1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413
|
$Basis = GAMESS VTZ
$Elements supported
$H Be B C N O F Ne Na Mg Al Si P S Cl Ar
$
$ REFERENCE
$ T. H. DUNNING, JR., J. CHEM. PHYS. 55, 716 (1971)
$ A.D. MCLEAN AND G.S. CHANDLER, J. CHEM. PHYS. 72, 5639 (1980)
$ A.J.H. WATCHERS, J. CHEM. PHYS. 52, 1033 (1970).
$
a 1
$ HYDROGEN (5s) -> [3s]
$ S-TYPE FUNCTIONS
5 3 0
33.6400000 0.02537400 0.00000000 0.00000000
5.0580000 0.18968400 0.00000000 0.00000000
1.1470000 0.85293300 0.00000000 0.00000000
0.3211000 0.00000000 1.00000000 0.00000000
0.1013000 0.00000000 0.00000000 1.00000000
a 4
$ BERYLLIUM (10s,5p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
3630.0000000 0.00083900 0.00000000 0.00000000 0.00000000 0.00000000
532.3000000 0.00673500 0.00000000 0.00000000 0.00000000 0.00000000
117.8000000 0.03572600 0.00000000 0.00000000 0.00000000 0.00000000
32.6600000 0.13863500 0.00000000 0.00000000 0.00000000 0.00000000
10.4800000 0.38539900 0.00000000 0.00000000 0.00000000 0.00000000
3.6680000 0.54768800 0.00000000 0.00000000 0.00000000 0.00000000
3.6680000 0.00000000 0.21340600 0.00000000 0.00000000 0.00000000
1.3540000 0.00000000 0.81469200 0.00000000 0.00000000 0.00000000
0.3890000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.1502000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.0524100 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
5 3 0
3.2020000 0.05291200 0.00000000 0.00000000
0.6923000 0.26765900 0.00000000 0.00000000
0.2016000 0.79208500 0.00000000 0.00000000
0.1183000 0.00000000 1.00000000 0.00000000
0.0694000 0.00000000 0.00000000 1.00000000
a 5
$ BORON (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
6250.0000000 0.00079800 0.00000000 0.00000000 0.00000000 0.00000000
916.1000000 0.00641000 0.00000000 0.00000000 0.00000000 0.00000000
202.2000000 0.03429900 0.00000000 0.00000000 0.00000000 0.00000000
55.8300000 0.13548700 0.00000000 0.00000000 0.00000000 0.00000000
17.8600000 0.38853200 0.00000000 0.00000000 0.00000000 0.00000000
6.2530000 0.54775800 0.00000000 0.00000000 0.00000000 0.00000000
6.2530000 0.00000000 0.23264300 0.00000000 0.00000000 0.00000000
2.3120000 0.00000000 0.79721900 0.00000000 0.00000000 0.00000000
0.6824000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.2604000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.0894000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
15.4600000 0.01682200 0.00000000 0.00000000
3.4830000 0.10087800 0.00000000 0.00000000
1.0660000 0.33689500 0.00000000 0.00000000
0.3928000 0.67231700 0.00000000 0.00000000
0.1503000 0.00000000 1.00000000 0.00000000
0.0572200 0.00000000 0.00000000 1.00000000
a 6
$ CARBON (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
9471.0000000 0.00077600 0.00000000 0.00000000 0.00000000 0.00000000
1398.0000000 0.00621800 0.00000000 0.00000000 0.00000000 0.00000000
307.5000000 0.03357500 0.00000000 0.00000000 0.00000000 0.00000000
84.5400000 0.13427800 0.00000000 0.00000000 0.00000000 0.00000000
26.9100000 0.39366800 0.00000000 0.00000000 0.00000000 0.00000000
9.4090000 0.54416900 0.00000000 0.00000000 0.00000000 0.00000000
9.4090000 0.00000000 0.24807500 0.00000000 0.00000000 0.00000000
3.5000000 0.00000000 0.78284400 0.00000000 0.00000000 0.00000000
1.0680000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.4002000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.1351000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
25.3700000 0.01629500 0.00000000 0.00000000
5.7760000 0.10209800 0.00000000 0.00000000
1.7870000 0.34022800 0.00000000 0.00000000
0.6577000 0.66826900 0.00000000 0.00000000
0.2480000 0.00000000 1.00000000 0.00000000
0.0910600 0.00000000 0.00000000 1.00000000
a 7
$ NITROGEN (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
13520.0000000 0.00076000 0.00000000 0.00000000 0.00000000 0.00000000
1999.0000000 0.00607600 0.00000000 0.00000000 0.00000000 0.00000000
440.0000000 0.03284700 0.00000000 0.00000000 0.00000000 0.00000000
120.9000000 0.13239600 0.00000000 0.00000000 0.00000000 0.00000000
38.4700000 0.39326100 0.00000000 0.00000000 0.00000000 0.00000000
13.4600000 0.54633900 0.00000000 0.00000000 0.00000000 0.00000000
13.4600000 0.00000000 0.25203600 0.00000000 0.00000000 0.00000000
