MOLPRO Basis Query, element=Sc, basis=V5Z-DK, l=p
Basis Sc p V5Z-DK
Primitives | Contractions... |
55070.500000 | 0.000014 | -0.000005 | -0.000001 | 0.000001 | 0.000003 | -0.000003 | -0.000005 | 0.000000 |
13741.700000 | 0.000048 | -0.000016 | -0.000004 | 0.000005 | 0.000009 | -0.000012 | -0.000016 | 0.000000 |
4365.400000 | 0.000202 | -0.000066 | -0.000016 | 0.000020 | 0.000041 | -0.000041 | -0.000070 | 0.000000 |
1642.260000 | 0.000755 | -0.000248 | -0.000060 | 0.000074 | 0.000142 | -0.000208 | -0.000261 | 0.000000 |
694.066000 | 0.002678 | -0.000882 | -0.000216 | 0.000262 | 0.000546 | -0.000520 | -0.000929 | 0.000000 |
317.742000 | 0.008556 | -0.002830 | -0.000688 | 0.000843 | 0.001614 | -0.002411 | -0.002987 | 0.000000 |
153.899000 | 0.024514 | -0.008189 | -0.002005 | 0.002431 | 0.005086 | -0.004712 | -0.008689 | 0.000000 |
77.766500 | 0.061700 | -0.020972 | -0.005107 | 0.006255 | 0.011899 | -0.018175 | -0.022524 | 0.000000 |
40.673600 | 0.130976 | -0.045760 | -0.011256 | 0.013616 | 0.028789 | -0.024379 | -0.049467 | 0.000000 |
21.906100 | 0.221699 | -0.079789 | -0.019487 | 0.023933 | 0.044138 | -0.076664 | -0.086016 | 0.000000 |
12.079500 | 0.292982 | -0.110403 | -0.027552 | 0.033050 | 0.076102 | -0.043637 | -0.116208 | 0.000000 |
6.753490 | 0.275582 | -0.107329 | -0.026199 | 0.032827 | 0.056057 | -0.192525 | -0.176144 | 0.000000 |
3.763210 | 0.146794 | 0.000533 | 0.001828 | -0.002562 | 0.024325 | 0.132639 | 0.010278 | 0.000000 |
2.049730 | 0.031673 | 0.218595 | 0.065040 | -0.074805 | -0.217115 | 0.113550 | 1.261926 | 0.000000 |
1.086450 | 0.000123 | 0.392363 | 0.115372 | -0.137645 | -0.370335 | 1.366904 | 0.259985 | 0.000000 |
0.564087 | -0.001608 | 0.362930 | 0.137521 | -0.170428 | -0.443520 | -1.561725 | -3.773952 | 0.000000 |
0.281020 | -0.000820 | 0.149023 | -0.007752 | -0.047864 | 1.237938 | -0.893610 | 4.504364 | 0.000000 |
0.121432 | -0.000064 | 0.015090 | -0.361751 | 0.583521 | 0.412996 | 2.291079 | -2.629708 | 0.000000 |
0.053345 | -0.000011 | 0.000572 | -0.541982 | 0.515168 | -0.940008 | -1.233846 | 0.524723 | 0.000000 |
0.023143 | 0.000001 | 0.000150 | -0.215775 | 0.032119 | -0.074409 | -0.154042 | 0.445716 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)