MOLPRO Basis Query, element=Tl, basis=cc-pVQZ-DK, l=s
Basis Tl s cc-pVQZ-DK
Primitives | Contractions... |
587047320.000000 | 0.000246 | -0.000096 | 0.000046 | -0.000023 | 0.000010 | 0.000003 | 0.000000 | 0.000000 | 0.000000 |
173216820.000000 | 0.000183 | -0.000072 | 0.000034 | -0.000017 | 0.000008 | 0.000002 | 0.000000 | 0.000000 | 0.000000 |
55917610.000000 | 0.000660 | -0.000259 | 0.000124 | -0.000062 | 0.000028 | 0.000009 | 0.000000 | 0.000000 | 0.000000 |
19429078.000000 | 0.000963 | -0.000378 | 0.000182 | -0.000091 | 0.000040 | 0.000013 | 0.000000 | 0.000000 | 0.000000 |
7168112.100000 | 0.002002 | -0.000786 | 0.000378 | -0.000190 | 0.000084 | 0.000027 | 0.000000 | 0.000000 | 0.000000 |
2777168.500000 | 0.003325 | -0.001309 | 0.000629 | -0.000317 | 0.000140 | 0.000044 | 0.000000 | 0.000000 | 0.000000 |
1120013.900000 | 0.006060 | -0.002393 | 0.001152 | -0.000579 | 0.000257 | 0.000081 | 0.000000 | 0.000000 | 0.000000 |
467005.120000 | 0.010286 | -0.004087 | 0.001968 | -0.000990 | 0.000439 | 0.000139 | 0.000000 | 0.000000 | 0.000000 |
200316.050000 | 0.017978 | -0.007205 | 0.003476 | -0.001749 | 0.000775 | 0.000245 | 0.000000 | 0.000000 | 0.000000 |
88080.861000 | 0.030669 | -0.012461 | 0.006024 | -0.003033 | 0.001344 | 0.000425 | 0.000000 | 0.000000 | 0.000000 |
39613.477000 | 0.052796 | -0.021901 | 0.010626 | -0.005357 | 0.002375 | 0.000751 | 0.000000 | 0.000000 | 0.000000 |
18199.664000 | 0.089265 | -0.038261 | 0.018666 | -0.009416 | 0.004173 | 0.001320 | 0.000000 | 0.000000 | 0.000000 |
8537.619500 | 0.147086 | -0.066401 | 0.032696 | -0.016547 | 0.007345 | 0.002324 | 0.000000 | 0.000000 | 0.000000 |
4089.585200 | 0.222977 | -0.109493 | 0.054726 | -0.027759 | 0.012314 | 0.003894 | 0.000000 | 0.000000 | 0.000000 |
2000.875200 | 0.281815 | -0.157423 | 0.080698 | -0.041291 | 0.018391 | 0.005825 | 0.000000 | 0.000000 | 0.000000 |
1000.213600 | 0.243116 | -0.151591 | 0.079500 | -0.040696 | 0.018049 | 0.005701 | 0.000000 | 0.000000 | 0.000000 |
510.889510 | 0.103956 | 0.021964 | -0.025325 | 0.014578 | -0.006531 | -0.002052 | 0.000000 | 0.000000 | 0.000000 |
266.525760 | 0.012192 | 0.373970 | -0.310288 | 0.180045 | -0.082961 | -0.026465 | 0.000000 | 0.000000 | 0.000000 |
141.848320 | 0.000884 | 0.502779 | -0.544212 | 0.334575 | -0.155046 | -0.049339 | 0.000000 | 0.000000 | 0.000000 |
76.850433 | -0.000549 | 0.218072 | -0.166580 | 0.110879 | -0.055607 | -0.018194 | 0.000000 | 0.000000 | 0.000000 |
42.240666 | 0.000393 | 0.021967 | 0.663587 | -0.698717 | 0.379539 | 0.125001 | 0.000000 | 0.000000 | 0.000000 |
23.439848 | -0.000341 | 0.000875 | 0.606346 | -0.833308 | 0.462031 | 0.151234 | 0.000000 | 0.000000 | 0.000000 |
13.044848 | 0.000245 | -0.000276 | 0.116689 | 0.277367 | -0.199481 | -0.065341 | 0.000000 | 0.000000 | 0.000000 |
7.218363 | -0.000154 | -0.000059 | 0.010292 | 0.921986 | -0.925459 | -0.350068 | 0.000000 | 0.000000 | 0.000000 |
3.928575 | 0.000092 | -0.000009 | -0.001899 | 0.355521 | -0.470485 | -0.178897 | 0.000000 | 0.000000 | 0.000000 |
2.075039 | -0.000049 | 0.000005 | 0.001185 | 0.013135 | 0.747119 | 0.379869 | 0.000000 | 0.000000 | 0.000000 |
1.038229 | 0.000023 | 0.000007 | -0.000710 | 0.004736 | 0.733866 | 0.500701 | 0.000000 | 0.000000 | 0.000000 |
0.464956 | -0.000012 | -0.000002 | 0.000333 | -0.001641 | 0.117533 | 0.084364 | 0.000000 | 0.000000 | 0.000000 |
0.233884 | 0.000006 | 0.000001 | -0.000187 | 0.000979 | -0.007673 | -0.505132 | 1.000000 | 0.000000 | 0.000000 |
0.104962 | -0.000002 | -0.000000 | 0.000071 | -0.000371 | 0.002884 | -0.600669 | 0.000000 | 1.000000 | 0.000000 |
0.046719 | 0.000001 | 0.000000 | -0.000018 | 0.000092 | -0.000599 | -0.169810 | 0.000000 | 0.000000 | 1.000000 |
Comment: D.H. Bross and K.A. Peterson, Theor. Chem. Acc. 133, 1434(2013)