Geant4 Cross Reference |
1 /* 1 /* 2 # <<BEGIN-copyright>> 2 # <<BEGIN-copyright>> 3 # <<END-copyright>> 3 # <<END-copyright>> 4 */ 4 */ 5 5 6 #include <map> 6 #include <map> 7 #include <string.h> 7 #include <string.h> 8 #include <cmath> 8 #include <cmath> 9 9 10 #include <xDataTOM.h> 10 #include <xDataTOM.h> 11 #include "MCGIDI.h" 11 #include "MCGIDI.h" 12 #include "MCGIDI_misc.h" 12 #include "MCGIDI_misc.h" 13 #include "MCGIDI_private.h" 13 #include "MCGIDI_private.h" 14 14 15 #if defined __cplusplus 15 #if defined __cplusplus 16 namespace GIDI { 16 namespace GIDI { 17 using namespace GIDI; 17 using namespace GIDI; 18 #endif 18 #endif 19 19 20 static int MCGIDI_target_heated_parsePOPs( sta 20 static int MCGIDI_target_heated_parsePOPs( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, 21 xDataTOM_element *particleAliases ); 21 xDataTOM_element *particleAliases ); 22 static int MCGIDI_target_heated_parseParticle( 22 static int MCGIDI_target_heated_parseParticle( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, 23 xDataTOM_element *particleAliases ); 23 xDataTOM_element *particleAliases ); 24 static int MCGIDI_target_heated_parseParticleL 24 static int MCGIDI_target_heated_parseParticleLevel( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, MCGIDI_POP *parent, 25 double mass_MeV, xDataTOM_element *particl 25 double mass_MeV, xDataTOM_element *particleAliases ); 26 static int MCGIDI_target_heated_parseParticleG 26 static int MCGIDI_target_heated_parseParticleGammas( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, char const *name ); 27 static int MCGIDI_target_heated_parseReaction( 27 static int MCGIDI_target_heated_parseReaction( statusMessageReporting *smr, xDataTOM_element *child, MCGIDI_target_heated *target, 28 MCGIDI_POPs *pops, MCGIDI_reaction *reacti 28 MCGIDI_POPs *pops, MCGIDI_reaction *reaction ); 29 /* 29 /* 30 ********************************************** 30 ************************************************************ 31 */ 31 */ 32 MCGIDI_target_heated *MCGIDI_target_heated_new 32 MCGIDI_target_heated *MCGIDI_target_heated_new( statusMessageReporting *smr ) { 33 33 34 MCGIDI_target_heated *target; 34 MCGIDI_target_heated *target; 35 35 36 if( ( target = (MCGIDI_target_heated *) sm 36 if( ( target = (MCGIDI_target_heated *) smr_malloc2( smr, sizeof( MCGIDI_target_heated ), 0, "target" ) ) == NULL ) return( NULL ); 37 if( MCGIDI_target_heated_initialize( smr, 37 if( MCGIDI_target_heated_initialize( smr, target ) ) target = (MCGIDI_target_heated *) smr_freeMemory( (void **) &target ); 38 return( target ); 38 return( target ); 39 } 39 } 40 /* 40 /* 41 ********************************************** 41 ************************************************************ 42 */ 42 */ 43 int MCGIDI_target_heated_initialize( statusMes 43 int MCGIDI_target_heated_initialize( statusMessageReporting *smr, MCGIDI_target_heated *target ) { 44 44 45 memset( target, 0, sizeof( MCGIDI_target_h 45 memset( target, 0, sizeof( MCGIDI_target_heated ) ); 46 MCGIDI_POPs_initial( smr, &(target->pops), 46 MCGIDI_POPs_initial( smr, &(target->pops), 100 ); 47 target->transportabilities = new transport 47 target->transportabilities = new transportabilitiesMap( ); 48 return( 0 ); 48 return( 0 ); 49 } 49 } 50 /* 50 /* 51 ********************************************** 51 ************************************************************ 52 */ 52 */ 53 MCGIDI_target_heated *MCGIDI_target_heated_new 53 MCGIDI_target_heated *MCGIDI_target_heated_newRead( statusMessageReporting *smr, const char *fileName ) { 54 54 55 MCGIDI_target_heated *target; 55 MCGIDI_target_heated *target; 56 56 57 if( ( target = MCGIDI_target_heated_new( s 57 if( ( target = MCGIDI_target_heated_new( smr ) ) == NULL ) return( NULL ); 58 if( MCGIDI_target_heated_read( smr, target 58 if( MCGIDI_target_heated_read( smr, target, fileName ) != 0 ) target = (MCGIDI_target_heated *) smr_freeMemory( (void **) &target ); 59 return( target ); 59 return( target ); 60 } 60 } 61 /* 61 /* 62 ********************************************** 62 ************************************************************ 63 */ 63 */ 64 MCGIDI_target_heated *MCGIDI_target_heated_fre 64 MCGIDI_target_heated *MCGIDI_target_heated_free( statusMessageReporting *smr, MCGIDI_target_heated *target ) { 65 65 66 MCGIDI_target_heated_release( smr, target 66 MCGIDI_target_heated_release( smr, target ); 67 smr_freeMemory( (void **) &target ); 67 smr_freeMemory( (void **) &target ); 68 return( NULL ); 68 return( NULL ); 69 } 69 } 70 /* 70 /* 71 ********************************************** 71 ************************************************************ 72 */ 72 */ 73 int MCGIDI_target_heated_release( statusMessag 73 int MCGIDI_target_heated_release( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 74 74 75 int ir; 75 int ir; 76 76 77 ptwXY_free( target->crossSection ); 77 ptwXY_free( target->crossSection ); 78 ptwX_free( target->crossSectionGrouped ); 78 ptwX_free( target->crossSectionGrouped ); 79 ptwX_free( target->crossSectionGroupedForS 79 ptwX_free( target->crossSectionGroupedForSampling ); 80 for( ir = 0; ir < target->numberOfReaction 80 for( ir = 0; ir < target->numberOfReactions; ir++ ) MCGIDI_reaction_release( NULL, &(target->reactions[ir]) ); 81 smr_freeMemory( (void **) &(target->reacti 81 smr_freeMemory( (void **) &(target->reactions) ); 82 MCGIDI_POPs_release( &(target->pops) ); 82 MCGIDI_POPs_release( &(target->pops) ); 83 smr_freeMemory( (void **) &(target->path) 83 smr_freeMemory( (void **) &(target->path) ); 84 smr_freeMemory( (void **) &(target->absPat 84 smr_freeMemory( (void **) &(target->absPath) ); 85 xDataTOMAL_release( &(target->attributes) 85 xDataTOMAL_release( &(target->attributes) ); 86 delete target->transportabilities; 86 delete target->transportabilities; 87 return( 0 ); 87 return( 0 ); 88 } 88 } 89 /* 89 /* 90 ********************************************** 90 ************************************************************ 91 */ 91 */ 92 int MCGIDI_target_heated_read( statusMessageRe 92 int MCGIDI_target_heated_read( statusMessageReporting *smr, MCGIDI_target_heated *target, const char *fileName ) { 93 /* 93 /* 94 * If a target has already been read into thi 94 * If a target has already been read into this target, user must have called MCGIDI_target_heated_release before calling this routine. 95 * Otherwise, there will be memory leaks. 95 * Otherwise, there will be memory leaks. 96 */ 96 */ 97 int n, ir; 97 int n, ir; 98 xDataTOM_TOM *doc = NULL; 98 xDataTOM_TOM *doc = NULL; 99 xDataTOM_element *element, *child, *partic 99 xDataTOM_element *element, *child, *particles, *particleAliases; 100 char const *name, *version, *temperatureSt 100 char const *name, *version, *temperatureStr; 101 char *e1; 101 char *e1; 102 MCGIDI_reaction *reaction; 102 MCGIDI_reaction *reaction; 103 double crossSectionInit[4] = { 0., 0., 0., 103 double crossSectionInit[4] = { 0., 0., 0., 0., }; 104 nfu_status status; 104 nfu_status status; 105 ptwXYPoints *crossSection; 105 ptwXYPoints *crossSection; 106 int subtag1_Notice = 0; 106 int subtag1_Notice = 0; 107 107 108 if( ( target->path = smr_allocateCopyStrin 108 if( ( target->path = smr_allocateCopyString2( smr, fileName, "path" ) ) == NULL ) goto err; 109 if( ( target->absPath = xDataTOMMisc_getAb 109 if( ( target->absPath = xDataTOMMisc_getAbsPath( smr, fileName ) ) == NULL ) goto err; 110 if( ( doc = xDataTOM_importFile( smr, file 110 if( ( doc = xDataTOM_importFile( smr, fileName ) ) == NULL ) goto err; 111 element = xDataTOM_getDocumentsElement( do 111 element = xDataTOM_getDocumentsElement( doc ); 112 if( ( version = xDataTOM_getAttributesValu 112 if( ( version = xDataTOM_getAttributesValueInElement( element, "version" ) ) == NULL ) { 113 smr_setReportError2( smr, smr_unkn 113 smr_setReportError2( smr, smr_unknownID, 1, "version attribute missing from element '%s'", element->name ); 114 goto err; } 114 goto err; } 115 else { 115 else { 116 if( strcmp( version, "GND 1.3" ) != 0 116 if( strcmp( version, "GND 1.3" ) != 0 ) { 117 smr_setReportError2( smr, smr_unkn 117 smr_setReportError2( smr, smr_unknownID, 1, "Unsupported version '%s' for element %s", version, element->name ); 118 goto err; 118 goto err; 119 } 119 } 120 } 120 } 121 if( strcmp( element->name, "reactionSuite" 121 if( strcmp( element->name, "reactionSuite" ) != 0 ) { 122 smr_setReportError2( smr, smr_unknownI 122 smr_setReportError2( smr, smr_unknownID, 1, "input file's top element must be reactionSuite and not %s", element->name ); 123 goto err; } 123 goto err; } 124 else { 124 else { 125 xDataTOMAL_copyAttributionList( smr, & 125 xDataTOMAL_copyAttributionList( smr, &(target->attributes), &(element->attributes) ); 126 particleAliases = xDataTOME_getOneElem 126 particleAliases = xDataTOME_getOneElementByName( smr, element, "aliases", 0 ); 127 if( ( particles = xDataTOME_getOneElem 127 if( ( particles = xDataTOME_getOneElementByName( smr, element, "particles", 1 ) ) == NULL ) goto err; 128 if( MCGIDI_target_heated_parsePOPs( sm 128 if( MCGIDI_target_heated_parsePOPs( smr, target, particles, particleAliases ) != 0 ) goto err; 129 129 130 if( ( temperatureStr = MCGIDI_misc_poi 130 if( ( temperatureStr = MCGIDI_misc_pointerToTOMAttributeIfAllOk3( smr, target->absPath, 1, &(target->attributes), "temperature" ) ) == NULL ) goto err; 131 target->temperature_MeV = strtod( temp 131 target->temperature_MeV = strtod( temperatureStr, &e1 ); 132 while( isspace( *e1 ) ) ++e1; // Loop 132 while( isspace( *e1 ) ) ++e1; // Loop checking, 11.06.2015, T. Koi 133 target->temperature_MeV *= MCGIDI_misc 133 target->temperature_MeV *= MCGIDI_misc_getUnitConversionFactor( smr, e1, "MeV/k" ); 134 if( !smr_isOk( smr ) ) goto err; 134 if( !smr_isOk( smr ) ) goto err; 135 135 136 if( ( name = MCGIDI_misc_pointerToTOMA 136 if( ( name = MCGIDI_misc_pointerToTOMAttributeIfAllOk3( smr, target->absPath, 1, &(target->attributes), "projectile" ) ) != NULL ) 137 target->projectilePOP = MCGIDI_POP 137 target->projectilePOP = MCGIDI_POPs_findParticle( &(target->pops), name ); 138 if( !smr_isOk( smr ) ) goto err; 138 if( !smr_isOk( smr ) ) goto err; 139 139 140 if( ( name = MCGIDI_misc_pointerToTOMA 140 if( ( name = MCGIDI_misc_pointerToTOMAttributeIfAllOk3( smr, target->absPath, 1, &(target->attributes), "target" ) ) != NULL ) 141 if( !smr_isOk( smr ) ) goto err; 141 if( !smr_isOk( smr ) ) goto err; 142 target->targetPOP = MCGIDI_POPs_fi 142 target->targetPOP = MCGIDI_POPs_findParticle( &(target->pops), name ); 143 143 144 n = xDataTOM_numberOfElementsByName( s 144 n = xDataTOM_numberOfElementsByName( smr, element, "reaction" ); 145 if( n == 0 ) { 145 if( n == 0 ) { 146 