = true; 273 first = true;
274 274
275 if (flip_Z > 0) { 275 if (flip_Z > 0) {
276 delta_Z += 1; 276 delta_Z += 1;
277 } 277 }
278 myZ = Z + flip_Z * delta_Z; 278 myZ = Z + flip_Z * delta_Z;
279 flip_Z *= -1; 279 flip_Z *= -1;
280 280
281 myA = A; 281 myA = A;
282 if (myZ > 100) { 282 if (myZ > 100) {
283 myZ = 100; 283 myZ = 100;
284 } 284 }
285 if (myZ < 1) { 285 if (myZ < 1) {
286 myZ = 1; 286 myZ = 1;
287 } 287 }
288 288
289 // myZ += inc; 289 // myZ += inc;
290 } 290 }
291 else { 291 else {
292 if (flip_A > 0) { 292 if (flip_A > 0) {
293 delta_A += 1; 293 delta_A += 1;
294 } 294 }
295 myA = A + flip_A * delta_A; 295 myA = A + flip_A * delta_A;
296 flip_A *= -1; 296 flip_A *= -1;
297 297
298 if (myA < 1) { 298 if (myA < 1) {
299 myA = 1; 299 myA = 1;
300 } 300 }
301 301
302 // myA += inc; 302 // myA += inc;
303 } 303 }
304 304
305 } while (myZ == 0 || myA == 0); // No mea 305 } while (myZ == 0 || myA == 0); // No meaning // Loop checking, 11.05.2015, T. Koi
306 306
307 } while ((check == nullptr) || (!(*check))); 307 } while ((check == nullptr) || (!(*check))); // Loop checking, 11.05.2015, T. Koi
308 308
309 #ifdef G4VERBOSE 309 #ifdef G4VERBOSE
310 if (fManager->GetDEBUG()) 310 if (fManager->GetDEBUG())
311 { 311 {
312 G4cout << "Names::GetName: last theName pr 312 G4cout << "Names::GetName: last theName proposal = " << G4endl;
313 G4cout << *theName << " " << A << " " << Z 313 G4cout << *theName << " " << A << " " << Z << " " << result.GetName() << G4endl;
314 } 314 }
315 #endif 315 #endif
316 316
317 // administration and anouncement for lackin 317 // administration and anouncement for lacking of exact data in NDL
318 if (Z != result.GetZ() || A != result.GetA() 318 if (Z != result.GetZ() || A != result.GetA()) {
319 if (rest == "/CrossSection") { 319 if (rest == "/CrossSection") {
320 G4String reac = base; 320 G4String reac = base;
321 const G4String& dir = fManager->GetNeutr << 321 G4String dir = fManager->GetNeutronHPPath();
322 reac.erase(0, dir.length()); 322 reac.erase(0, dir.length());
323 if (fManager->GetSkipMissingIsotopes() 323 if (fManager->GetSkipMissingIsotopes()
324 && (Z != result.GetZ() || !result.Is 324 && (Z != result.GetZ() || !result.IsThisNaturalAbundance()))
325 { 325 {
326 #ifdef G4VERBOSE 326 #ifdef G4VERBOSE
327 if (fManager->GetVerboseLevel() > 0) { 327 if (fManager->GetVerboseLevel() > 0) {
328 G4cout << "NeutronHP: " << reac << " 328 G4cout << "NeutronHP: " << reac << " file for Z = " << Z << ", A = " << A
329 << " is not found and CrossSe 329 << " is not found and CrossSection set to 0." << G4endl;
330 } 330 }
331 #endif 331 #endif
332 const G4String& new_name = base + "/" << 332 G4String new_name = base + "/" + rest + "/" + "0_0_Zero";
333 result.SetName(new_name); 333 result.SetName(new_name);
334 } 334 }
335 else { 335 else {
336 // 080901 Add protection that deuteron 336 // 080901 Add protection that deuteron data do not selected for hydrogen and so on by T. Koi
337 // 160216 Increase protencted isotopes 337 // 160216 Increase protencted isotopes for fixing problem on charged particle HP
338 if ((reac.find("Inelastic") != reac.si 338 if ((reac.find("Inelastic") != reac.size()
339 && ((Z == 1 && A == 1) || (Z == 1 339 && ((Z == 1 && A == 1) || (Z == 1 && A == 2) || (Z == 1 && A == 3)
340 || (Z == 2 && A == 3) || (Z = 340 || (Z == 2 && A == 3) || (Z == 2 && A == 4)))
341 || (reac.find("Capture") != reac.s 341 || (reac.find("Capture") != reac.size() && ((Z == 1 && A == 3) || (Z == 2 && A == 4)))
342 || (reac.find("Fission") != reac.s 342 || (reac.find("Fission") != reac.size()
343 && ((Z == 88 && A == 224) || ( 343 && ((Z == 88 && A == 224) || (Z == 88 && A == 225) || (Z == 89 && A == 225)
344 || (Z == 88 && A == 226))) 344 || (Z == 88 && A == 226))))
345 345
346 { 346 {
347 const G4String& new_name = base + "/ << 347 G4String new_name = base + "/" + rest + "/" + "0_0_Zero";
348 result.SetName(new_name); 348 result.SetName(new_name);
349 } 349 }
350 else { 350 else {
351 #ifdef G4VERBOSE 351 #ifdef G4VERBOSE
352 if (fManager->GetVerboseLevel() > 0) 352 if (fManager->GetVerboseLevel() > 0) {
353 G4cout << "NeutronHP: " << reac << 353 G4cout << "NeutronHP: " << reac << " file for Z = " << Z << ", A = " << A
354 << " is not found and Neutr 354 << " is not found and NeutronHP will use " << result.GetName() << G4endl;
355 } 355 }
356 #endif 356 #endif
357 } 357 }
358 } 358 }
359 } 359 }
360 } 360 }
361 361
362 delete theName; 362 delete theName;
363 delete check; 363 delete check;
364 364
365 return result; 365 return result;
366 } 366 }
367 367