1$ Hay-Wadt MB (n+1) ECP EMSL Basis Set Exchange Library 9/29/10 2:03 AM 2$ Elements References 3$ -------- ---------- 4$ K - Au: P. J. Hay and W. R. Wadt, J. Chem. Phys. 82, 299 (1985). 5$ P. J. Hay (Private Communication). 6$ 7a 19 8$ POTASSIUM (5s,5p) -> [2s,1p] 9$ POTASSIUM (5s,5p)->[2s,1p] 10$ S-TYPE FUNCTIONS 11 5 2 0 12 3.07200000 -0.30843000 0.06888700 13 0.67520000 0.78238400 -0.19902600 14 0.25450000 0.41445400 -0.27555200 15 0.05290000 -0.00243500 0.36195500 16 0.02090000 0.00292500 0.77817900 17$ P-TYPE FUNCTIONS 18 5 1 0 19 8.23300000 -0.04173800 20 0.95260000 0.57418900 21 0.30130000 0.52029600 22 0.03760000 0.03082200 23 0.01400000 -0.01161700 24a 20 25$ CALCIUM (5s,5p) -> [2s,1p] 26$ CALCIUM (5s,5p)->[2s,1p] 27$ S-TYPE FUNCTIONS 28 5 2 0 29 3.48400000 -0.34185500 0.09741400 30 0.85510000 0.77744500 -0.25564900 31 0.31920000 0.47181500 -0.44810700 32 0.14470000 -0.03492900 0.38319300 33 0.03500000 0.00724700 0.91745000 34$ P-TYPE FUNCTIONS 35 5 1 0 36 9.42000000 -0.04349200 37 1.15000000 0.60068100 38 0.36880000 0.49381400 39 0.07050000 0.01442700 40 0.02630000 -0.00043200 41a 21 42$ SCANDIUM (5s,5p,5d) -> [2s,1p,1d] 43$ SCANDIUM (5s,5p,5d)->[2s,1p,1d] 44$ S-TYPE FUNCTIONS 45 5 2 0 46 3.71700000 -0.39140300 0.10399600 47 1.09700000 0.71250200 -0.21514600 48 0.41640000 0.54922000 -0.32835400 49 0.07610000 0.00621500 0.53289500 50 0.02840000 -0.00058300 0.62744100 51$ P-TYPE FUNCTIONS 52 5 1 0 53 10.40000000 -0.04903700 54 1.31100000 0.60487300 55 0.42660000 0.48987700 56 0.04700000 0.02170700 57 0.01400000 -0.00713100 58$ D-TYPE FUNCTIONS 59 5 1 0 60 15.13000000 0.03131200 61 4.20500000 0.14351100 62 1.30300000 0.35235000 63 0.36800000 0.51502400 64 0.08120000 0.37776800 65a 22 66$ TITANIUM (5s,5p,5d) -> [2s,1p,1d] 67$ TITANIUM (5s,5p,5d)->[2s,1p,1d] 68$ S-TYPE FUNCTIONS 69 5 2 0 70 4.37200000 -0.36343900 0.09623500 71 1.09800000 0.81784400 -0.26185500 72 0.41780000 0.41814100 -0.27680100 73 0.08720000 0.00106700 0.53783800 74 0.03140000 0.00063100 0.63088200 75$ P-TYPE FUNCTIONS 76 5 1 0 77 12.52000000 -0.04552800 78 1.49100000 0.61812700 79 0.48590000 0.47484000 80 0.05300000 0.02080200 81 0.01600000 -0.00700800 82$ D-TYPE FUNCTIONS 83 5 1 0 84 20.21000000 0.02872600 85 5.49500000 0.14376500 86 1.69900000 0.37041100 87 0.48400000 0.51404000 88 0.11570000 0.34266000 89a 23 90$ VANADIUM (5s,5p,5d) -> [2s,1p,1d] 91$ VANADIUM (5s,5p,5d)->[2s,1p,1d] 92$ S-TYPE FUNCTIONS 93 5 2 0 94 4.59000000 -0.42530500 0.11223700 95 1.49300000 0.70296100 -0.21081400 96 0.55700000 0.58623800 -0.31993500 97 0.09750000 0.01193500 0.49392300 98 0.03420000 -0.00208900 0.65821300 99$ P-TYPE FUNCTIONS 100 5 1 0 101 13.76000000 -0.04805500 102 1.71200000 0.61187300 103 0.55870000 0.48206700 104 0.05900000 0.02197200 105 0.01800000 -0.00767800 106$ D-TYPE FUNCTIONS 107 5 1 0 108 25.70000000 0.02783700 109 6.53000000 0.15100700 110 2.07800000 0.36773600 111 0.62430000 0.50327400 112 0.15420000 0.33812900 113a 24 114$ CHROMIUM (5s,5p,5d) -> [2s,1p,1d] 115$ CHROMIUM (5s,5p,5d)->[2s,1p,1d] 116$ S-TYPE FUNCTIONS 117 5 2 0 118 5.36100000 -0.37960400 0.09896600 119 1.44900000 0.77758600 -0.24362300 120 0.54960000 