4.9930000 0.00000000 0.77938500 0.00000000 0.00000000 0.00000000
1.5690000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.5800000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.1923000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
35.9100000 0.01691600 0.00000000 0.00000000
8.4800000 0.10220000 0.00000000 0.00000000
2.7060000 0.33813400 0.00000000 0.00000000
0.9921000 0.66928100 0.00000000 0.00000000
0.3727000 0.00000000 1.00000000 0.00000000
0.1346000 0.00000000 0.00000000 1.00000000
a 8
$ OXYGEN (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
18050.0000000 0.00075700 0.00000000 0.00000000 0.00000000 0.00000000
2660.0000000 0.00606600 0.00000000 0.00000000 0.00000000 0.00000000
585.7000000 0.03278200 0.00000000 0.00000000 0.00000000 0.00000000
160.9000000 0.13260900 0.00000000 0.00000000 0.00000000 0.00000000
51.1600000 0.39683900 0.00000000 0.00000000 0.00000000 0.00000000
17.9000000 0.54257200 0.00000000 0.00000000 0.00000000 0.00000000
17.9000000 0.00000000 0.26249000 0.00000000 0.00000000 0.00000000
6.6390000 0.00000000 0.76982800 0.00000000 0.00000000 0.00000000
2.0770000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.7736000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.2558000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
49.8300000 0.01635800 0.00000000 0.00000000
11.4900000 0.10645300 0.00000000 0.00000000
3.6090000 0.34930200 0.00000000 0.00000000
1.3210000 0.65718300 0.00000000 0.00000000
0.4821000 0.00000000 1.00000000 0.00000000
0.1651000 0.00000000 0.00000000 1.00000000
a 9
$ FLUORINE (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
23340.0000000 0.00075700 0.00000000 0.00000000 0.00000000 0.00000000
3431.0000000 0.00608100 0.00000000 0.00000000 0.00000000 0.00000000
757.7000000 0.03263600 0.00000000 0.00000000 0.00000000 0.00000000
209.2000000 0.13170400 0.00000000 0.00000000 0.00000000 0.00000000
66.7300000 0.39624000 0.00000000 0.00000000 0.00000000 0.00000000
23.3700000 0.54367200 0.00000000 0.00000000 0.00000000 0.00000000
23.3700000 0.00000000 0.26489300 0.00000000 0.00000000 0.00000000
8.6240000 0.00000000 0.76792500 0.00000000 0.00000000 0.00000000
2.6920000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
1.0090000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.3312000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
65.6600000 0.01603700 0.00000000 0.00000000
15.2200000 0.10569700 0.00000000 0.00000000
4.7880000 0.35022700 0.00000000 0.00000000
1.7320000 0.65819500 0.00000000 0.00000000
0.6206000 0.00000000 1.00000000 0.00000000
0.2070000 0.00000000 0.00000000 1.00000000
a 10
$ NEON (10s,6p) -> [5s,3p]
$ S-TYPE FUNCTIONS
11 5 0
28660.0000000 0.00076700 0.00000000 0.00000000 0.00000000 0.00000000
4263.0000000 0.00606800 0.00000000 0.00000000 0.00000000 0.00000000
946.8000000 0.03247400 0.00000000 0.00000000 0.00000000 0.00000000
261.5000000 0.13146800 0.00000000 0.00000000 0.00000000 0.00000000
83.3400000 0.39772300 0.00000000 0.00000000 0.00000000 0.00000000
29.1700000 0.54249100 0.00000000 0.00000000 0.00000000 0.00000000
29.1700000 0.00000000 0.26906500 0.00000000 0.00000000 0.00000000
10.7600000 0.00000000 0.76412100 0.00000000 0.00000000 0.00000000
3.3430000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
1.2410000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.4063000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
6 3 0
84.8400000 0.01555000 0.00000000 0.00000000
19.7100000 0.10301100 0.00000000 0.00000000
6.2190000 0.34921500 0.00000000 0.00000000
2.2110000 0.66283900 0.00000000 0.00000000
0.7853000 0.00000000 1.00000000 0.00000000
0.2566000 0.00000000 0.00000000 1.00000000
a 11
$ SODIUM (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
36166.40000 0.00103200 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
5372.58000000 0.00807100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1213.21000000 0.04212900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
339.62000000 0.16978900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
109.55000000 0.51462100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38.77700000 0.37981700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
38.77700000 0.00000000 0.37476200 0.00000000 0.00000000 0.00000000 0.00000000
