MOLPRO Basis Query, element=Pm, basis=cc-pVQZ-DK3, l=p
Basis Pm p cc-pVQZ-DK3
Primitives | Contractions... |
43387390.000000 | 0.000004 | -0.000003 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000001 | -0.000001 | 0.000000 |
10205300.000000 | 0.000007 | -0.000006 | 0.000002 | -0.000001 | 0.000000 | 0.000000 | -0.000001 | -0.000001 | -0.000001 | 0.000000 |
2800636.000000 | 0.000019 | -0.000016 | 0.000004 | -0.000002 | 0.000000 | 0.000001 | -0.000002 | -0.000003 | -0.000004 | 0.000000 |
857293.900000 | 0.000044 | -0.000036 | 0.000010 | -0.000005 | 0.000001 | 0.000003 | -0.000005 | -0.000008 | -0.000008 | 0.000000 |
285648.500000 | 0.000107 | -0.000089 | 0.000024 | -0.000012 | 0.000003 | 0.000008 | -0.000013 | -0.000019 | -0.000021 | 0.000000 |
102187.400000 | 0.000261 | -0.000216 | 0.000059 | -0.000029 | 0.000006 | 0.000019 | -0.000032 | -0.000046 | -0.000050 | 0.000000 |
38978.510000 | 0.000657 | -0.000545 | 0.000150 | -0.000072 | 0.000016 | 0.000047 | -0.000081 | -0.000120 | -0.000131 | 0.000000 |
15812.660000 | 0.001693 | -0.001409 | 0.000389 | -0.000188 | 0.000042 | 0.000121 | -0.000208 | -0.000301 | -0.000324 | 0.000000 |
6811.793000 | 0.004451 | -0.003719 | 0.001030 | -0.000497 | 0.000112 | 0.000320 | -0.000554 | -0.000831 | -0.000907 | 0.000000 |
3104.403000 | 0.011689 | -0.009837 | 0.002740 | -0.001321 | 0.000298 | 0.000852 | -0.001464 | -0.002106 | -0.002257 | 0.000000 |
1487.292000 | 0.029777 | -0.025355 | 0.007123 | -0.003434 | 0.000775 | 0.002214 | -0.003831 | -0.005792 | -0.006348 | 0.000000 |
743.781400 | 0.070068 | -0.060942 | 0.017380 | -0.008371 | 0.001889 | 0.005406 | -0.009279 | -0.013277 | -0.014204 | 0.000000 |
385.511700 | 0.142797 | -0.128155 | 0.037345 | -0.017984 | 0.004060 | 0.011607 | -0.020136 | -0.030825 | -0.034027 | 0.000000 |
205.528800 | 0.232463 | -0.217839 | 0.065419 | -0.031465 | 0.007105 | 0.020347 | -0.034841 | -0.048930 | -0.051969 | 0.000000 |
112.144400 | 0.269162 | -0.255557 | 0.077368 | -0.037241 | 0.008412 | 0.024048 | -0.042171 | -0.068423 | -0.077304 | 0.000000 |
62.023380 | 0.199917 | -0.101493 | 0.009621 | -0.004569 | 0.000983 | 0.002860 | -0.003174 | 0.010743 | 0.022025 | 0.000000 |
34.544390 | 0.123905 | 0.238171 | -0.161882 | 0.078189 | -0.017877 | -0.052008 | 0.089078 | 0.109855 | 0.106687 | 0.000000 |
19.654210 | 0.115016 | 0.472187 | -0.333439 | 0.165341 | -0.038114 | -0.110283 | 0.203065 | 0.391876 | 0.519572 | 0.000000 |
11.334510 | 0.073768 | 0.317386 | -0.184842 | 0.083528 | -0.018838 | -0.057060 | 0.090436 | -0.000522 | -0.135636 | 0.000000 |
6.532719 | 0.018225 | 0.070905 | 0.269065 | -0.162064 | 0.039629 | 0.133166 | -0.274864 | -0.422275 | -0.591189 | 0.000000 |
3.683875 | 0.000138 | -0.014959 | 0.532135 | -0.341295 | 0.085847 | 0.243912 | -0.477988 | -1.249600 | -2.049730 | 0.000000 |
2.081286 | -0.000934 | -0.013133 | 0.322742 | -0.227517 | 0.056840 | 0.212034 | -0.293223 | 1.223450 | 5.311740 | 0.000000 |
1.167742 | -0.000204 | -0.003254 | 0.083566 | 0.152968 | -0.055965 | -0.387667 | 1.235570 | 1.940950 | -3.428180 | 0.000000 |
0.637678 | -0.000077 | -0.000871 | 0.033363 | 0.447394 | -0.147582 | -0.493827 | 0.543500 | -2.552330 | -1.913370 | 0.000000 |
0.349365 | -0.000026 | -0.000564 | 0.025692 | 0.417170 | -0.171489 | -0.055376 | -1.022450 | -0.454827 | 4.352200 | 0.000000 |
0.188078 | -0.000020 | -0.000231 | 0.010529 | 0.173222 | -0.068139 | 0.283791 | -0.745001 | 1.687320 | -2.018360 | 0.000000 |
0.091799 | 0.000001 | -0.000026 | 0.001373 | 0.023984 | 0.236703 | 0.545845 | 0.541803 | 0.026135 | -0.975821 | 0.000000 |
0.046358 | -0.000002 | -0.000003 | 0.000091 | 0.001332 | 0.499858 | 0.274595 | 0.494090 | -0.727499 | 1.083470 | 0.000000 |
0.023739 | 0.000001 | 0.000000 | 0.000026 | 0.000634 | 0.354239 | 0.030156 | 0.036214 | -0.017361 | 0.027978 | 0.000000 |
0.012156 | -0.000000 | -0.000000 | -0.000002 | -0.000081 | 0.064158 | 0.001012 | 0.006044 | -0.018465 | 0.031857 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)