0.47187800 -0.27166900 121 0.10520000 0.00446000 0.50026800 122 0.03640000 0.00076400 0.65464700 123$ P-TYPE FUNCTIONS 124 5 1 0 125 16.42000000 -0.04597800 126 1.91400000 0.60884900 127 0.62410000 0.48425500 128 0.06300000 0.02208600 129 0.01900000 -0.00787200 130$ D-TYPE FUNCTIONS 131 5 1 0 132 28.95000000 0.02862900 133 7.70800000 0.15089000 134 2.49500000 0.37037300 135 0.76550000 0.50358800 136 0.18890000 0.32801400 137a 25 138$ MANGANESE (5s,5p,5d) -> [2s,1p,1d] 139$ MANGANESE (5s,5p,5d)->[2s,1p,1d] 140$ S-TYPE FUNCTIONS 141 5 2 0 142 5.91400000 -0.37454100 0.09434400 143 1.60500000 0.76856000 -0.23139000 144 0.62600000 0.47451500 -0.26068200 145 0.11150000 0.01078600 0.48970500 146 0.03800000 -0.00155000 0.65599500 147$ P-TYPE FUNCTIONS 148 5 1 0 149 18.20000000 -0.04465000 150 2.14100000 0.62407300 151 0.70090000 0.46816400 152 0.06900000 0.02061000 153 0.02100000 -0.00749300 154$ D-TYPE FUNCTIONS 155 5 1 0 156 32.27000000 0.02895500 157 8.87500000 0.14928500 158 2.89000000 0.37249500 159 0.87610000 0.50379800 160 0.21200000 -0.33124400 161a 26 162$ IRON (5s,5p,5d) -> [3s,3p,2d] 163$ IRON (5s,5p,5d)->[3s,3p,2d] 164$ S-TYPE FUNCTIONS 165 5 3 0 166 6.42200000 -0.39278820 0.17868770 0.00000000 167 1.82600000 0.77126430 -0.41940320 0.00000000 168 0.71350000 0.49202280 -0.45681850 0.00000000 169 0.10210000 0.00000000 1.10350480 0.00000000 170 0.03630000 0.00000000 0.00000000 1.00000000 171$ P-TYPE FUNCTIONS 172 5 3 0 173 19.48000000 -0.04702820 0.00000000 0.00000000 174 2.38900000 0.62488410 0.00000000 0.00000000 175 0.77950000 0.47225420 0.00000000 0.00000000 176 0.07400000 0.00000000 1.00000000 0.00000000 177 0.02200000 0.00000000 0.00000000 1.00000000 178$ D-TYPE FUNCTIONS 179 5 2 0 180 37.08000000 0.03290000 0.00000000 181 10.10000000 0.17874180 0.00000000 182 3.22000000 0.44876570 0.00000000 183 0.96280000 0.58763610 0.00000000 184 0.22620000 0.00000000 1.00000000 185a 27 186$ COBALT (5s,5p,5d) -> [3s,3p,2d] 187$ COBALT (5s,5p,5d)->[3s,3p,2d] 188$ S-TYPE FUNCTIONS 189 5 3 0 190 7.17600000 -0.38567340 0.17361610 0.00000000 191 2.00900000 0.74531160 -0.39704420 0.00000000 192 0.80550000 0.50918190 -0.46306220 0.00000000 193 0.10700000 0.00000000 1.08996540 0.00000000 194 0.03750000 0.00000000 0.00000000 1.00000000 195$ P-TYPE FUNCTIONS 196 5 3 0 197 21.39000000 -0.04804130 0.00000000 0.00000000 198 2.65000000 0.62223370 0.00000000 0.00000000 199 0.86190000 0.47580420 0.00000000 0.00000000 200 0.08000000 0.00000000 1.00000000 0.00000000 201 0.02300000 0.00000000 0.00000000 1.00000000 202$ D-TYPE FUNCTIONS 203 5 2 0 204 39.25000000 0.03615410 0.00000000 205 10.78000000 0.18967440 0.00000000 206 3.49600000 0.45249810 0.00000000 207 1.06600000 0.57104270 0.00000000 208 0.26060000 0.00000000 1.00000000 209a 28 210$ NICKEL (5s,5p,5d) -> [3s,3p,2d] 211$ NICKEL (5s,5p,5d)->[3s,3p,2d] 212$ S-TYPE FUNCTIONS 213 5 3 0 214 7.62000000 -0.40825500 0.18725910 0.00000000 215 2.29400000 0.74553080 -0.39669640 0.00000000 216 0.87600000 0.53257210 -0.49540030 0.00000000 217 0.11530000 0.00000000 1.08443430 0.00000000 218 0.03960000 0.00000000 0.00000000 1.00000000 219$ P-TYPE FUNCTIONS 220 5 3 0 221 23.66000000 -0.04815580 0.00000000 0.00000000 222 2.89300000 0.62584730 0.00000000 0.00000000 223 0.94350000 0.47151580 0.00000000 0.00000000 224 0.08400000 0.00000000 1.00000000 0.00000000 225 0.02400000 0.00000000 0.00000000 1.00000000 226$ D-TYPE FUNCTIONS 227 5 2 0 228 42.72000000 0.03726990 0.00000000 229 11.76000000 0.19561030 0.00000000 230 3.81700000 0.45612730 0.00000000 231 1.16900000 0.56215870 0.00000000 232 0.28360000 0.00000000 1.00000000 233a 29 234$ COPPER (5s,5p,5d) -> [3s,3p,2d] 235$ COPPER (5s,5p,5d)->[3s,3p,2d] 236$ S-TYPE FUNCTIONS 237 5 3 0 238 8.17600000 -0.42102600 0.17876650 0.00000000 239 2.56800000 0.73859240 -0.35922730 0.00000000 240 0.95870000 0.55256920 -0.47048250 0.00000000 241 0.11530000 0.00000000 1.08074070 0.00000000 242 0.03960000 0.00000000 0.00000000 1.00000000 243$ P-TYPE FUNCTIONS 244 5 3 0 245 25.63000000 -0.04891730 0.00000000 0.00000000 246 3.16600000 0.62728540 0.00000000 0.00000000 247 1.02300000 0.47161880 0.00000000 0.00000000 248 0.08600000 0.00000000 1.00000000 0.00000000 249 0.02400000 0.00000000 0.00000000 1.00000000 250$ D-TYPE FUNCTIONS 251 5 2 0 252 41.34000000 0.04654240 0.00000000 253 11.42000000 0.22278240 0.00000000 254 3.83900000 0.45390590 0.00000000 255 1.23000000 0.53147690 0.00000000 256 0.31020000 0.00000000 1.00000000 257a 37 258$ RUBIDIUM (5s,6p) -> [3s,3p] 259$ RUBIDIUM (5s,6p)->[3s,3p] 260$ S-TYPE FUNCTIONS 261 5 3 0 262 1.45700000 -1.06174060 0.50521740 0.00000000 263 0.94000000 1.17221250 -0.57184040 0.00000000 264 0.27060000 0.74370080 -0.68353080 0.00000000 265 0.03660000 0.00000000 1.11364770 0.00000000 266 0.01550000 0.00000000 0.00000000 1.00000000 267$ P-TYPE FUNCTIONS 268 6 3 0 269 3.30000000 -0.07294170 0.00000000 0.00000000 270 0.59850000 0.63217820 0.00000000 0.00000000 271 0.20670000 0.47074260 0.00000000 0.00000000 272 0.19470000 0.00000000 -0.12505520 0.00000000 273 0.03180000 0.00000000 1.04382060 0.00000000 274 0.01240000 0.00000000 0.00000000 1.00000000 275a 38 276$ STRONTIUM (5s,5p) -> [2s,1p] 277$ STRONTIUM (5s,5p)->[2s,1p] 278$ S-TYPE FUNCTIONS 279 5 2 0 280 1.64800000 -0.95979600 0.31931100 281 1.00300000 1.09590100 -0.38062500 282 0.31060000 0.72622400 -0.52623400 283 0.10990000 -0.01472900 0.36500400 284 0.02920000 0.00829900 0.89764000 285$ P-TYPE FUNCTIONS 286 5 1 0 287 3.55200000 -0.08826000 288 0.69750000 0.66328400 289 0.24800000 0.43715800 290 0.05700000 0.01118600 291 0.02220000 0.00119100 292a 39 293$ YTTRIUM (5s,6p,4d) -> [3s,3p,2d] 294$ YTTRIUM (5s,6p,4d)->[3s,3p,2d] 295$ S-TYPE FUNCTIONS 296 5 3 0 297 1.75100000 -1.16179050 0.96831230 0.00000000 298 1.14300000 1.29588770 -1.13463670 0.00000000 299 0.35810000 0.71151250 -1.19140540 0.00000000 300 0.10580000 0.00000000 0.92810630 0.00000000 301 0.03180000 0.00000000 0.00000000 1.00000000 302$ P-TYPE FUNCTIONS 303 6 3 0 304 3.88400000 -0.08206010 0.00000000 0.00000000 305 0.76600000 0.67564130 0.00000000 0.00000000 306 0.28900000 0.41954820 0.00000000 0.00000000 307 0.28960000 0.00000000 -0.15010800 0.00000000 308 0.06290000 0.00000000 1.06869260 0.00000000 309 0.02230000 0.00000000 0.00000000 1.00000000 310$ D-TYPE FUNCTIONS 311 4 2 0 312 1.52300000 0.10748430 