MOLPRO Basis Query, element=Yb, basis=cc-pwCVDZ-DK3, l=s
Basis Yb s cc-pwCVDZ-DK3
Primitives | Contractions... |
58714880.000000 | 0.000503 | -0.000274 | 0.000156 | -0.000036 | 0.000019 | -0.000008 | 0.000018 | 0.000000 | 0.000000 |
13960190.000000 | 0.000687 | -0.000374 | 0.000213 | -0.000050 | 0.000026 | -0.000011 | 0.000024 | 0.000000 | 0.000000 |
4102913.000000 | 0.001801 | -0.000982 | 0.000559 | -0.000130 | 0.000068 | -0.000028 | 0.000064 | 0.000000 | 0.000000 |
1318311.000000 | 0.003388 | -0.001851 | 0.001056 | -0.000246 | 0.000129 | -0.000054 | 0.000121 | 0.000000 | 0.000000 |
456614.400000 | 0.006955 | -0.003812 | 0.002179 | -0.000508 | 0.000266 | -0.000111 | 0.000249 | 0.000000 | 0.000000 |
167687.200000 | 0.013291 | -0.007329 | 0.004209 | -0.000983 | 0.000514 | -0.000214 | 0.000485 | 0.000000 | 0.000000 |
64885.030000 | 0.025696 | -0.014296 | 0.008254 | -0.001934 | 0.001011 | -0.000421 | 0.000940 | 0.000000 | 0.000000 |
26287.330000 | 0.048623 | -0.027499 | 0.016066 | -0.003772 | 0.001973 | -0.000822 | 0.001878 | 0.000000 | 0.000000 |
11099.690000 | 0.091017 | -0.052806 | 0.031325 | -0.007419 | 0.003872 | -0.001613 | 0.003557 | 0.000000 | 0.000000 |
4863.776000 | 0.160961 | -0.098042 | 0.060093 | -0.014335 | 0.007495 | -0.003122 | 0.007259 | 0.000000 | 0.000000 |
2203.495000 | 0.248364 | -0.164488 | 0.105629 | -0.025833 | 0.013421 | -0.005594 | 0.012004 | 0.000000 | 0.000000 |
1028.723000 | 0.276789 | -0.213789 | 0.149953 | -0.037477 | 0.019573 | -0.008149 | 0.019976 | 0.000000 | 0.000000 |
491.933400 | 0.171748 | -0.125129 | 0.084493 | -0.021872 | 0.011112 | -0.004652 | 0.006717 | 0.000000 | 0.000000 |
226.679800 | 0.079435 | 0.201591 | -0.279025 | 0.093811 | -0.047176 | 0.019761 | -0.035067 | 0.000000 | 0.000000 |
113.390200 | 0.083446 | 0.390523 | -0.730396 | 0.274869 | -0.141061 | 0.058824 | -0.158892 | 0.000000 | 0.000000 |
57.882340 | 0.045917 | 0.204443 | -0.355006 | 0.160034 | -0.078955 | 0.033528 | -0.028981 | 0.000000 | 0.000000 |
28.070530 | 0.034192 | 0.222938 | 0.751520 | -0.679874 | 0.351435 | -0.150231 | 0.265040 | 0.000000 | 0.000000 |
14.597450 | 0.024840 | 0.162470 | 0.638784 | -0.683755 | 0.384022 | -0.163332 | 0.584169 | 0.000000 | 0.000000 |
6.414460 | 0.001642 | 0.010630 | 0.005812 | 0.768417 | -0.568195 | 0.252675 | -1.203080 | 1.000000 | 0.000000 |
3.091525 | -0.000852 | -0.007106 | -0.055796 | 0.699676 | -0.652363 | 0.314367 | -0.101490 | 0.000000 | 0.000000 |
0.898860 | -0.000022 | -0.000115 | -0.003154 | 0.077402 | 0.731431 | -0.442192 | 2.171820 | 0.000000 | 0.000000 |
0.387070 | -0.000021 | -0.000207 | -0.001034 | 0.019540 | 0.482235 | -0.429517 | -1.703210 | 0.000000 | 0.000000 |
0.060295 | 0.000001 | 0.000014 | -0.000094 | 0.004892 | 0.161014 | 0.798949 | -0.789879 | 0.000000 | 0.000000 |
0.024674 | -0.000001 | -0.000015 | -0.000033 | 0.000221 | 0.058076 | 0.339989 | 1.136250 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)
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