smr_setReportError2( smr, smr_unkn 146 smr_setReportError2( smr, smr_unknownID, 1, "target does not have any reactions: file = '%s'", fileName ); 147 goto err; 147 goto err; 148 } 148 } 149 if( ( target->reactions = (MCGIDI_reac 149 if( ( target->reactions = (MCGIDI_reaction *) smr_malloc2( smr, n * sizeof( MCGIDI_reaction ), 1, "target->reactions" ) ) == NULL ) goto err; 150 150 151 for( ir = 0, child = xDataTOME_getFirs 151 for( ir = 0, child = xDataTOME_getFirstElement( element ); child != NULL; child = xDataTOME_getNextElement( child ) ) { 152 if( strcmp( child->name, "particle 152 if( strcmp( child->name, "particles" ) == 0 ) continue; 153 if( strcmp( child->name, "styles" 153 if( strcmp( child->name, "styles" ) == 0 ) continue; 154 if( strcmp( child->name, "document 154 if( strcmp( child->name, "documentations" ) == 0 ) continue; 155 if( strcmp( child->name, "resonanc 155 if( strcmp( child->name, "resonances" ) == 0 ) continue; 156 if( strcmp( child->name, "summedRe 156 if( strcmp( child->name, "summedReaction" ) == 0 ) continue; 157 if( strcmp( child->name, "fissionC 157 if( strcmp( child->name, "fissionComponent" ) == 0 ) continue; 158 if( strcmp( child->name, "reaction 158 if( strcmp( child->name, "reaction" ) == 0 ) { 159 double EMin, EMax; 159 double EMin, EMax; 160 160 161 reaction = &(target->reaction 161 reaction = &(target->reactions[ir]); 162 if( MCGIDI_target_heated_parse 162 if( MCGIDI_target_heated_parseReaction( smr, child, target, &(target->pops), reaction ) ) goto err; 163 if( MCGIDI_reaction_getDomain( 163 if( MCGIDI_reaction_getDomain( smr, reaction, &EMin, &EMax ) ) goto err; 164 if( ir == 0 ) { target->EMin = 164 if( ir == 0 ) { target->EMin = EMin; target->EMax = EMax; } 165 if( EMin < target->EMin ) targ 165 if( EMin < target->EMin ) target->EMin = EMin; 166 if( EMax > target->EMax ) targ 166 if( EMax > target->EMax ) target->EMax = EMax; 167 for( transportabilitiesMap::co 167 for( transportabilitiesMap::const_iterator iter = reaction->transportabilities->begin( ); 168 iter != reaction-> 168 iter != reaction->transportabilities->end( ); ++iter ) { 169 MCGIDI_misc_updateTranspor 169 MCGIDI_misc_updateTransportabilitiesMap( target->transportabilities, iter->first, iter->second ); 170 } 170 } 171 ir++; } 171 ir++; } 172 else if( strcmp( child->name, "pro 172 else if( strcmp( child->name, "production" ) == 0 ) { 173 continue; } 173 continue; } 174 else if( strcmp( child->name, "ali 174 else if( strcmp( child->name, "aliases" ) == 0 ) { 175 continue; } 175 continue; } 176 else if( strcmp( child->name, "par 176 else if( strcmp( child->name, "partialGammaProduction" ) == 0 ) { 177 if( subtag1_Notice == 0 ) prin 177 if( subtag1_Notice == 0 ) printf( "Unsupported reactionSuite sub-tag = '%s'\n", child->name ); 178 subtag1_Notice++; } 178 subtag1_Notice++; } 179 else { 179 else { 180 printf( "Unsupported reactionS 180 printf( "Unsupported reactionSuite sub-tag = '%s'\n", child->name ); 181 } 181 } 182 } 182 } 183 crossSectionInit[0] = target->EMin; 183 crossSectionInit[0] = target->EMin; 184 crossSectionInit[2] = target->EMax; 184 crossSectionInit[2] = target->EMax; 185 if( ( target->crossSection = ptwXY_cre 185 if( ( target->crossSection = ptwXY_create( ptwXY_interpolationLinLin, NULL, 2., 1e-3, 2, 10, 2, crossSectionInit, &status, 0 ) ) == NULL ) { 186 smr_setReportError2( smr, smr_unkn 186 smr_setReportError2( smr, smr_unknownID, 1, "ptwXY_create err = %d: %s\n", status, nfu_statusMessage( status ) ); 187 goto err; 187 goto err; 188 } 188 } 189 for( ir = 0; ir < target->numberOfReac 189 for( ir = 0; ir < target->numberOfReactions; ir++ ) { 190 reaction = &(target->reactions[ir 190 reaction = &(target->reactions[ir]); 191 if( MCGIDI_reaction_fixDomains( sm 191 if( MCGIDI_reaction_fixDomains( smr, reaction, target->EMin, target->EMax, &status ) ) { 192 smr_setReportError2( smr, smr_ 192 smr_setReportError2( smr, smr_unknownID, 1, "ptwXY_add_ptwXY err = %d: %s\n", status, nfu_statusMessage( status ) ); 193 goto err; 193 goto err; 194 } 194 } 195 if( ( crossSection = ptwXY_add_ptw 195 if( ( crossSection = ptwXY_add_ptwXY( target->crossSection, reaction->crossSection, &status ) ) == NULL ) { 196 smr_setReportError2( smr, smr_ 196 smr_setReportError2( smr, smr_unknownID, 1, "ptwXY_add_ptwXY err = %d: %s\n", status, nfu_statusMessage( status ) ); 197 goto err; 197 goto err; 198 } 198 } 199 target->crossSection = ptwXY_free( 199 target->crossSection = ptwXY_free( target->crossSection ); 200 target->crossSection = crossSectio 200 target->crossSection = crossSection; 201 } 201 } 202 } 202 } 203 xDataTOM_freeTOM( smr, &doc ); 203 xDataTOM_freeTOM( smr, &doc ); 204 return( 0 ); 204 return( 0 ); 205 205 206 err: 206 err: 207 smr_setReportError2( smr, smr_unknownID, 1 207 smr_setReportError2( smr, smr_unknownID, 1, "Sub-error while reading file '%s'", fileName ); 208 if( doc != NULL ) xDataTOM_freeTOM( smr, & 208 if( doc != NULL ) xDataTOM_freeTOM( smr, &doc ); 209 MCGIDI_target_heated_release( smr, target 209 MCGIDI_target_heated_release( smr, target ); 210 return( 1 ); 210 return( 1 ); 211 } 211 } 212 /* 212 /* 213 ********************************************** 213 ************************************************************ 214 */ 214 */ 215 static int MCGIDI_target_heated_parsePOPs( sta 215 static int MCGIDI_target_heated_parsePOPs( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, 