TELLURIUM K(2)L(8)M(18)4S(2)4P(6)5S(2)4D(10)5P(4), 3P
CHARGE = 52.000000
SYMMETRY SPECIES S P D
NUMBER OF BASIS FUNCTIONS 23 19 12
NUMBER OF CLOSED SHELLS 5 3 2
NUMBER OF OPEN SHELLS 0 1 0
OPEN SHELL OCCUPATION NUMBER 0 4 0
*** FINAL SCF RESULTS ***
E = -6791.194123300
ORBITAL ENERGIES AND EXPANSION COEFFICIENTS
S 1S 2S 3S 4S 5S
BASIS/ORB.ENERGY -1175.0234000 -183.7646400 -38.1059430 -7.1074663 -0.7464163
S 1.3679460D+09 0.0000221 -0.0000076 -0.0000034 0.0000015 -0.0000005
S 1.3840070D+08 0.0000864 -0.0000299 -0.0000133 0.0000059 -0.0000020
S 2.2653740D+07 0.0002631 -0.0000910 -0.0000405 0.0000181 -0.0000060
S 4.8087910D+06 0.0007019 -0.0002429 -0.0001083 0.0000483 -0.0000161
S 1.2145840D+06 0.0017130 -0.0005942 -0.0002649 0.0001181 -0.0000393
S 3.4944390D+05 0.0039609 -0.0013788 -0.0006149 0.0002744 -0.0000913
S 1.1127380D+05 0.0088427 -0.0031010 -0.0013849 0.0006175 -0.0002055
S 3.8892950D+04 0.0191498 -0.0067880 -0.0030341 0.0013555 -0.0004514
S 1.4740350D+04 0.0411607 -0.0149126 -0.0066955 0.0029848 -0.0009935
S 5.9493830D+03 0.0870671 -0.0326475 -0.0147046 0.0065917 -0.0021962
S 2.5369970D+03 0.1718392 -0.0692741 -0.0316362 0.0141201 -0.0047024
S 1.1318960D+03 0.2871226 -0.1315397 -0.0610366 0.0276281 -0.0092176
S 5.2436790D+02 0.3331758 -0.1960039 -0.0954490 0.0428960 -0.0143191
S 2.4943870D+02 0.1973318 -0.1265765 -0.0631912 0.0300384 -0.0100729
S 1.1168480D+02 0.0318275 0.2750007 0.1837339 -0.0924897 0.0313709
S 5.5564540D+01 -0.0027602 0.5874056 0.5520041 -0.2805621 0.0961368
S 2.7901800D+01 0.0014619 0.2933899 0.2756363 -0.1724543 0.0610122
S 1.2897780D+01 -0.0007851 0.0268387 -0.7004936 0.6023932 -0.2283706
S 6.5154310D+00 0.0003585 -0.0011560 -0.6214358 0.7206175 -0.2918531
S 2.5788470D+00 -0.0001368 0.0001955 -0.0586759 -0.7353442 0.4092394
S 1.1970580D+00 0.0000582 -0.0001816 0.0051326 -0.7214649 0.5522288
S 2.8282710D-01 -0.0000142 0.0000343 -0.0011816 -0.0299328 -0.7529509
S 1.0920250D-01 0.0000054 -0.0000115 0.0004588 0.0061888 -0.5210030
P 2P 3P 4P 5P
BASIS/ORB.ENERGY -164.7998700 -31.7772260 -5.0510582 -0.3580673
P 1.5049580D+06 0.0000316 -0.0000148 -0.0000064 0.0000018
P 2.2049710D+05 0.0001250 -0.0000584 -0.0000252 0.0000070
P 4.8494470D+04 0.0004600 -0.0002154 -0.0000927 0.0000258
P 1.3771370D+04 0.0016209 -0.0007618 -0.0003285 0.0000913
P 4.7166030D+03 0.0055821 -0.0026369 -0.0011368 0.0003159
P 1.8323020D+03 0.0186324 -0.0089004 -0.0038515 0.0010715
P 7.7736320D+02 0.0569426 -0.0277361 -0.0120265 0.0033450
P 3.5286710D+02 0.1462105 -0.0739755 -0.0323920 0.0090292
P 1.6852540D+02 0.2863152 -0.1525350 -0.0673417 0.0187832
P 8.3523740D+01 0.3698129 -0.2065470 -0.0926407 0.0259338
P 4.2277110D+01 0.2461241 -0.0558518 -0.0132632 0.0031046
P 2.1125040D+01 0.0582002 0.3467756 0.2125492 -0.0624233
P 1.0777520D+01 0.0013351 0.5411591 0.3853770 -0.1166398
P 5.4825470D+00 0.0007749 0.2237680 -0.0076263 0.0161856
P 2.6663100D+00 -0.0004370 0.0191622 -0.5982678 0.2277873
P 1.2446870D+00 0.0001065 0.0012555 -0.4862726 0.2170049
P 4.8850810D-01 -0.0000584 -0.0001222 -0.0652608 -0.2171784
P 2.0170690D-01 0.0000250 0.0000493 0.0038797 -0.6112459
P 7.4612940D-02 -0.0000065 -0.0000253 -0.0015715 -0.3551264
D 3D 4D
BASIS/ORB.ENERGY -22.1829400 -1.9523718
D 2.9748340D+03 0.0003014 -0.0001207
D 8.3510790D+02 0.0025059 -0.0009996
D 3.1511590D+02 0.0138234 -0.0055811
D 1.3690400D+02 0.0534725 -0.0216554
D 6.4812320D+01 0.1475963 -0.0612127
D 3.2292150D+01 0.2875359 -0.1175945
D 1.6335140D+01 0.3776473 -0.1476994
D 8.3150830D+00 0.2717871 -0.0288015
D 4.1069480D+00 0.0762828 0.2770301
D 1.9639020D+00 0.0040570 0.4694738
D 8.9960090D-01 0.0004550 0.3386363
D 3.6986900D-01 -0.0001375 0.0848022