14.57600000 0.00000000 0.57576900 0.00000000 0.00000000 0.00000000 0.00000000
5.26990000 0.00000000 0.11293300 0.00000000 0.00000000 0.00000000 0.00000000
1.82780000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
0.61990000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.05720000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.02400000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
9 5 0
144.64500000 0.01148500 0.00000000 0.00000000 0.00000000 0.00000000
33.90700000 0.08238300 0.00000000 0.00000000 0.00000000 0.00000000
10.62900000 0.31965800 0.00000000 0.00000000 0.00000000 0.00000000
3.82390000 0.70129500 0.00000000 0.00000000 0.00000000 0.00000000
1.44430000 0.00000000 0.63850600 0.00000000 0.00000000 0.00000000
0.55260000 0.00000000 0.42536500 0.00000000 0.00000000 0.00000000
0.18870000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.04650000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.01630000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 12
$ MAGNESIUM (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
43866.50000 0.00091800 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
6605.37000000 0.00704700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1513.26000000 0.03594100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
432.31700000 0.14146100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
142.14900000 0.42676400 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51.39800000 0.49797500 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
51.39800000 0.00000000 0.25135500 0.00000000 0.00000000 0.00000000 0.00000000
19.92000000 0.00000000 0.61867100 0.00000000 0.00000000 0.00000000 0.00000000
8.02470000 0.00000000 0.18841700 0.00000000 0.00000000 0.00000000 0.00000000
2.50820000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
0.87150000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.10820000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.04010000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
9 5 0
193.85400000 0.01018800 0.00000000 0.00000000 0.00000000 0.00000000
45.44200000 0.07536000 0.00000000 0.00000000 0.00000000 0.00000000
14.18600000 0.30741900 0.00000000 0.00000000 0.00000000 0.00000000
5.05750000 0.71757500 0.00000000 0.00000000 0.00000000 0.00000000
1.88860000 0.00000000 0.66733900 0.00000000 0.00000000 0.00000000
0.72270000 0.00000000 0.39464900 0.00000000 0.00000000 0.00000000
0.23640000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.09340000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.03480000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 13
$ ALUMINUM (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
54866.49000 0.00083900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
8211.77000000 0.00652700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1866.18000000 0.03366600 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
531.12900000 0.13290200 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
175.11800000 0.40126600 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
64.00550000 0.53133800 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
64.00550000 0.00000000 0.20230500 0.00000000 0.00000000 0.00000000 0.00000000
25.29250000 0.00000000 0.62479000 0.00000000 0.00000000 0.00000000 0.00000000
10.53490000 0.00000000 0.22743900 0.00000000 0.00000000 0.00000000 0.00000000
3.20670000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
1.15260000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.17670000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.06520000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
9 5 0
259.28400000 0.00944800 0.00000000 0.00000000 0.00000000 0.00000000
61.07690000 0.07097400 0.00000000 0.00000000 0.00000000 0.00000000
19.30320000 0.29563600 0.00000000 0.00000000 0.00000000 0.00000000
7.01090000 0.72821900 0.00000000 0.00000000 0.00000000 0.00000000
2.67390000 0.00000000 0.64446700 0.00000000 0.00000000 0.00000000
1.03660000 0.00000000 0.41741300 0.00000000 0.00000000 0.00000000
0.31680000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.11430000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.04140000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 14