0.00000000 313 0.56340000 0.45639540 0.00000000 314 0.18340000 0.60398550 0.00000000 315 0.05690000 0.00000000 1.00000000 316a 40 317$ ZIRCONIUM (5s,6p,4d) -> [3s,3p,2d] 318$ ZIRCONIUM (5s,6p,4d)->[3s,3p,2d] 319$ S-TYPE FUNCTIONS 320 5 3 0 321 1.97600000 -0.92067450 0.75060600 0.00000000 322 1.15400000 1.09290330 -0.98108260 0.00000000 323 0.39100000 0.67956210 -1.02251510 0.00000000 324 0.10010000 0.00000000 1.08600380 0.00000000 325 0.03340000 0.00000000 0.00000000 1.00000000 326$ P-TYPE FUNCTIONS 327 6 3 0 328 4.19200000 -0.09425540 0.00000000 0.00000000 329 0.87640000 0.67836750 0.00000000 0.00000000 330 0.32630000 0.42466180 0.00000000 0.00000000 331 0.29720000 0.00000000 -0.15274010 0.00000000 332 0.07240000 0.00000000 1.07771850 0.00000000 333 0.02430000 0.00000000 0.00000000 1.00000000 334$ D-TYPE FUNCTIONS 335 4 2 0 336 2.26900000 0.05997410 0.00000000 337 0.78550000 0.47341580 0.00000000 338 0.26150000 0.61171780 0.00000000 339 0.08020000 0.00000000 1.00000000 340a 41 341$ NIOBIUM (5s,6p,4d) -> [3s,3p,2d] 342$ NIOBIUM (5s,6p,4d)->[3s,3p,2d] 343$ S-TYPE FUNCTIONS 344 5 3 0 345 2.18200000 -0.88461440 0.77902870 0.00000000 346 1.20900000 1.10337750 -1.07527880 0.00000000 347 0.41650000 0.62987760 -1.15060140 0.00000000 348 0.14540000 0.00000000 0.99691550 0.00000000 349 0.03920000 0.00000000 0.00000000 1.00000000 350$ P-TYPE FUNCTIONS 351 6 3 0 352 4.51900000 -0.08173030 0.00000000 0.00000000 353 0.94060000 0.69951150 0.00000000 0.00000000 354 0.34920000 0.39809960 0.00000000 0.00000000 355 0.41060000 0.00000000 -0.12121760 0.00000000 356 0.07520000 0.00000000 1.04804770 0.00000000 357 0.02470000 0.00000000 0.00000000 1.00000000 358$ D-TYPE FUNCTIONS 359 4 2 0 360 3.46600000 0.03159830 0.00000000 361 0.99380000 0.48343060 0.00000000 362 0.33500000 0.61648930 0.00000000 363 0.10240000 0.00000000 1.00000000 364a 42 365$ MOLYBDENUM (5s,6p,4d) -> [3s,3p,2d] 366$ MOLYBDENUM (5s,6p,4d)->[3s,3p,2d] 367$ S-TYPE FUNCTIONS 368 5 3 0 369 2.36100000 -0.91217600 0.81392590 0.00000000 370 1.30900000 1.14774530 -1.13600840 0.00000000 371 0.45000000 0.60971090 -1.16115920 0.00000000 372 0.16810000 0.00000000 1.00647860 0.00000000 373 0.04230000 0.00000000 0.00000000 1.00000000 374$ P-TYPE FUNCTIONS 375 6 3 0 376 4.89500000 -0.09082580 0.00000000 0.00000000 377 1.04400000 0.70428990 0.00000000 0.00000000 378 0.38770000 0.39731790 0.00000000 0.00000000 379 0.49950000 0.00000000 -0.10819450 0.00000000 380 0.07800000 0.00000000 1.03680930 0.00000000 381 0.02470000 0.00000000 0.00000000 1.00000000 382$ D-TYPE FUNCTIONS 383 4 2 0 384 2.99300000 0.05270630 0.00000000 385 1.06300000 0.50039070 0.00000000 386 0.37210000 0.57940240 0.00000000 387 0.11780000 0.00000000 1.00000000 388a 43 389$ TECHNETIUM (5s,6p,4d) -> [3s,3p,2d] 390$ TECHNETIUM (5s,6p,4d)->[3s,3p,2d] 391$ S-TYPE FUNCTIONS 392 5 3 0 393 2.34200000 -1.49117820 1.35239970 0.00000000 394 1.63400000 1.67490430 -1.62163010 0.00000000 395 0.50940000 0.65730060 -1.14637700 0.00000000 396 0.17060000 0.00000000 0.98591900 0.00000000 397 0.04350000 0.00000000 0.00000000 1.00000000 398$ P-TYPE FUNCTIONS 399 6 3 0 400 5.27800000 -0.09954190 0.00000000 0.00000000 