MOLPRO Basis Query, element=Dy, basis=cc-pwCVTZ-DK3, l=s
Basis Dy s cc-pwCVTZ-DK3
Primitives | Contractions... |
67554410.000000 | 0.000366 | -0.000185 | 0.000108 | -0.000026 | 0.000013 | -0.000007 | -0.000013 | 0.000017 | 0.000022 | 0.000000 | 0.000000 | 0.000000 |
17885360.000000 | 0.000368 | -0.000186 | 0.000109 | -0.000026 | 0.000013 | -0.000007 | -0.000013 | 0.000017 | 0.000022 | 0.000000 | 0.000000 | 0.000000 |
6059470.000000 | 0.001045 | -0.000528 | 0.000309 | -0.000074 | 0.000038 | -0.000019 | -0.000036 | 0.000049 | 0.000062 | 0.000000 | 0.000000 | 0.000000 |
2267005.000000 | 0.001542 | -0.000780 | 0.000457 | -0.000110 | 0.000056 | -0.000027 | -0.000053 | 0.000073 | 0.000093 | 0.000000 | 0.000000 | 0.000000 |
916206.700000 | 0.003088 | -0.001565 | 0.000918 | -0.000220 | 0.000113 | -0.000055 | -0.000106 | 0.000147 | 0.000184 | 0.000000 | 0.000000 | 0.000000 |
387775.300000 | 0.005102 | -0.002594 | 0.001525 | -0.000366 | 0.000188 | -0.000092 | -0.000177 | 0.000245 | 0.000312 | 0.000000 | 0.000000 | 0.000000 |
170664.000000 | 0.009246 | -0.004722 | 0.002784 | -0.000669 | 0.000344 | -0.000168 | -0.000321 | 0.000445 | 0.000554 | 0.000000 | 0.000000 | 0.000000 |
77485.300000 | 0.015787 | -0.008117 | 0.004806 | -0.001157 | 0.000595 | -0.000290 | -0.000560 | 0.000775 | 0.000998 | 0.000000 | 0.000000 | 0.000000 |
36195.480000 | 0.027822 | -0.014455 | 0.008613 | -0.002078 | 0.001067 | -0.000520 | -0.000994 | 0.001376 | 0.001687 | 0.000000 | 0.000000 | 0.000000 |
17344.000000 | 0.047990 | -0.025339 | 0.015243 | -0.003692 | 0.001897 | -0.000926 | -0.001793 | 0.002484 | 0.003265 | 0.000000 | 0.000000 | 0.000000 |
8509.086000 | 0.082685 | -0.044805 | 0.027371 | -0.006662 | 0.003418 | -0.001665 | -0.003166 | 0.004382 | 0.005220 | 0.000000 | 0.000000 | 0.000000 |
4266.493000 | 0.135862 | -0.076801 | 0.048052 | -0.011813 | 0.006065 | -0.002962 | -0.005779 | 0.008008 | 0.010887 | 0.000000 | 0.000000 | 0.000000 |
2182.759000 | 0.203349 | -0.123638 | 0.080505 | -0.020058 | 0.010268 | -0.004997 | -0.009413 | 0.013038 | 0.014676 | 0.000000 | 0.000000 | 0.000000 |
1137.525000 | 0.247217 | -0.169480 | 0.117192 | -0.029971 | 0.015361 | -0.007516 | -0.014921 | 0.020699 | 0.030366 | 0.000000 | 0.000000 | 0.000000 |
602.595500 | 0.206155 | -0.163708 | 0.121595 | -0.031916 | 0.016238 | -0.007865 | -0.014146 | 0.019614 | 0.015602 | 0.000000 | 0.000000 | 0.000000 |
323.591700 | 0.098375 | -0.028102 | 0.004504 | 0.000346 | 0.000011 | -0.000125 | -0.002323 | 0.003172 | 0.023746 | 0.000000 | 0.000000 | 0.000000 |
173.991900 | 0.057198 | 0.231396 | -0.316228 | 0.107822 | -0.054738 | 0.027016 | 0.056934 | -0.079691 | -0.144914 | 0.000000 | 0.000000 | 0.000000 |
95.611460 | 0.065496 | 0.345515 | -0.630081 | 0.244793 | -0.122653 | 0.059482 | 0.107316 | -0.151330 | -0.108920 | 0.000000 | 0.000000 | 0.000000 |
52.843950 | 0.036940 | 0.193342 | -0.394199 | 0.173715 | -0.089859 | 0.045225 | 0.106031 | -0.149911 | -0.366160 | 0.000000 | 0.000000 | 0.000000 |
28.301130 | 0.022948 | 0.164194 | 0.447833 | -0.356055 | 0.188135 | -0.095586 | -0.226327 | 0.324856 | 0.775148 | 0.000000 | 0.000000 | 0.000000 |
16.147580 | 0.024009 | 0.187778 | 0.734640 | -0.817395 | 0.441685 | -0.217784 | -0.420148 | 0.691160 | 0.545720 | 0.000000 | 0.000000 | 0.000000 |
9.006453 | 0.008131 | 0.063055 | 0.237091 | -0.114117 | 0.052683 | -0.031145 | -0.106823 | 0.023122 | 0.560204 | 0.000000 | 0.000000 | 0.000000 |
4.774530 | -0.000030 | -0.001284 | -0.033943 | 0.815351 | -0.592641 | 0.323440 | 1.047220 | -2.021480 | -5.542230 | 0.000000 | 0.000000 | 0.000000 |
2.525598 | -0.000276 | -0.002945 | -0.032021 | 0.532819 | -0.598920 | 0.329942 | 0.440072 | 0.241123 | 6.632450 | 0.000000 | 0.000000 | 0.000000 |
1.141681 | -0.000052 | -0.000474 | -0.003906 | 0.073471 | 0.255452 | -0.153218 | -1.467220 | 3.825400 | -1.449120 | 0.000000 | 0.000000 | 0.000000 |
0.587704 | -0.000002 | -0.000063 | -0.001148 | 0.046548 | 0.682277 | -0.541421 | -0.780058 | -3.434640 | -3.955020 | 0.000000 | 0.000000 | 0.000000 |
0.282457 | -0.000008 | -0.000077 | -0.000649 | 0.020750 | 0.244555 | -0.326941 | 1.463980 | -0.083175 | 4.352580 | 0.000000 | 0.000000 | 0.000000 |
0.070639 | 0.000000 | -0.000000 | -0.000061 | 0.003958 | 0.136558 | 0.504293 | 0.970226 | 2.388840 | -2.732150 | 0.000000 | 0.000000 | 0.000000 |
0.035769 | -0.000001 | -0.000013 | -0.000083 | 0.003673 | 0.122873 | 0.500829 | -1.092370 | -1.570300 | 1.118200 | 0.000000 | 0.000000 | 0.000000 |
0.017565 | 0.000000 | -0.000000 | -0.000018 | 0.001148 | 0.041249 | 0.160487 | -0.192398 | -0.248079 | 0.386888 | 1.000000 | 0.000000 | 0.000000 |
11.982810 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
7.570910 | 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)
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