216 xDataTOM_element *particleAliases ) { 216 xDataTOM_element *particleAliases ) { 217 217 218 xDataTOM_element *child; 218 xDataTOM_element *child; 219 219 220 for( child = xDataTOME_getFirstElement( el 220 for( child = xDataTOME_getFirstElement( element ); child != NULL; child = xDataTOME_getNextElement( child ) ) { 221 if( strcmp( child->name, "particle" ) 221 if( strcmp( child->name, "particle" ) ) { 222 smr_setReportError2( smr, smr_unkn 222 smr_setReportError2( smr, smr_unknownID, 1, "invalid element '%s' in %s", child->name, element->name ); 223 goto err; 223 goto err; 224 } 224 } 225 if( MCGIDI_target_heated_parseParticle 225 if( MCGIDI_target_heated_parseParticle( smr, target, child, particleAliases ) ) goto err; 226 } 226 } 227 return( 0 ); 227 return( 0 ); 228 228 229 err: 229 err: 230 return( 1 ); 230 return( 1 ); 231 } 231 } 232 /* 232 /* 233 ********************************************** 233 ************************************************************ 234 */ 234 */ 235 static int MCGIDI_target_heated_parseParticle( 235 static int MCGIDI_target_heated_parseParticle( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, 236 xDataTOM_element *particleAliases ) { 236 xDataTOM_element *particleAliases ) { 237 /* 237 /* 238 This routine, MCGIDI_target_heated_parsePa 238 This routine, MCGIDI_target_heated_parseParticleLevel, MCGIDI_target_heated_parseParticleGammas handle the parsing of a 239 particle which can have one of the followi 239 particle which can have one of the following three forms: 240 240 241 1) 241 1) 242 <particle name="Sc47" genre="nucleus" mass 242 <particle name="Sc47" genre="nucleus" mass="46.9524440292728 amu"/> 243 2) 243 2) 244 <particle name="Sc46" genre="nucleus" mass 244 <particle name="Sc46" genre="nucleus" mass="45.9551770270807 amu"> 245 <level name="Sc46_e0" label="0" energy 245 <level name="Sc46_e0" label="0" energy="0 eV"/> 246 <level name="Sc46_e1" label="1" energy 246 <level name="Sc46_e1" label="1" energy="142500 eV"/></particle> 247 3) 247 3) 248 <particle name="S36" genre="nucleus" mass= 248 <particle name="S36" genre="nucleus" mass="35.9669735654569 amu"> 249 <level name="S36_e0" label="0" energy= 249 <level name="S36_e0" label="0" energy="0 eV" spin="0"/> 250 <level name="S36_e1" label="1" energy= 250 <level name="S36_e1" label="1" energy="3.291e6 eV"> 251 <gamma finalLevel="S36_e0" probabi 251 <gamma finalLevel="S36_e0" probability="1.0"/></level> 252 <level name="S36_e2" label="2" energy= 252 <level name="S36_e2" label="2" energy="3.346e6 eV"> 253 <gamma finalLevel="S36_e0" probabi 253 <gamma finalLevel="S36_e0" probability="1.0"/></level> 254 <level name="S36_e3" label="3" energy= 254 <level name="S36_e3" label="3" energy="4191990 eV"> 255 <gamma finalLevel="S36_e1" probabi 255 <gamma finalLevel="S36_e1" probability="1.0"/></level> 256 <level name="S36_e4" label="4" energy= 256 <level name="S36_e4" label="4" energy="4522990 eV"> 257 <gamma finalLevel="S36_e1" probabi 257 <gamma finalLevel="S36_e1" probability="0.248"/> 258 <gamma finalLevel="S36_e0" probabi 258 <gamma finalLevel="S36_e0" probability="0.752"/></level> 259 <level name="S36_e5" label="5" energy= 259 <level name="S36_e5" label="5" energy="4574990 eV"> 260 <gamma finalLevel="S36_e1" probabi 260 <gamma finalLevel="S36_e1" probability="1.0"/></level> 261 <level name="S36_c" label="c" energy=" 261 <level name="S36_c" label="c" energy="u:4999990 eV"/></particle> 262 */ 262 */ 263 int globalParticle = 1; 263 int globalParticle = 1; 264 char const *name = NULL, *mass = NULL; 264 char const *name = NULL, *mass = NULL; /* Do not free name or mass, do not own them. */ 265 double mass_MeV; 265 double mass_MeV; 266 xDataTOM_element *child; 266 xDataTOM_element *child; 267 MCGIDI_POP *pop; 267 MCGIDI_POP *pop; 268 268 269 if( ( name = xDataTOM_getAttributesValueIn 269 if( ( name = xDataTOM_getAttributesValueInElement( element, "name" ) ) == NULL ) { 270 smr_setReportError2p( smr, smr_unknown 270 smr_setReportError2p( smr, smr_unknownID, 1, "particle missing name attribute" ); 271 goto err; 271 goto err; 272 } 272 } 273 if( ( mass = xDataTOM_getAttributesValueIn 273 if( ( mass = xDataTOM_getAttributesValueInElement( element, "mass" ) ) == NULL ) { 274 smr_setReportError2( smr, smr_unknownI 274 smr_setReportError2( smr, smr_unknownID, 1, "particle '%s' missing mass attribute", name ); 275 goto err; 275 goto err; 276 } 276 } 277 if( MCGIDI_misc_PQUStringToDouble( smr, ma 277 if( MCGIDI_misc_PQUStringToDouble( smr, mass, "amu", MCGIDI_AMU2MeV, &mass_MeV ) ) goto err; 278 if( ( pop = MCGIDI_POPs_addParticleIfNeede 278 if( ( pop = MCGIDI_POPs_addParticleIfNeeded( smr, &(target->pops), name, mass_MeV, 0., NULL, globalParticle ) ) == NULL ) goto err; 279 279 280 for( child = xDataTOME_getFirstElement( el 280 for( child = xDataTOME_getFirstElement( element ); child != NULL; child = xDataTOME_getNextElement( child ) ) { 281 if( strcmp( child->name, "level" ) ) { 281 if( strcmp( child->name, "level" ) ) { 282 smr_setReportError2( smr, smr_unkn 282 smr_setReportError2( smr, smr_unknownID, 1, "invalid element '%s' in %s", child->name, element->name ); 283 goto err; 283 goto err; 284 } 284 } 285 if( MCGIDI_target_heated_parseParticle 285 if( MCGIDI_target_heated_parseParticleLevel( smr, target, child, pop, mass_MeV, particleAliases ) ) goto err; 286 } 286 } 287 287 288 return( 0 ); 288 return( 0 ); 289 289 290 err: 290 err: 291 return( 1 ); 291 return( 1 ); 292 } 292 } 293 /* 293 /* 294 ********************************************** 294 ************************************************************ 295 */ 295 */ 296 static int MCGIDI_target_heated_parseParticleL 296 static int MCGIDI_target_heated_parseParticleLevel( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, MCGIDI_POP *parent, 297 double mass_MeV, xDataTOM_element *particl 297 double mass_MeV, xDataTOM_element *particleAliases ) { 298 298 299 int globalParticle = 0; 299 int globalParticle = 0; 300 char const *name, *level, *aliasValue; 300 char const *name, *level, *aliasValue; /* Do not free any of these as they are owned by called routine. */ 301 double level_MeV = 0.; 301 double level_MeV = 0.; 302 xDataTOM_element *alias; 302 xDataTOM_element *alias; 303 303 304 if( ( name = xDataTOM_getAttributesValueIn 304 if( ( name = xDataTOM_getAttributesValueInElement( element, "name" ) ) == NULL ) { 305 smr_setReportError2p( smr, smr_unknown 305 smr_setReportError2p( smr, smr_unknownID, 1, "particle missing name attribute" ); 306 goto err; 306 goto err; 307 } 307 } 308 if( ( level = xDataTOM_getAttributesValueI 308 if( ( level = xDataTOM_getAttributesValueInElement( element, "energy" ) ) == NULL ) { 309 smr_setReportError2( smr, smr_unknownI 309 smr_setReportError2( smr, smr_unknownID, 1, "particle '%s' level missing energy attribute", name ); 310 goto err; 310 goto err; 311 } 311 } 312 /* Special case for 'c' labels. Correc 312 /* Special case for 'c' labels. Correct mass is only needed for two-body. */ 313 if( level[0] != 'u' ) if( MCGIDI_misc_PQUS 313 if( level[0] != 'u' ) if( MCGIDI_misc_PQUStringToDoubleInUnitOf( smr, level, "MeV", &level_MeV ) ) goto err; 314 for( alias = xDataTOME_getFirstElement( pa 314 for( alias = xDataTOME_getFirstElement( particleAliases ); alias != NULL; alias = xDataTOME_getNextElement( alias ) ) { 315 if( ( aliasValue = xDataTOM_getAttribu 315 if( ( aliasValue = xDataTOM_getAttributesValueInElement( alias, "value" ) ) == NULL ) { 316 smr_setReportError2p( smr, smr_unk 316 smr_setReportError2p( smr, smr_unknownID, 1, "particle missing name attribute" ); 317 goto err; 317 goto err; 318 } 318 } 319 if( strcmp( aliasValue, name ) == 0 ) 319 if( strcmp( aliasValue, name ) == 0 ) globalParticle = 1; 320 } 320 } 321 if( MCGIDI_POPs_addParticleIfNeeded( smr, 321 if( MCGIDI_POPs_addParticleIfNeeded( smr, &(target->pops), name, mass_MeV + level_MeV, level_MeV, parent, globalParticle ) == NULL ) goto err; 322 322 323 return( MCGIDI_target_heated_parseParticle 323 return( MCGIDI_target_heated_parseParticleGammas( smr, target, element, name ) ); 324 324 325 err: 325 err: 326 return( 1 ); 326 return( 1 ); 327 } 327 } 328 /* 328 /* 329 ********************************************** 329 ************************************************************ 330 */ 330 */ 331 static int MCGIDI_target_heated_parseParticleG 331 static int MCGIDI_target_heated_parseParticleGammas( statusMessageReporting *smr, MCGIDI_target_heated *target, xDataTOM_element *element, char const *name ) { 332 332 333 int gammaCounts = 0; 333 int gammaCounts = 0; 334 MCGIDI_POP *pop = MCGIDI_POPs_findParticle 334 MCGIDI_POP *pop = MCGIDI_POPs_findParticle( &(target->pops), name ); 335 xDataTOM_element *child; 335 xDataTOM_element *child; 336 MCGIDI_GammaBranching *gammas = NULL; 336 MCGIDI_GammaBranching *gammas = NULL; 337 char const *finalLevelString; 337 char const *finalLevelString; 338 double probability; 338 double probability; 339 339 340 for( child = xDataTOME_getFirstElement( el 340 for( child = xDataTOME_getFirstElement( element ); child != NULL; child = xDataTOME_getNextElement( child ) ) { 341 if( strcmp( child->name, "gamma" ) ) { 341 if( strcmp( child->name, "gamma" ) ) { 342 smr_setReportError2( smr, smr_unkn 342 smr_setReportError2( smr, smr_unknownID, 1, "invalid element '%s' in %s", child->name, element->name ); 343 goto err; 343 goto err; 344 } 344 } 345 gammaCounts++; 345 gammaCounts++; 346 } 346 } 347 if( gammaCounts > 0 ) { 347 if( gammaCounts > 0 ) { 348 if( ( gammas = (MCGIDI_GammaBranching 348 if( ( gammas = (MCGIDI_GammaBranching *) smr_malloc2( smr, gammaCounts * sizeof( MCGIDI_GammaBranching), 0, "gammas" ) ) == NULL ) goto err; 349 for( child = xDataTOME_getFirstElement 349 for( child = xDataTOME_getFirstElement( element ); child != NULL; child = xDataTOME_getNextElement( child ) ) { 350 if( ( finalLevelString = xDataTOM_ 350 if( ( finalLevelString = xDataTOM_getAttributesValueInElement( child, "finalLevel" ) ) == NULL ) { 351 smr_setReportError2p( smr, smr 351 smr_setReportError2p( smr, smr_unknownID, 1, "gamma missing 'finalLevel'" ); 352 goto err; 352 goto err; 353 } 353 } 354 if( xDataTOME_convertAttributeToDo 354 if( xDataTOME_convertAttributeToDouble( smr, child, "probability", &probability ) != 0 ) { 355 smr_setReportError2p( smr, smr 355 smr_setReportError2p( smr, smr_unknownID, 1, "gamma missing 'probability' attribute" ); 356 goto err; 356 goto err; 357 } 357 } 358 } 358 } 359 } 359 } 360 pop->numberOfGammaBranchs = gammaCounts; 360 pop->numberOfGammaBranchs = gammaCounts; 361 pop->gammas = gammas; 361 pop->gammas = gammas; 362 362 363 return( 0 ); 363 return( 0 ); 364 364 365 