MOLPRO Basis Query, element=Tm, basis=cc-pwCVQZ-DK3, l=s
Basis Tm s cc-pwCVQZ-DK3
Primitives | Contractions... |
67026860.000000 | 0.000443 | -0.000228 | 0.000133 | -0.000033 | 0.000016 | -0.000007 | -0.000015 | 0.000022 | -0.000027 | 0.000027 | 0.000000 | 0.000000 | 0.000000 |
17853570.000000 | 0.000425 | -0.000219 | 0.000128 | -0.000031 | 0.000016 | -0.000007 | -0.000014 | 0.000021 | -0.000026 | 0.000026 | 0.000000 | 0.000000 | 0.000000 |
6133802.000000 | 0.001227 | -0.000633 | 0.000369 | -0.000090 | 0.000046 | -0.000020 | -0.000041 | 0.000061 | -0.000076 | 0.000075 | 0.000000 | 0.000000 | 0.000000 |
2351840.000000 | 0.001663 | -0.000859 | 0.000502 | -0.000123 | 0.000062 | -0.000027 | -0.000056 | 0.000083 | -0.000103 | 0.000102 | 0.000000 | 0.000000 | 0.000000 |
989706.000000 | 0.003304 | -0.001708 | 0.000999 | -0.000244 | 0.000124 | -0.000055 | -0.000111 | 0.000166 | -0.000205 | 0.000202 | 0.000000 | 0.000000 | 0.000000 |
441674.500000 | 0.004925 | -0.002554 | 0.001497 | -0.000366 | 0.000185 | -0.000082 | -0.000167 | 0.000249 | -0.000307 | 0.000304 | 0.000000 | 0.000000 | 0.000000 |
207103.700000 | 0.008616 | -0.004485 | 0.002636 | -0.000645 | 0.000326 | -0.000144 | -0.000294 | 0.000438 | -0.000541 | 0.000531 | 0.000000 | 0.000000 | 0.000000 |
100571.800000 | 0.013406 | -0.007022 | 0.004143 | -0.001016 | 0.000514 | -0.000227 | -0.000463 | 0.000689 | -0.000850 | 0.000848 | 0.000000 | 0.000000 | 0.000000 |
50264.770000 | 0.022480 | -0.011873 | 0.007040 | -0.001729 | 0.000874 | -0.000387 | -0.000788 | 0.001175 | -0.001451 | 0.001413 | 0.000000 | 0.000000 | 0.000000 |
25693.970000 | 0.035872 | -0.019196 | 0.011471 | -0.002825 | 0.001429 | -0.000632 | -0.001288 | 0.001916 | -0.002362 | 0.002385 | 0.000000 | 0.000000 | 0.000000 |
13394.770000 | 0.058906 | -0.032111 | 0.019404 | -0.004799 | 0.002426 | -0.001074 | -0.002185 | 0.003264 | -0.004034 | 0.003871 | 0.000000 | 0.000000 | 0.000000 |
7103.517000 | 0.092986 | -0.052210 | 0.032092 | -0.007987 | 0.004036 | -0.001786 | -0.003640 | 0.005408 | -0.006666 | 0.006858 | 0.000000 | 0.000000 | 0.000000 |
3826.648000 | 0.142346 | -0.083645 | 0.052761 | -0.013260 | 0.006696 | -0.002963 | -0.006030 | 0.009031 | -0.011182 | 0.010461 | 0.000000 | 0.000000 | 0.000000 |
2093.445000 | 0.194644 | -0.123258 | 0.080906 | -0.020645 | 0.010415 | -0.004611 | -0.009406 | 0.013940 | -0.017171 | 0.018338 | 0.000000 | 0.000000 | 0.000000 |
1164.037000 | 0.221345 | -0.156810 | 0.108945 | -0.028440 | 0.014326 | -0.006340 | -0.012901 | 0.019453 | -0.024198 | 0.021032 | 0.000000 | 0.000000 | 0.000000 |
657.966400 | 0.180275 | -0.143692 | 0.105677 | -0.028281 | 0.014226 | -0.006302 | -0.012911 | 0.018854 | -0.023063 | 0.029299 | 0.000000 | 0.000000 | 0.000000 |
377.482100 | 0.095586 | -0.038940 | 0.016615 | -0.003122 | 0.001608 | -0.000701 | -0.001280 | 0.002764 | -0.003995 | -0.009826 | 0.000000 | 0.000000 | 0.000000 |
