MOLPRO Basis Query, element=Cu, basis=cc-pVQZ-DK, l=s
Basis Cu s cc-pVQZ-DK
Primitives | Contractions... |
16665490.000000 | 0.000069 | -0.000039 | 0.000009 | -0.000002 | -0.000003 | -0.000007 | -0.000007 | 0.000000 |
2495213.000000 | 0.000192 | -0.000108 | 0.000024 | -0.000005 | -0.000009 | -0.000019 | -0.000020 | 0.000000 |
567850.700000 | 0.000502 | -0.000283 | 0.000064 | -0.000013 | -0.000024 | -0.000049 | -0.000052 | 0.000000 |
160853.100000 | 0.001200 | -0.000676 | 0.000153 | -0.000031 | -0.000059 | -0.000117 | -0.000121 | 0.000000 |
52481.860000 | 0.002812 | -0.001588 | 0.000359 | -0.000073 | -0.000137 | -0.000272 | -0.000300 | 0.000000 |
18948.850000 | 0.006576 | -0.003730 | 0.000847 | -0.000173 | -0.000332 | -0.000658 | -0.000641 | 0.000000 |
7391.655000 | 0.015563 | -0.008880 | 0.002024 | -0.000413 | -0.000758 | -0.001515 | -0.001783 | 0.000000 |
3066.517000 | 0.036660 | -0.021223 | 0.004900 | -0.001002 | -0.001956 | -0.003859 | -0.003463 | 0.000000 |
1337.994000 | 0.082401 | -0.048899 | 0.011473 | -0.002344 | -0.004214 | -0.008469 | -0.010778 | 0.000000 |
608.783000 | 0.164332 | -0.103322 | 0.025341 | -0.005192 | -0.010372 | -0.020392 | -0.016322 | 0.000000 |
286.898000 | 0.262145 | -0.184178 | 0.048325 | -0.009891 | -0.017144 | -0.034896 | -0.050821 | 0.000000 |
139.153000 | 0.276466 | -0.246279 | 0.073892 | -0.015245 | -0.032526 | -0.063408 | -0.034451 | 0.000000 |
68.494550 | 0.147890 | -0.155758 | 0.050915 | -0.010449 | -0.012017 | -0.028078 | -0.101172 | 0.000000 |
31.601080 | 0.071599 | 0.208389 | -0.108314 | 0.022566 | 0.023963 | 0.057058 | 0.224667 | 0.000000 |
15.991580 | 0.114422 | 0.550074 | -0.391449 | 0.086448 | 0.211961 | 0.430275 | 0.169943 | 0.000000 |
8.056510 | 0.074733 | 0.349980 | -0.336991 | 0.075331 | 0.084280 | 0.297302 | 1.113261 | 0.000000 |
3.690329 | 0.008901 | 0.043809 | 0.322344 | -0.084213 | -0.089472 | -0.772365 | -3.563214 | 0.000000 |
1.762902 | -0.000324 | -0.003669 | 0.682957 | -0.215165 | -0.809196 | -1.579862 | 2.767509 | 0.000000 |
0.801269 | -0.000058 | -0.000507 | 0.297028 | -0.186623 | 0.324217 | 2.535085 | 0.218880 | 0.000000 |
0.184243 | -0.000013 | -0.000186 | 0.011974 | 0.289928 | 1.447289 | -0.551653 | -3.266031 | 0.000000 |
0.081793 | 0.000007 | 0.000115 | -0.002692 | 0.572278 | -0.443132 | -1.312257 | 4.560972 | 0.000000 |
0.035303 | -0.000003 | -0.000039 | 0.001911 | 0.287101 | -0.881848 | 1.281861 | -2.247963 | 1.000000 |
Comment: N.B. Balabanov and K.A. Peterson, J. Chem. Phys. 123, 064107 (2005)