401 1.15600000 0.70815440 0.00000000 0.00000000 402 0.43020000 0.39735710 0.00000000 0.00000000 403 0.47670000 0.00000000 -0.09731270 0.00000000 404 0.08950000 0.00000000 1.04048620 0.00000000 405 0.02460000 0.00000000 0.00000000 1.00000000 406$ D-TYPE FUNCTIONS 407 4 2 0 408 4.63200000 0.02687240 0.00000000 409 1.27900000 0.50730890 0.00000000 410 0.44250000 0.59113810 0.00000000 411 0.13640000 0.00000000 1.00000000 412a 44 413$ RUTHENIUM (5s,6p,4d) -> [3s,3p,2d] 414$ RUTHENIUM (5s,6p,4d)->[3s,3p,2d] 415$ S-TYPE FUNCTIONS 416 5 3 0 417 2.56500000 -1.04310560 0.87701280 0.00000000 418 1.50800000 1.33147860 -1.26346600 0.00000000 419 0.51290000 0.56130650 -0.83849870 0.00000000 420 0.13620000 0.00000000 1.06377730 0.00000000 421 0.04170000 0.00000000 0.00000000 1.00000000 422$ P-TYPE FUNCTIONS 423 6 3 0 424 4.85900000 -0.09457550 0.00000000 0.00000000 425 1.21900000 0.74347980 0.00000000 0.00000000 426 0.44130000 0.36681440 0.00000000 0.00000000 427 0.57250000 0.00000000 -0.08808640 0.00000000 428 0.08300000 0.00000000 1.02839700 0.00000000 429 0.02500000 0.00000000 0.00000000 1.00000000 430$ D-TYPE FUNCTIONS 431 4 2 0 432 4.19500000 0.04857290 0.00000000 433 1.37700000 0.51052230 0.00000000 434 0.48280000 0.57300280 0.00000000 435 0.15010000 0.00000000 1.00000000 436a 45 437$ RHODIUM (5s,6p,4d) -> [3s,3p,2d] 438$ RHODIUM (5s,6p,4d)->[3s,3p,2d] 439$ S-TYPE FUNCTIONS 440 5 3 0 441 2.64600000 -1.35540840 1.14721370 0.00000000 442 1.75100000 1.61122330 -1.49435250 0.00000000 443 0.57130000 0.58938140 -0.85897040 0.00000000 444 0.14380000 0.00000000 1.02972410 0.00000000 445 0.04280000 0.00000000 0.00000000 1.00000000 446$ P-TYPE FUNCTIONS 447 6 3 0 448 5.44000000 -0.09876990 0.00000000 0.00000000 449 1.32900000 0.74335950 0.00000000 0.00000000 450 0.48450000 0.36684620 0.00000000 0.00000000 451 0.65950000 0.00000000 -0.08380560 0.00000000 452 0.08690000 0.00000000 1.02448410 0.00000000 453 0.02570000 0.00000000 0.00000000 1.00000000 454$ D-TYPE FUNCTIONS 455 4 2 0 456 3.66900000 0.07600590 0.00000000 457 1.42300000 0.51588520 0.00000000 458 0.50910000 0.54365850 0.00000000 459 0.16100000 0.00000000 1.00000000 460a 46 461$ PALLADIUM (5s,6p,4d) -> [3s,3p,2d] 462$ PALLADIUM (5s,6p,4d)->[3s,3p,2d] 463$ S-TYPE FUNCTIONS 464 5 3 0 465 2.78700000 -1.61023930 1.35407750 0.00000000 466 1.96500000 1.84898420 -1.67808480 0.00000000 467 0.62430000 0.60374920 -0.85593810 0.00000000 468 0.14960000 0.00000000 1.02002990 0.00000000 469 0.04360000 0.00000000 0.00000000 1.00000000 470$ P-TYPE FUNCTIONS 471 6 3 0 472 5.99900000 -0.10349100 0.00000000 0.00000000 473 1.44300000 0.74569520 0.00000000 0.00000000 474 0.52640000 0.36564940 0.00000000 0.00000000 475 0.73680000 0.00000000 0.07632850 0.00000000 476 0.08990000 0.00000000 0.97400650 0.00000000 477 0.02620000 0.00000000 0.00000000 1.00000000 478$ D-TYPE FUNCTIONS 479 4 2 0 480 6.09100000 0.03761460 0.00000000 481 1.71900000 0.52004790 0.00000000 482 0.60560000 0.57060710 0.00000000 483 0.18830000 0.00000000 1.00000000 484a 47 485$ SILVER (5s,6p,4d) -> [3s,3p,2d] 486$ SILVER (5s,6p,4d)->[3s,3p,2d] 487$ S-TYPE FUNCTIONS 488 5 3 0 489 2.95000000 -1.79105640 1.01411250 