218.508400 | 0.050892 | 0.158941 | -0.213579 | 0.072458 | -0.036078 | 0.015978 | 0.032586 | -0.051006 | 0.065475 | -0.036822 | 0.000000 | 0.000000 | 0.000000 |
128.709300 | 0.059831 | 0.302886 | -0.495959 | 0.188607 | -0.093802 | 0.041695 | 0.086596 | -0.126819 | 0.157667 | -0.222543 | 0.000000 | 0.000000 | 0.000000 |
76.665750 | 0.046318 | 0.238001 | -0.512306 | 0.217890 | -0.108410 | 0.048124 | 0.099257 | -0.159523 | 0.205707 | -0.078869 | 0.000000 | 0.000000 | 0.000000 |
46.366020 | 0.021669 | 0.116040 | -0.090348 | 0.029670 | -0.016324 | 0.007561 | 0.017312 | -0.009244 | 0.022468 | -0.327222 | 0.000000 | 0.000000 | 0.000000 |
28.867720 | 0.018843 | 0.144822 | 0.489277 | -0.414627 | 0.217114 | -0.098483 | -0.213673 | 0.297782 | -0.405171 | 1.027600 | 0.000000 | 0.000000 | 0.000000 |
18.228650 | 0.019993 | 0.151255 | 0.595402 | -0.669198 | 0.361168 | -0.163737 | -0.381465 | 0.732051 | -1.218470 | 0.809456 | 0.000000 | 0.000000 | 0.000000 |
11.394760 | 0.008719 | 0.070592 | 0.277208 | -0.252589 | 0.125793 | -0.057221 | -0.108485 | 0.025537 | 0.267675 | 0.146824 | 0.000000 | 0.000000 | 0.000000 |
6.740215 | 0.001347 | 0.007947 | 0.014227 | 0.473371 | -0.308505 | 0.146208 | 0.471564 | -0.953592 | 2.080840 | -5.525520 | 0.000000 | 0.000000 | 0.000000 |
4.088204 | -0.000568 | -0.004119 | -0.040794 | 0.670614 | -0.573070 | 0.282505 | 0.721875 | -1.501910 | 2.594950 | 3.120290 | 0.000000 | 0.000000 | 0.000000 |
2.448957 | -0.000061 | -0.001700 | -0.016745 | 0.286459 | -0.368740 | 0.195251 | 0.402539 | 0.656797 | -6.935740 | 8.183420 | 0.000000 | 0.000000 | 0.000000 |
1.469437 | -0.000097 | -0.000362 | -0.003375 | 0.053471 | 0.153790 | -0.098079 | -1.268460 | 2.779700 | 0.920410 | -11.380600 | 0.000000 | 0.000000 | 0.000000 |
0.823755 | 0.000022 | -0.000101 | -0.000949 | 0.036916 | 0.549411 | -0.332166 | -0.791970 | -0.431091 | 5.244450 | 2.105850 | 0.000000 | 0.000000 | 0.000000 |
0.462024 | -0.000025 | -0.000086 | -0.000857 | 0.027188 | 0.434305 | -0.381202 | 0.161608 | -2.355730 | -1.991200 | 6.072820 | 0.000000 | 0.000000 | 0.000000 |
0.253815 | 0.000006 | -0.000017 | -0.000158 | 0.007025 | 0.096781 | -0.196174 | 0.813646 | 0.005522 | -2.505000 | -4.522810 | 0.000000 | 0.000000 | 0.000000 |
0.118469 | -0.000004 | -0.000004 | -0.000043 | 0.001137 | 0.040816 | 0.164879 | 0.816371 | 1.534590 | 1.292960 | -1.598220 | 0.000000 | 0.000000 | 0.000000 |
0.063203 | 0.000002 | -0.000005 | -0.000039 | 0.002696 | 0.106130 | 0.505136 | -0.115163 | 0.327910 | 1.127460 | 3.297510 | 0.000000 | 0.000000 | 0.000000 |
0.032343 | -0.000001 | -0.000005 | -0.000048 | 0.002354 | 0.094636 | 0.450309 | -0.585514 | -0.632113 | -0.533876 | -0.450401 | 0.000000 | 0.000000 | 0.000000 |
0.016451 | 0.000000 | -0.000001 | -0.000007 | 0.000454 | 0.018018 | 0.086371 | -0.269603 | -0.396180 | -0.492860 | -0.889959 | 1.000000 | 0.000000 | 0.000000 |
14.900550 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
9.461665 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)