MOLPRO Basis Query, element=Ce, basis=cc-pVQZ-DK3, l=p
Basis Ce p cc-pVQZ-DK3
Primitives | Contractions... |
40345190.000000 | 0.000003 | -0.000002 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000000 | -0.000001 | 0.000000 |
9143319.000000 | 0.000006 | -0.000005 | 0.000001 | -0.000001 | 0.000000 | 0.000000 | -0.000001 | -0.000001 | -0.000001 | 0.000000 |
2451579.000000 | 0.000017 | -0.000014 | 0.000004 | -0.000002 | 0.000000 | 0.000001 | -0.000002 | -0.000003 | -0.000003 | 0.000000 |
738230.700000 | 0.000041 | -0.000033 | 0.000009 | -0.000004 | 0.000001 | 0.000003 | -0.000005 | -0.000006 | -0.000007 | 0.000000 |
243089.300000 | 0.000101 | -0.000082 | 0.000022 | -0.000011 | 0.000003 | 0.000006 | -0.000011 | -0.000016 | -0.000019 | 0.000000 |
86258.610000 | 0.000252 | -0.000205 | 0.000055 | -0.000028 | 0.000006 | 0.000016 | -0.000029 | -0.000040 | -0.000044 | 0.000000 |
32767.790000 | 0.000648 | -0.000528 | 0.000143 | -0.000072 | 0.000016 | 0.000041 | -0.000074 | -0.000106 | -0.000124 | 0.000000 |
13293.380000 | 0.001704 | -0.001394 | 0.000378 | -0.000190 | 0.000043 | 0.000109 | -0.000194 | -0.000266 | -0.000293 | 0.000000 |
5744.898000 | 0.004559 | -0.003744 | 0.001018 | -0.000511 | 0.000117 | 0.000294 | -0.000526 | -0.000763 | -0.000911 | 0.000000 |
2630.640000 | 0.012132 | -0.010037 | 0.002744 | -0.001377 | 0.000315 | 0.000794 | -0.001411 | -0.001912 | -0.002068 | 0.000000 |
1266.462000 | 0.031131 | -0.026066 | 0.007188 | -0.003607 | 0.000826 | 0.002076 | -0.003716 | -0.005446 | -0.006591 | 0.000000 |
636.139600 | 0.073213 | -0.062648 | 0.017543 | -0.008793 | 0.002015 | 0.005072 | -0.009015 | -0.012106 | -0.012895 | 0.000000 |
331.016600 | 0.147914 | -0.130654 | 0.037396 | -0.018741 | 0.004296 | 0.010791 | -0.019368 | -0.028910 | -0.035803 | 0.000000 |
177.108400 | 0.237017 | -0.218705 | 0.064518 | -0.032288 | 0.007403 | 0.018649 | -0.033060 | -0.042881 | -0.042980 | 0.000000 |
96.960030 | 0.268327 | -0.249900 | 0.074127 | -0.037130 | 0.008519 | 0.021367 | -0.038757 | -0.063480 | -0.087229 | 0.000000 |
53.765940 | 0.194636 | -0.089632 | 0.005108 | -0.002535 | 0.000523 | 0.001454 | -0.001047 | 0.019922 | 0.059291 | 0.000000 |
30.004710 | 0.119815 | 0.243733 | -0.159525 | 0.079929 | -0.018548 | -0.047486 | 0.084255 | 0.084545 | 0.032280 | 0.000000 |
17.096500 | 0.111881 | 0.467075 | -0.322233 | 0.165933 | -0.038916 | -0.098074 | 0.184747 | 0.366785 | 0.614622 | 0.000000 |
9.884986 | 0.071812 | 0.313563 | -0.183803 | 0.086750 | -0.019811 | -0.053979 | 0.092982 | -0.047571 | -0.445353 | 0.000000 |
5.731205 | 0.018314 | 0.072691 | 0.247952 | -0.154439 | 0.038329 | 0.114063 | -0.245527 | -0.215311 | 0.251002 | 0.000000 |
3.255959 | 0.000430 | -0.013545 | 0.519265 | -0.343373 | 0.088192 | 0.210251 | -0.396228 | -1.181710 | -3.093690 | 0.000000 |
1.853273 | -0.000890 | -0.013703 | 0.336940 | -0.251974 | 0.065388 | 0.228270 | -0.472209 | 0.524037 | 5.325980 | 0.000000 |
1.033390 | -0.000210 | -0.003565 | 0.093281 | 0.142491 | -0.054627 | -0.325060 | 1.231270 | 2.690620 | -2.038520 | 0.000000 |
0.563825 | -0.000082 | -0.001010 | 0.037926 | 0.461230 | -0.160083 | -0.496505 | 0.717308 | -2.666690 | -3.586020 | 0.000000 |
0.308578 | -0.000030 | -0.000655 | 0.030048 | 0.420952 | -0.184371 | -0.094842 | -1.070850 | -0.756783 | 5.319640 | 0.000000 |
0.167018 | -0.000020 | -0.000256 | 0.011225 | 0.164992 | -0.067447 | 0.241709 | -0.821337 | 1.852160 | -2.217210 | 0.000000 |
0.084363 | 0.000001 | -0.000027 | 0.001604 | 0.022708 | 0.250460 | 0.567251 | 0.522137 | 0.106187 | -1.021870 | 0.000000 |
0.043078 | -0.000002 | -0.000005 | 0.000086 | 0.002045 | 0.511146 | 0.305544 | 0.518772 | -0.783641 | 1.019110 | 0.000000 |
0.022198 | 0.000001 | 0.000001 | 0.000047 | 0.000427 | 0.344030 | 0.033983 | 0.044714 | -0.044765 | 0.114780 | 0.000000 |
0.011328 | -0.000000 | -0.000000 | -0.000007 | -0.000025 | 0.053934 | 0.001132 | 0.005274 | -0.015463 | 0.014740 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)