err: 365 err: 366 if( gammas != NULL ) smr_freeMemory( (void 366 if( gammas != NULL ) smr_freeMemory( (void **) &gammas ); 367 return( 1 ); 367 return( 1 ); 368 } 368 } 369 /* 369 /* 370 ********************************************** 370 ************************************************************ 371 */ 371 */ 372 static int MCGIDI_target_heated_parseReaction( 372 static int MCGIDI_target_heated_parseReaction( statusMessageReporting *smr, xDataTOM_element *element, MCGIDI_target_heated *target, 373 MCGIDI_POPs *pops, MCGIDI_reaction *re 373 MCGIDI_POPs *pops, MCGIDI_reaction *reaction ) { 374 374 375 if( MCGIDI_reaction_parseFromTOM( smr, ele 375 if( MCGIDI_reaction_parseFromTOM( smr, element, target, pops, reaction ) ) goto err; 376 target->numberOfReactions++; 376 target->numberOfReactions++; 377 377 378 return( 0 ); 378 return( 0 ); 379 379 380 err: 380 err: 381 smr_setReportError2( smr, smr_unknownID, 1 381 smr_setReportError2( smr, smr_unknownID, 1, "%s\n", xDataTOM_getAttributesValueInElement( element, "outputChannel" ) ); 382 return( 1 ); 382 return( 1 ); 383 } 383 } 384 /* 384 /* 385 ********************************************** 385 ************************************************************ 386 */ 386 */ 387 int MCGIDI_target_heated_numberOfReactions( st 387 int MCGIDI_target_heated_numberOfReactions( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 388 388 389 return( target->numberOfReactions ); 389 return( target->numberOfReactions ); 390 } 390 } 391 /* 391 /* 392 ********************************************** 392 ************************************************************ 393 */ 393 */ 394 int MCGIDI_target_heated_numberOfProductionRea 394 int MCGIDI_target_heated_numberOfProductionReactions( statusMessageReporting * /*smr*/, MCGIDI_target_heated * /*target*/ ) { 395 395 396 return( 0 ); 396 return( 0 ); 397 } 397 } 398 /* 398 /* 399 ********************************************** 399 ************************************************************ 400 */ 400 */ 401 MCGIDI_reaction *MCGIDI_target_heated_getReact 401 MCGIDI_reaction *MCGIDI_target_heated_getReactionAtIndex( MCGIDI_target_heated *target, int index ) { 402 402 403 if( ( index >= 0 ) && ( index < target->nu 403 if( ( index >= 0 ) && ( index < target->numberOfReactions ) ) return( &(target->reactions[index]) ); 404 return( NULL ); 404 return( NULL ); 405 } 405 } 406 /* 406 /* 407 ********************************************** 407 ************************************************************ 408 */ 408 */ 409 MCGIDI_reaction *MCGIDI_target_heated_getReact 409 MCGIDI_reaction *MCGIDI_target_heated_getReactionAtIndex_smr( statusMessageReporting *smr, MCGIDI_target_heated *target, int index ) { 410 410 411 MCGIDI_reaction *reaction = MCGIDI_target_ 411 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex( target, index ); 412 412 413 if( reaction == NULL ) { 413 if( reaction == NULL ) { 414 smr_setReportError2( smr, smr_unknownI 414 smr_setReportError2( smr, smr_unknownID, 1, "bad reaction index = %d for %s + %s", index, target->projectilePOP->name, target->targetPOP->name ); 415 } 415 } 416 return( reaction ); 416 return( reaction ); 417 } 417 } 418 #if 0 418 #if 0 419 /* 419 /* 420 ********************************************** 420 ************************************************************ 421 */ 421 */ 422 MCGIDI_channel *MCGIDI_target_heated_getProduc 422 MCGIDI_channel *MCGIDI_target_heated_getProductionReactionAtIndex( MCGIDI_target_heated *target, int index ) { 423 423 424 MCGIDI_channel *channel = NULL; 424 MCGIDI_channel *channel = NULL; 425 425 426 if( ( index >= 0 ) && ( index < target->nP 426 if( ( index >= 0 ) && ( index < target->nProductionReactions ) ) channel = target->productionReactions[index]; 427 return( channel ); 427 return( channel ); 428 } 428 } 429 #endif 429 #endif 430 /* 430 /* 431 ********************************************** 431 ************************************************************ 432 */ 432 */ 433 MCGIDI_POP *MCGIDI_target_heated_getPOPForProj 433 MCGIDI_POP *MCGIDI_target_heated_getPOPForProjectile( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 434 434 435 return( target->projectilePOP ); 435 return( target->projectilePOP ); 436 } 436 } 437 /* 437 /* 438 ********************************************** 438 ************************************************************ 439 */ 439 */ 440 MCGIDI_POP *MCGIDI_target_heated_getPOPForTarg 440 MCGIDI_POP *MCGIDI_target_heated_getPOPForTarget( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 441 441 442 return( target->targetPOP ); 442 return( target->targetPOP ); 443 } 443 } 444 /* 444 /* 445 ********************************************** 445 ************************************************************ 446 */ 446 */ 447 double MCGIDI_target_heated_getProjectileMass_ 447 double MCGIDI_target_heated_getProjectileMass_MeV( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 448 448 449 return( MCGIDI_POP_getMass_MeV( target->pr 449 return( MCGIDI_POP_getMass_MeV( target->projectilePOP ) ); 450 } 450 } 451 /* 451 /* 452 ********************************************** 452 ************************************************************ 453 */ 453 */ 454 double MCGIDI_target_heated_getTargetMass_MeV( 454 double MCGIDI_target_heated_getTargetMass_MeV( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 