0.00000000 490 2.14900000 2.02445700 -1.24139710 0.00000000 491 0.66840000 0.60728390 -1.24139710 0.00000000 492 0.09970000 0.00000000 1.11283750 0.00000000 493 0.03470000 0.00000000 0.00000000 1.00000000 494$ P-TYPE FUNCTIONS 495 6 3 0 496 6.55300000 -0.10791170 0.00000000 0.00000000 497 1.56500000 0.74036450 0.00000000 0.00000000 498 0.57480000 0.37210080 0.00000000 0.00000000 499 0.90850000 0.00000000 -0.04183710 0.00000000 500 0.08330000 0.00000000 1.00875860 0.00000000 501 0.02520000 0.00000000 0.00000000 1.00000000 502$ D-TYPE FUNCTIONS 503 4 2 0 504 3.39100000 0.13969380 0.00000000 505 1.59900000 0.47444210 0.00000000 506 0.62820000 0.51563110 0.00000000 507 0.21080000 0.00000000 1.00000000 508a 55 509$ CESIUM (5s,6p) -> [3s,3p] 510$ CESIUM (5s,6p)->[3s,3p] 511$ S-TYPE FUNCTIONS 512 5 3 0 513 0.87090000 -1.16047980 0.82377270 0.00000000 514 0.53930000 1.41985150 -1.07091810 0.00000000 515 0.17240000 0.58729050 -0.90851220 0.00000000 516 0.03930000 0.00000000 1.07740490 0.00000000 517 0.01510000 0.00000000 0.00000000 1.00000000 518$ P-TYPE FUNCTIONS 519 6 3 0 520 1.46800000 -0.13210330 0.00000000 0.00000000 521 0.41340000 0.65724100 0.00000000 0.00000000 522 0.15360000 0.47564560 0.00000000 0.00000000 523 0.14580000 0.00000000 -0.16805560 0.00000000 524 0.02790000 0.00000000 1.06657460 0.00000000 525 0.01130000 0.00000000 0.00000000 1.00000000 526a 56 527$ BARIUM (5s,6p) -> [3s,3p] 528$ BARIUM (5s,6p)->[3s,3p] 529$ S-TYPE FUNCTIONS 530 5 3 0 531 0.86990000 -2.25497470 2.03913830 0.00000000 532 0.66760000 2.51457860 -2.37177120 0.00000000 533 0.19820000 0.57751840 -1.27580060 0.00000000 534 0.08230000 0.00000000 1.17033460 0.00000000 535 0.02310000 0.00000000 0.00000000 1.00000000 536$ P-TYPE FUNCTIONS 537 6 3 0 538 1.60500000 -0.16264030 0.00000000 0.00000000 539 0.47900000 0.69712890 0.00000000 0.00000000 540 0.18180000 0.45051070 0.00000000 0.00000000 541 0.18040000 0.00000000 -0.26425370 0.00000000 542 0.04760000 0.00000000 1.13472120 0.00000000 543 0.01920000 0.00000000 0.00000000 1.00000000 544a 57 545$ LANTHANUM (5s,6p,3d) -> [3s,3p,2d] 546$ LANTHANUM (5s,6p,3d)->[3s,3p,2d] 547$ S-TYPE FUNCTIONS 548 5 3 0 549 0.91670000 -3.02407510 2.69102430 0.00000000 550 0.74270000 3.29714760 -3.04743630 0.00000000 551 0.22370000 0.55135420 -1.10302110 0.00000000 552 0.07920000 0.00000000 1.19418630 0.00000000 553 0.02390000 0.00000000 0.00000000 1.00000000 554$ P-TYPE FUNCTIONS 555 6 3 0 556 1.55400000 -0.18171680 0.00000000 0.00000000 557 0.56220000 0.66322260 0.00000000 0.00000000 558 0.22390000 0.50297820 0.00000000 0.00000000 559 0.21250000 0.00000000 -0.19688100 0.00000000 560 0.04830000 0.00000000 1.09075420 0.00000000 561 0.01790000 0.00000000 0.00000000 1.00000000 562$ D-TYPE FUNCTIONS 563 3 2 0 564 0.45240000 0.44680510 0.00000000 565 0.16020000 0.65434930 0.00000000 566 0.05310000 0.00000000 1.00000000 567a 72 568$ HAFNIUM (5s,6p,3d) -> [3s,3p,2d] 569$ HAFNIUM (5s,6p,3d)->[3s,3p,2d] 570$ S-TYPE FUNCTIONS 571 5 3 0 572 1.95000000 -1.22608500 1.07783820 0.00000000 573 1.18300000 1.56950740 -1.50108620 0.00000000 574 0.38970000 0.49334120 -1.19821750 0.00000000 575 0.16560000 0.00000000 