$ SILICON (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
69379.23000 0.00075700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
10354.94000 0.00593200 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2333.88000000 0.03108800 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
657.14000000 0.12496700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
214.30000000 0.38689700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
77.62900000 0.55488800 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
77.62900000 0.00000000 0.17788100 0.00000000 0.00000000 0.00000000 0.00000000
30.63100000 0.00000000 0.62776500 0.00000000 0.00000000 0.00000000 0.00000000
12.80100000 0.00000000 0.24762300 0.00000000 0.00000000 0.00000000 0.00000000
3.92690000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
1.45230000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.25620000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.09430000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
9 5 0
335.48000000 0.00886600 0.00000000 0.00000000 0.00000000 0.00000000
78.90000000 0.06829900 0.00000000 0.00000000 0.00000000 0.00000000
24.98800000 0.29095800 0.00000000 0.00000000 0.00000000 0.00000000
9.21970000 0.73211600 0.00000000 0.00000000 0.00000000 0.00000000
3.62110000 0.00000000 0.61987900 0.00000000 0.00000000 0.00000000
1.45130000 0.00000000 0.43914800 0.00000000 0.00000000 0.00000000
0.50500000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.18630000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.06540000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 15
$ PHOSPHORUS (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
77492.43000 0.00078700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
11605.79000 0.00610700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
2645.96000000 0.03137300 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
754.98000000 0.12423900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
248.75000000 0.38089300 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
91.15700000 0.55981200 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
91.15700000 0.00000000 0.16398600 0.00000000 0.00000000 0.00000000 0.00000000
36.22600000 0.00000000 0.62595000 0.00000000 0.00000000 0.00000000 0.00000000
15.21100000 0.00000000 0.26219600 0.00000000 0.00000000 0.00000000 0.00000000
4.71380000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
1.78270000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.34250000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.12460000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
10 5 0
384.84000000 0.00324000 0.00000000 0.00000000 0.00000000 0.00000000
90.55200000 0.02492500 0.00000000 0.00000000 0.00000000 0.00000000
28.80600000 0.10569700 0.00000000 0.00000000 0.00000000 0.00000000
10.68800000 0.26322900 0.00000000 0.00000000 0.00000000 0.00000000
4.25210000 0.71905300 0.00000000 0.00000000 0.00000000 0.00000000
4.25210000 0.00000000 -1.61273900 0.00000000 0.00000000 0.00000000
1.74050000 0.00000000 1.20508300 0.00000000 0.00000000 0.00000000
0.59790000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.22920000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.08380000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 16
$ SULFUR (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
93413.40000 0.00074200 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
13961.70000 0.00579000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3169.90000000 0.02994500 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
902.46000000 0.11897100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
297.16000000 0.36827300 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
108.70200000 0.57750700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
108.70200000 0.00000000 0.14294300 0.00000000 0.00000000 0.00000000 0.00000000
43.15500000 0.00000000 0.62460600 0.00000000 0.00000000 0.00000000 0.00000000
18.10800000 0.00000000 0.28343800 0.00000000 0.00000000 0.00000000 0.00000000
5.57050000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