455 455 456 return( MCGIDI_POP_getMass_MeV( target->ta 456 return( MCGIDI_POP_getMass_MeV( target->targetPOP ) ); 457 } 457 } 458 /* 458 /* 459 ********************************************** 459 ************************************************************ 460 */ 460 */ 461 double MCGIDI_target_heated_getTotalCrossSecti 461 double MCGIDI_target_heated_getTotalCrossSectionAtE( statusMessageReporting *smr, MCGIDI_target_heated *target, 462 MCGIDI_quantitiesLookupModes &modes, b 462 MCGIDI_quantitiesLookupModes &modes, bool sampling ) { 463 463 464 double xsec; 464 double xsec; 465 465 466 if( modes.getCrossSectionMode( ) == MCGIDI 466 if( modes.getCrossSectionMode( ) == MCGIDI_quantityLookupMode_pointwise ) { 467 double e_in = modes.getProjectileEnerg 467 double e_in = modes.getProjectileEnergy( ); 468 468 469 if( e_in < target->EMin ) e_in = targe 469 if( e_in < target->EMin ) e_in = target->EMin; 470 if( e_in > target->EMax ) e_in = targe 470 if( e_in > target->EMax ) e_in = target->EMax; 471 ptwXY_getValueAtX( target->crossSectio 471 ptwXY_getValueAtX( target->crossSection, e_in, &xsec ); } 472 else if( modes.getCrossSectionMode( ) == M 472 else if( modes.getCrossSectionMode( ) == MCGIDI_quantityLookupMode_grouped ) { 473 int index = modes.getGroupIndex( ); 473 int index = modes.getGroupIndex( ); 474 double *xSecP; 474 double *xSecP; 475 475 476 if( sampling ) { 476 if( sampling ) { 477 xSecP = ptwX_getPointAtIndex( targ 477 xSecP = ptwX_getPointAtIndex( target->crossSectionGroupedForSampling, index ); } 478 else { 478 else { 479 xSecP = ptwX_getPointAtIndex( targ 479 xSecP = ptwX_getPointAtIndex( target->crossSectionGrouped, index ); 480 } 480 } 481 481 482 if( xSecP != NULL ) { 482 if( xSecP != NULL ) { 483 xsec = *xSecP; } 483 xsec = *xSecP; } 484 else { 484 else { 485 xsec = 0.; 485 xsec = 0.; 486 smr_setReportError2( smr, smr_unkn 486 smr_setReportError2( smr, smr_unknownID, 1, "Invalid cross section group index %d", index, (int) ptwX_length( target->crossSectionGrouped ) ); 487 } } 487 } } 488 else { 488 else { 489 xsec = 0.; 489 xsec = 0.; 490 } 490 } 491 return( xsec ); 491 return( xsec ); 492 } 492 } 493 /* 493 /* 494 ********************************************** 494 ************************************************************ 495 */ 495 */ 496 double MCGIDI_target_heated_getIndexReactionCr 496 double MCGIDI_target_heated_getIndexReactionCrossSectionAtE( statusMessageReporting *smr, MCGIDI_target_heated *target, int index, 497 MCGIDI_quantitiesLookupModes &modes, b 497 MCGIDI_quantitiesLookupModes &modes, bool sampling ) { 498 498 499 double xsec = 0.; 499 double xsec = 0.; 500 MCGIDI_reaction *reaction = MCGIDI_target_ 500 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex_smr( smr, target, index ); 501 501 502 if( reaction != NULL ) xsec = MCGIDI_react 502 if( reaction != NULL ) xsec = MCGIDI_reaction_getCrossSectionAtE( smr, reaction, modes, sampling ); 503 return( xsec ); 503 return( xsec ); 504 } 504 } 505 /* 505 /* 506 ********************************************** 506 ************************************************************ 507 */ 507 */ 508 int MCGIDI_target_heated_sampleIndexReactionPr 508 int MCGIDI_target_heated_sampleIndexReactionProductsAtE( statusMessageReporting *smr, MCGIDI_target_heated *target, int index, 509 MCGIDI_quantitiesLookupModes &modes, M 509 MCGIDI_quantitiesLookupModes &modes, MCGIDI_decaySamplingInfo *decaySamplingInfo, MCGIDI_sampledProductsDatas *productDatas ) { 510 510 511 MCGIDI_reaction *reaction = MCGIDI_target_ 511 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex_smr( smr, target, index ); 512 512 513 productDatas->numberOfProducts = 0; 513 productDatas->numberOfProducts = 0; 514 if( reaction == NULL ) return( -1 ); 514 if( reaction == NULL ) return( -1 ); 515 return( MCGIDI_outputChannel_sampleProduct 515 return( MCGIDI_outputChannel_sampleProductsAtE( smr, &(reaction->outputChannel), modes, decaySamplingInfo, productDatas, NULL ) ); 516 } 516 } 517 /* 517 /* 518 ********************************************** 518 ************************************************************ 519 */ 519 */ 520 double MCGIDI_target_heated_getReactionsThresh 520 double MCGIDI_target_heated_getReactionsThreshold( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target, int index ) { 521 521 522 MCGIDI_reaction *reaction = MCGIDI_target_ 522 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex( target, index ); 523 523 524 if( reaction == NULL ) return( -1 ); 524 if( reaction == NULL ) return( -1 ); 525 return( reaction->EMin ); 525 return( reaction->EMin ); 526 } 526 } 527 /* 527 /* 528 ********************************************** 528 ************************************************************ 529 */ 529 */ 530 int MCGIDI_target_heated_getReactionsDomain( s 530 int MCGIDI_target_heated_getReactionsDomain( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target, int index, double *EMin, double *EMax ) { 531 531 532 MCGIDI_reaction *reaction = MCGIDI_target_ 532 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex( target, index ); 533 533 534 if( reaction == NULL ) return( -1 ); 534 if( reaction == NULL ) return( -1 ); 535 *EMin = reaction->EMin; 535 *EMin = reaction->EMin; 536 *EMax = reaction->EMax; 536 *EMax = reaction->EMax; 537 return( 0 ); 537 return( 0 ); 538 } 