| 56 | | strcpy( chFilename , Species[intNS].chptrSpName ); |
| 57 | | strcat( chFilename , ".elvlc"); |
| 58 | | uncaps( chFilename ); |
| 59 | | strcpy( chEnFilename , cpu.DataPath() ); |
| 60 | | strcat( chEnFilename , chFilename ); |
| 61 | | if(DEBUGSTATE) |
| 62 | | printf("The data file is %s \n",chFilename); |
| | 55 | strcpy( chEnFilename , Species[intNS].chptrSpName ); |
| | 56 | strcat( chEnFilename , ".elvlc"); |
| | 57 | uncaps( chEnFilename ); |
| | 58 | if(DEBUGSTATE) |
| | 59 | printf("The data file is %s \n",chEnFilename); |
| 66 | | fprintf( ioQQQ," moldat_readin opening %s:",chFilename); |
| 67 | | |
| 68 | | if( ( atmolLevDATA = fopen( chEnFilename , "r" ) ) == NULL ) |
| 69 | | { |
| 70 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename ); |
| 71 | | fprintf( ioQQQ, " even tried path\n" ); |
| 72 | | |
| 73 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename); |
| 74 | | fprintf( ioQQQ, " path is ==%s==\n",cpu.DataPath() ); |
| 75 | | fprintf( ioQQQ, " final path is ==%s==\n",chEnFilename ); |
| 76 | | |
| 77 | | /* make announcement that path probably not set */ |
| 78 | | path_not_set(); |
| 79 | | |
| 80 | | cdEXIT(EXIT_FAILURE); |
| 81 | | } |
| 82 | | |
| 83 | | if( read_whole_line( chLine , (int)sizeof(chLine) , atmolLevDATA ) == NULL ) |
| 84 | | { |
| 85 | | fprintf( ioQQQ, " moldat_readin could not read first line of %s.\n",chFilename); |
| 86 | | cdEXIT(EXIT_FAILURE); |
| 87 | | } |
| 88 | | /*Rewind the file*/ |
| 89 | | if( fseek( atmolLevDATA , 0 , SEEK_SET ) != 0 ) |
| 90 | | { |
| 91 | | fprintf( ioQQQ, " moldat_readin could not rewind %s.\n",chFilename); |
| 92 | | cdEXIT(EXIT_FAILURE); |
| 93 | | } |
| | 63 | fprintf( ioQQQ," moldat_readin opening %s:",chEnFilename); |
| | 64 | |
| | 65 | atmolLevDATA = open_data( chEnFilename, "r" ); |
| | 66 | |
| 95 | | strcpy( chFilename , Species[intNS].chptrSpName ); |
| 96 | | strcat( chFilename , ".wgfa"); |
| 97 | | uncaps( chFilename ); |
| 98 | | strcpy( chTraFilename , cpu.DataPath() ); |
| 99 | | strcat( chTraFilename , chFilename ); |
| 100 | | if(DEBUGSTATE) |
| 101 | | printf("The data file is %s \n",chFilename); |
| | 68 | strcpy( chTraFilename , Species[intNS].chptrSpName ); |
| | 69 | strcat( chTraFilename , ".wgfa"); |
| | 70 | uncaps( chTraFilename ); |
| | 71 | if(DEBUGSTATE) |
| | 72 | printf("The data file is %s \n",chTraFilename); |
| 105 | | fprintf( ioQQQ," moldat_readin opening %s:",chFilename); |
| 106 | | |
| 107 | | if( ( atmolTraDATA = fopen( chTraFilename , "r" ) ) == NULL ) |
| 108 | | { |
| 109 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename ); |
| 110 | | fprintf( ioQQQ, " even tried path\n" ); |
| 111 | | |
| 112 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename); |
| 113 | | fprintf( ioQQQ, " path is ==%s==\n",cpu.DataPath() ); |
| 114 | | fprintf( ioQQQ, " final path is ==%s==\n",chTraFilename ); |
| 115 | | |
| 116 | | /* make announcement that path probably not set */ |
| 117 | | path_not_set(); |
| 118 | | |
| 119 | | cdEXIT(EXIT_FAILURE); |
| 120 | | } |
| 121 | | |