1.22902960 0.00000000 576 0.04240000 0.00000000 0.00000000 1.00000000 577$ P-TYPE FUNCTIONS 578 6 3 0 579 1.97200000 -0.63234670 0.00000000 0.00000000 580 1.35400000 1.04651620 0.00000000 0.00000000 581 0.41340000 0.58016700 0.00000000 0.00000000 582 0.34270000 0.00000000 -0.17391780 0.00000000 583 0.08040000 0.00000000 1.08416440 0.00000000 584 0.02740000 0.00000000 0.00000000 1.00000000 585$ D-TYPE FUNCTIONS 586 3 2 0 587 0.82260000 0.44904050 0.00000000 588 0.25850000 0.67238910 0.00000000 589 0.07620000 0.00000000 1.00000000 590a 73 591$ TANTALUM (5s,6p,3d) -> [3s,3p,2d] 592$ TANTALUM (5s,6p,3d)->[3s,3p,2d] 593$ S-TYPE FUNCTIONS 594 5 3 0 595 2.04400000 -1.31047790 1.18973150 0.00000000 596 1.26700000 1.65799250 -1.66504620 0.00000000 597 0.41570000 0.48483370 -1.05633350 0.00000000 598 0.16710000 0.00000000 1.18406520 0.00000000 599 0.04820000 0.00000000 0.00000000 1.00000000 600$ P-TYPE FUNCTIONS 601 6 3 0 602 2.56500000 -0.29172380 0.00000000 0.00000000 603 1.22900000 0.75706490 0.00000000 0.00000000 604 0.42440000 0.52400810 0.00000000 0.00000000 605 0.43600000 0.00000000 -0.15130140 0.00000000 606 0.08400000 0.00000000 1.06131230 0.00000000 607 0.02800000 0.00000000 0.00000000 1.00000000 608$ D-TYPE FUNCTIONS 609 3 2 0 610 0.89480000 0.47310720 0.00000000 611 0.29890000 0.63992000 0.00000000 612 0.09350000 0.00000000 1.00000000 613a 74 614$ TUNGSTEN (5s,6p,3d) -> [3s,3p,2d] 615$ TUNGSTEN (5s,6p,3d)->[3s,3p,2d] 616$ S-TYPE FUNCTIONS 617 5 3 0 618 2.13700000 -1.39161510 1.29850880 0.00000000 619 1.34700000 1.75102610 -1.81024290 0.00000000 620 0.43660000 0.46946470 -1.08445310 0.00000000 621 0.18830000 0.00000000 1.25806180 0.00000000 622 0.05180000 0.00000000 0.00000000 1.00000000 623$ P-TYPE FUNCTIONS 624 6 3 0 625 3.00500000 -0.24055630 0.00000000 0.00000000 626 1.22800000 0.73640920 0.00000000 0.00000000 627 0.44150000 0.48814870 0.00000000 0.00000000 628 0.40100000 0.00000000 -0.14974990 0.00000000 629 0.09000000 0.00000000 1.07074630 0.00000000 630 0.02800000 0.00000000 0.00000000 1.00000000 631$ D-TYPE FUNCTIONS 632 3 2 0 633 0.95190000 0.49852650 0.00000000 634 0.32700000 0.61111100 0.00000000 635 0.10540000 0.00000000 1.00000000 636a 75 637$ RHENIUM (5s,6p,3d) -> [3s,3p,2d] 638$ RHENIUM (5s,6p,3d)->[3s,3p,2d] 639$ S-TYPE FUNCTIONS 640 5 3 0 641 2.18500000 -1.62237300 1.54597520 0.00000000 642 1.45100000 1.99386470 -2.07589270 0.00000000 643 0.45850000 0.45311660 -1.19223960 0.00000000 644 0.23140000 0.00000000 1.22728640 0.00000000 645 0.05660000 0.00000000 0.00000000 1.00000000 646$ P-TYPE FUNCTIONS 647 6 3 0 648 3.35800000 -0.23186670 0.00000000 0.00000000 649 1.27100000 0.74586830 0.00000000 0.00000000 650 0.46440000 0.46326860 0.00000000 0.00000000 651 0.49600000 0.00000000 -0.13113700 0.00000000 652 0.08900000 0.00000000 1.05036710 0.00000000 653 0.02800000 0.00000000 0.00000000 1.00000000 654$ D-TYPE FUNCTIONS 655 3 2 0 656 1.11600000 0.46898880 0.00000000 657 0.42670000 0.62095910 0.00000000 658 0.13780000 0.00000000 1.00000000 659a 76 660$ OSMIUM (5s,6p,3d) -> [3s,3p,2d] 661$ OSMIUM (5s,6p,3d)->[3s,3p,2d] 662$ S-TYPE FUNCTIONS 663 5 3 0 664 2.22200000 -1.65380360 1.60469680 