538 } 539 /* 539 /* 540 ********************************************** 540 ************************************************************ 541 */ 541 */ 542 double MCGIDI_target_heated_getIndexReactionFi 542 double MCGIDI_target_heated_getIndexReactionFinalQ( statusMessageReporting *smr, MCGIDI_target_heated *target, int index, 543 MCGIDI_quantitiesLookupModes &modes ) 543 MCGIDI_quantitiesLookupModes &modes ) { 544 544 545 MCGIDI_reaction *reaction = MCGIDI_target_ 545 MCGIDI_reaction *reaction = MCGIDI_target_heated_getReactionAtIndex_smr( smr, target, index ); 546 546 547 if( reaction == NULL ) return( 0. ); 547 if( reaction == NULL ) return( 0. ); 548 return( MCGIDI_reaction_getFinalQ( smr, re 548 return( MCGIDI_reaction_getFinalQ( smr, reaction, modes ) ); 549 } 549 } 550 /* 550 /* 551 ********************************************** 551 ************************************************************ 552 */ 552 */ 553 std::map<int, enum MCGIDI_transportability> co 553 std::map<int, enum MCGIDI_transportability> const *MCGIDI_target_heated_getUniqueProducts( statusMessageReporting * /*smr*/, MCGIDI_target_heated *target ) { 554 554 555 return( target->transportabilities ); 555 return( target->transportabilities ); 556 } 556 } 557 /* 557 /* 558 ********************************************** 558 ************************************************************ 559 */ 559 */ 560 int MCGIDI_target_heated_recast( statusMessage 560 int MCGIDI_target_heated_recast( statusMessageReporting *smr, MCGIDI_target_heated *target, GIDI_settings &settings ) { 561 561 562 int ir, projectilePoPID = target->projecti 562 int ir, projectilePoPID = target->projectilePOP->globalPoPsIndex; 563 ptwXPoints *totalGroupedCrossSection = NUL 563 ptwXPoints *totalGroupedCrossSection = NULL; 564 GIDI_settings_particle const *projectileSe 564 GIDI_settings_particle const *projectileSettings = settings.getParticle( projectilePoPID ); 565 nfu_status status_nf; 565 nfu_status status_nf; 566 566 567 if( projectileSettings == NULL ) { 567 if( projectileSettings == NULL ) { 568 smr_setReportError2( smr, smr_unknownI 568 smr_setReportError2( smr, smr_unknownID, 1, "Settings missing for projectile %s", target->projectilePOP->name ); 569 return( 1 ); 569 return( 1 ); 570 } 570 } 571 target->crossSectionGrouped = ptwX_free( t 571 target->crossSectionGrouped = ptwX_free( target->crossSectionGrouped ); 572 target->crossSectionGroupedForSampling = p 572 target->crossSectionGroupedForSampling = ptwX_free( target->crossSectionGroupedForSampling ); 573 if( projectileSettings->isEnergyMode_group 573 if( projectileSettings->isEnergyMode_grouped( ) ) { 574 int64_t numberOfGroups = projectileSet 574 int64_t numberOfGroups = projectileSettings->getNumberOfGroups( ); 575 575 576 if( ( totalGroupedCrossSection = ptwX_ 576 if( ( totalGroupedCrossSection = ptwX_createLine( numberOfGroups, numberOfGroups, 0, 0, &status_nf ) ) == NULL ) { 577 smr_setReportError2( smr, smr_unkn 577 smr_setReportError2( smr, smr_unknownID, 1, "totalGroupedCrossSection allocation failed: status_nf = %d, '%s'", 578 status_nf, nfu_statusMessa 578 status_nf, nfu_statusMessage( status_nf ) ); 579 goto err; 579 goto err; 580 } 580 } 581 } 581 } 582 582 583 for( ir = 0; ir < target->numberOfReaction 583 for( ir = 0; ir < target->numberOfReactions; ++ir ) { 584 if( MCGIDI_reaction_recast( smr, &(tar 584 if( MCGIDI_reaction_recast( smr, &(target->reactions[ir]), settings, projectileSettings, target->temperature_MeV, totalGroupedCrossSection ) != 0 ) goto err; 585 } 585 } 586 if( projectileSettings->isEnergyMode_group 586 if( projectileSettings->isEnergyMode_grouped( ) ) { 587 if( ( target->crossSectionGroupedForSa 587 if( ( target->crossSectionGroupedForSampling = ptwX_clone( totalGroupedCrossSection, &status_nf ) ) == NULL ) { 588 smr_setReportError2( smr, smr_unkn 588 smr_setReportError2( smr, smr_unknownID, 1, "totalGroupedCrossSection allocation failed: status_nf = %d, '%s'", 589 status_nf, nfu_statusMessa 589 status_nf, nfu_statusMessage( status_nf ) ); 590 goto err; 590 goto err; 591 } 591 } 592 for( ir = 0; ir < target->numberOfReac 592 for( ir = 0; ir < target->numberOfReactions; ++ir ) { 593 int index = target->reactions[ir]. 593 int index = target->reactions[ir].thresholdGroupIndex; 594 594 595 if( index > -1 ) { 595 if( index > -1 ) { 596 double xSec = target->reaction 596 double xSec = target->reactions[ir].thresholdGroupedDeltaCrossSection + 597 ptwX_getPointAtIndex_U 597 ptwX_getPointAtIndex_Unsafely( target->crossSectionGroupedForSampling, index ); 598 598 599 ptwX_setPointAtIndex( target-> 599 ptwX_setPointAtIndex( target->crossSectionGroupedForSampling, index, xSec ); 600 } 600 } 601 } 601 } 602 } 602 } 603 target->crossSectionGrouped = totalGrouped 603 target->crossSectionGrouped = totalGroupedCrossSection; 604 totalGroupedCrossSection = NULL; 604 totalGroupedCrossSection = NULL; 605 605 606 return( 0 ); 606 return( 0 ); 607 607 608 err: 608 err: 609 ptwX_free( totalGroupedCrossSection ); 609 ptwX_free( totalGroupedCrossSection ); 610 target->crossSectionGroupedForSampling = p 610 target->crossSectionGroupedForSampling = ptwX_free( target->crossSectionGroupedForSampling ); 611 return( 1 ); 611 return( 1 ); 612 } 612 } 613 613 614 #if defined __cplusplus 614 #if defined __cplusplus 615 } 615 } 616 #endif 616 #endif 617 617