2.14270000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.43400000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.15700000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
10 5 0
495.04000000 0.00272000 0.00000000 0.00000000 0.00000000 0.00000000
117.22000000 0.02109000 0.00000000 0.00000000 0.00000000 0.00000000
37.50700000 0.09236900 0.00000000 0.00000000 0.00000000 0.00000000
13.91000000 0.24678100 0.00000000 0.00000000 0.00000000 0.00000000
5.50450000 0.74384000 0.00000000 0.00000000 0.00000000 0.00000000
5.50450000 0.00000000 -1.60871900 0.00000000 0.00000000 0.00000000
2.24330000 0.00000000 1.22325500 0.00000000 0.00000000 0.00000000
0.77620000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.29190000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.10290000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 17
$ CHLORINE (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
105818.80000 0.00074300 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
15872.00000 0.00575300 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
3619.70000000 0.02967600 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1030.80000000 0.11801000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
339.91000000 0.36523000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
124.53800000 0.58122100 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
124.53800000 0.00000000 0.13754800 0.00000000 0.00000000 0.00000000 0.00000000
49.51400000 0.00000000 0.62288100 0.00000000 0.00000000 0.00000000 0.00000000
20.80600000 0.00000000 0.29014300 0.00000000 0.00000000 0.00000000 0.00000000
6.46480000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
2.52540000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.53780000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.19350000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
10 5 0
589.78000000 0.00276000 0.00000000 0.00000000 0.00000000 0.00000000
139.85000000 0.02153600 0.00000000 0.00000000 0.00000000 0.00000000
44.79500000 0.09591600 0.00000000 0.00000000 0.00000000 0.00000000
16.61200000 0.26231500 0.00000000 0.00000000 0.00000000 0.00000000
6.59950000 0.72681100 0.00000000 0.00000000 0.00000000 0.00000000
6.59950000 0.00000000 -1.56429400 0.00000000 0.00000000 0.00000000
2.71410000 0.00000000 1.49577800 0.00000000 0.00000000 0.00000000
0.95280000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.35800000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.12500000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
a 18
$ ARGON (12s,9p) -> [6s,5p]
$ S-TYPE FUNCTIONS
13 6 0
118022.40000 0.00074700 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
17683.50000 0.00579000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
4027.80000000 0.02991900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
1145.40000000 0.11920600 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
377.16000000 0.36902800 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
138.16000000 0.57645900 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000
138.16000000 0.00000000 0.14392700 0.00000000 0.00000000 0.00000000 0.00000000
54.98900000 0.00000000 0.62293800 0.00000000 0.00000000 0.00000000 0.00000000
23.17100000 0.00000000 0.28396400 0.00000000 0.00000000 0.00000000 0.00000000
7.37790000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000 0.00000000
2.92370000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.65040000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.23280000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
$ P-TYPE FUNCTIONS
10 5 0
663.06000000 0.00308200 0.00000000 0.00000000 0.00000000 0.00000000
157.09000000 0.02416500 0.00000000 0.00000000 0.00000000 0.00000000
50.23100000 0.10822300 0.00000000 0.00000000 0.00000000 0.00000000
18.63500000 0.29419200 0.00000000 0.00000000 0.00000000 0.00000000
7.44650000 0.68786200 0.00000000 0.00000000 0.00000000 0.00000000
7.44650000 0.00000000 -1.21448200 0.00000000 0.00000000 0.00000000
3.09570000 0.00000000 1.63237000 0.00000000 0.00000000 0.00000000
1.10650000 0.00000000 0.00000000 1.00000000 0.00000000 0.00000000
0.41560000 0.00000000 0.00000000 0.00000000 1.00000000 0.00000000
0.14540000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000
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