0.00000000 665 1.49600000 2.06702970 -2.21203860 0.00000000 666 0.47740000 0.42320170 -1.13012090 0.00000000 667 0.24370000 0.00000000 1.26545530 0.00000000 668 0.05830000 0.00000000 0.00000000 1.00000000 669$ P-TYPE FUNCTIONS 670 6 3 0 671 2.51800000 -0.41773450 0.00000000 0.00000000 672 1.46000000 0.94349470 0.00000000 0.00000000 673 0.49230000 0.46729760 0.00000000 0.00000000 674 0.51000000 0.00000000 -0.14902790 0.00000000 675 0.09800000 0.00000000 1.06036160 0.00000000 676 0.02900000 0.00000000 0.00000000 1.00000000 677$ D-TYPE FUNCTIONS 678 3 2 0 679 1.18300000 0.48384700 0.00000000 680 0.44920000 0.60795730 0.00000000 681 0.14630000 0.00000000 1.00000000 682a 77 683$ IRIDIUM (5s,6p,3d) -> [3s,3p,2d] 684$ IRIDIUM (5s,6p,3d)->[3s,3p,2d] 685$ S-TYPE FUNCTIONS 686 5 3 0 687 2.35000000 -1.67846420 1.64644670 0.00000000 688 1.58200000 2.09525530 -2.27481500 0.00000000 689 0.50180000 0.41629340 -1.04943570 0.00000000 690 0.25000000 0.00000000 1.21677910 0.00000000 691 0.05980000 0.00000000 0.00000000 1.00000000 692$ P-TYPE FUNCTIONS 693 6 3 0 694 2.79200000 -0.38892120 0.00000000 0.00000000 695 1.54100000 0.90775160 0.00000000 0.00000000 696 0.52850000 0.46914430 0.00000000 0.00000000 697 0.51000000 0.00000000 -0.11706690 0.00000000 698 0.09800000 0.00000000 1.04890020 0.00000000 699 0.02900000 0.00000000 0.00000000 1.00000000 700$ D-TYPE FUNCTIONS 701 3 2 0 702 1.24000000 0.50870220 0.00000000 703 0.46470000 0.58621020 0.00000000 704 0.15290000 0.00000000 1.00000000 705a 78 706$ PLATINUM (5s,6p,3d) -> [3s,3p,2d] 707$ PLATINUM (5s,6p,3d)->[3s,3p,2d] 708$ S-TYPE FUNCTIONS 709 5 3 0 710 2.54700000 -1.47391750 1.43881660 0.00000000 711 1.61400000 1.91157190 -2.09118210 0.00000000 712 0.51670000 0.39223190 -1.09213150 0.00000000 713 0.26510000 0.00000000 1.34265960 0.00000000 714 0.05800000 0.00000000 0.00000000 1.00000000 715$ P-TYPE FUNCTIONS 716 6 3 0 717 2.91100000 -0.52474380 0.00000000 0.00000000 718 1.83600000 0.96718840 0.00000000 0.00000000 719 0.59820000 0.54386320 0.00000000 0.00000000 720 0.60480000 0.00000000 -0.10614380 0.00000000 721 0.09960000 0.00000000 1.03831020 0.00000000 722 0.02900000 0.00000000 0.00000000 1.00000000 723$ D-TYPE FUNCTIONS 724 3 2 0 725 1.24300000 0.55981500 0.00000000 726 0.42710000 0.55110900 0.00000000 727 0.13700000 0.00000000 1.00000000 728a 79 729$ GOLD (5s,6p,3d) -> [3s,3p,2d] 730$ GOLD (5s,6p,3d)->[3s,3p,2d] 731$ S-TYPE FUNCTIONS 732 5 3 0 733 2.80900000 -1.20215560 1.16084810 0.00000000 734 1.59500000 1.67415780 -1.86428460 0.00000000 735 0.53270000 0.35265930 -1.03562300 0.00000000 736 0.28260000 0.00000000 1.30643990 0.00000000 737 0.05980000 0.00000000 0.00000000 1.00000000 738$ P-TYPE FUNCTIONS 739 6 3 0 740 3.68400000 -0.28026810 0.00000000 0.00000000 741 1.66600000 0.78183980 0.00000000 0.00000000 742 0.59890000 0.48047760 0.00000000 0.00000000 743 0.68380000 0.00000000 -0.09520780 0.00000000 744 0.09770000 0.00000000 1.02991470 0.00000000 745 0.02790000 0.00000000 0.00000000 1.00000000 746$ D-TYPE FUNCTIONS 747 3 2 0 748 1.28700000 0.58442730 0.00000000 749 0.43350000 0.52981610 0.00000000 750 0.13960000 0.00000000 1.00000000 751 752$ END OF BASIS 753