| 122 | | if( read_whole_line( chLine , (int)sizeof(chLine) , atmolTraDATA ) == NULL ) |
| 123 | | { |
| 124 | | fprintf( ioQQQ, " moldat_readin could not read first line of %s.\n",chFilename); |
| 125 | | cdEXIT(EXIT_FAILURE); |
| 126 | | } |
| 127 | | /*Rewind the file*/ |
| 128 | | if( fseek( atmolTraDATA , 0 , SEEK_SET ) != 0 ) |
| 129 | | { |
| 130 | | fprintf( ioQQQ, " moldat_readin could not rewind %s.\n",chFilename); |
| 131 | | cdEXIT(EXIT_FAILURE); |
| 132 | | } |
| | 76 | fprintf( ioQQQ," moldat_readin opening %s:",chTraFilename); |
| | 77 | |
| | 78 | atmolTraDATA = open_data( chTraFilename, "r" ); |
| | 79 | |
| 134 | | strcpy( chFilename , Species[intNS].chptrSpName ); |
| 135 | | strcat( chFilename , ".splups"); |
| 136 | | uncaps( chFilename ); |
| 137 | | strcpy( chEleColFilename , cpu.DataPath() ); |
| 138 | | strcat( chEleColFilename , chFilename ); |
| 139 | | if(DEBUGSTATE) |
| 140 | | printf("The data file is %s \n",chFilename); |
| | 81 | strcpy( chEleColFilename , Species[intNS].chptrSpName ); |
| | 82 | strcat( chEleColFilename , ".splups"); |
| | 83 | uncaps( chEleColFilename ); |
| | 84 | if(DEBUGSTATE) |
| | 85 | printf("The data file is %s \n",chEleColFilename); |
| 143 | | fprintf( ioQQQ," moldat_readin opening %s:",chFilename); |
| 144 | | if( ( atmolEleColDATA = fopen( chEleColFilename , "r" ) ) == NULL ) |
| 145 | | { |
| 146 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename ); |
| 147 | | fprintf( ioQQQ, " even tried path\n" ); |
| 148 | | |
| 149 | | fprintf( ioQQQ, " moldat_readin could not open %s \n",chFilename); |
| 150 | | fprintf( ioQQQ, " path is ==%s==\n",cpu.DataPath() ); |
| 151 | | fprintf( ioQQQ, " final path is ==%s==\n",chEleColFilename ); |
| 152 | | |
| 153 | | /* make announcement that path probably not set */ |
| 154 | | path_not_set(); |
| 155 | | |
| 156 | | cdEXIT(EXIT_FAILURE); |
| 157 | | } |
| 158 | | |
| 159 | | if( read_whole_line( chLine , (int)sizeof(chLine) , atmolEleColDATA ) == NULL ) |
| 160 | | { |
| 161 | | fprintf( ioQQQ, " moldat_readin could not read first line of %s.\n",chFilename); |
| 162 | | cdEXIT(EXIT_FAILURE); |
| 163 | | } |
| 164 | | /*Rewind the electron collision data file*/ |
| 165 | | if( fseek(atmolEleColDATA , 0 , SEEK_SET ) != 0 ) |
| 166 | | { |
| 167 | | fprintf( ioQQQ, " moldat_readin could not rewind %s.\n",chFilename); |
| 168 | | cdEXIT(EXIT_FAILURE); |
| 169 | | } |
| | 88 | fprintf( ioQQQ," moldat_readin opening %s:",chEleColFilename); |
| | 89 | |
| | 90 | atmolEleColDATA = open_data( chEleColFilename, "r" ); |
| | 91 | |
| 171 | | strcpy( chFilename , Species[intNS].chptrSpName ); |
| 172 | | strcat( chFilename , ".psplups"); |
| 173 | | uncaps( chFilename ); |
| 174 | | strcpy( chProColFilename , cpu.DataPath() ); |
| 175 | | strcat( chProColFilename , chFilename ); |
| 176 | | if(DEBUGSTATE) |
| 177 | | printf("The data file is %s \n",chFilename); |
| | 93 | strcpy( chProColFilename , Species[intNS].chptrSpName ); |
| | 94 | strcat( chProColFilename , ".psplups"); |
| | 95 | uncaps( chProColFilename ); |
| | 96 | if(DEBUGSTATE) |
| | 97 | printf("The data file is %s \n",chProColFilename); |