MOLPRO Basis Query, element=Am, basis=cc-pVQZ-DK3, l=s
Basis Am s cc-pVQZ-DK3
Primitives | Contractions... |
56303346.000000 | 0.002456 | -0.000877 | -0.000992 | -0.000146 | 0.000141 | -0.000063 | 0.000027 | 0.000053 | 0.000069 | -0.000089 | 0.000092 | 0.000000 |
14988829.000000 | 0.002095 | -0.000748 | -0.000845 | -0.000124 | 0.000120 | -0.000053 | 0.000023 | 0.000045 | 0.000058 | -0.000076 | 0.000079 | 0.000000 |
5125970.300000 | 0.006068 | -0.002170 | -0.002455 | -0.000361 | 0.000348 | -0.000155 | 0.000066 | 0.000130 | 0.000170 | -0.000219 | 0.000229 | 0.000000 |
1947967.100000 | 0.007325 | -0.002624 | -0.002971 | -0.000437 | 0.000422 | -0.000188 | 0.000080 | 0.000158 | 0.000205 | -0.000266 | 0.000277 | 0.000000 |
812671.980000 | 0.014448 | -0.005196 | -0.005889 | -0.000867 | 0.000837 | -0.000372 | 0.000158 | 0.000313 | 0.000407 | -0.000527 | 0.000549 | 0.000000 |
359925.900000 | 0.019158 | -0.006935 | -0.007874 | -0.001162 | 0.001121 | -0.000498 | 0.000212 | 0.000419 | 0.000546 | -0.000707 | 0.000736 | 0.000000 |
168644.310000 | 0.032471 | -0.011854 | -0.013490 | -0.001998 | 0.001924 | -0.000856 | 0.000364 | 0.000720 | 0.000936 | -0.001210 | 0.001264 | 0.000000 |
82671.372000 | 0.043300 | -0.016032 | -0.018317 | -0.002726 | 0.002621 | -0.001165 | 0.000496 | 0.000980 | 0.001277 | -0.001657 | 0.001720 | 0.000000 |
42400.980000 | 0.067302 | -0.025327 | -0.029069 | -0.004353 | 0.004175 | -0.001857 | 0.000790 | 0.001562 | 0.002029 | -0.002612 | 0.002745 | 0.000000 |
22690.864000 | 0.084637 | -0.032733 | -0.037853 | -0.005721 | 0.005469 | -0.002432 | 0.001035 | 0.002047 | 0.002673 | -0.003500 | 0.003587 | 0.000000 |
12732.012000 | 0.119825 | -0.047646 | -0.055545 | -0.008488 | 0.008084 | -0.003594 | 0.001529 | 0.003022 | 0.003904 | -0.004939 | 0.005329 | 0.000000 |
7500.188000 | 0.129413 | -0.054040 | -0.063831 | -0.009908 | 0.009381 | -0.004173 | 0.001775 | 0.003516 | 0.004652 | -0.006334 | 0.006127 | 0.000000 |
4603.107800 | 0.168486 | -0.072978 | -0.087218 | -0.013766 | 0.012964 | -0.005761 | 0.002451 | 0.004836 | 0.006112 | -0.007176 | 0.008619 | 0.000000 |
2904.475300 | 0.151690 | -0.070494 | -0.085734 | -0.013783 | 0.012888 | -0.005737 | 0.002441 | 0.004852 | 0.006683 | -0.010150 | 0.008317 | 0.000000 |
1853.075500 | 0.172983 | -0.080463 | -0.098105 | -0.015892 | 0.014839 | -0.006587 | 0.002801 | 0.005502 | 0.006538 | -0.005932 | 0.010015 | 0.000000 |
1160.810500 | 0.115599 | -0.042708 | -0.045345 | -0.005753 | 0.005858 | -0.002621 | 0.001116 | 0.002264 | 0.003897 | -0.008934 | 0.003447 | 0.000000 |
713.400550 | 0.077710 | 0.028064 | 0.075296 | 0.021558 | -0.017138 | 0.007658 | -0.003264 | -0.006575 | -0.010093 | 0.019263 | -0.011294 | 0.000000 |
437.532760 | 0.020231 | 0.146603 | 0.326882 | 0.090080 | -0.072588 | 0.032315 | -0.013759 | -0.027148 | -0.033086 | 0.033529 | -0.049628 | 0.000000 |
267.528010 | 0.028347 | 0.188278 | 0.545543 | 0.173480 | -0.135901 | 0.060769 | -0.025899 | -0.051751 | -0.071665 | 0.109618 | -0.093294 | 0.000000 |
162.794630 | 0.009577 | 0.133847 | 0.481804 | 0.172434 | -0.133695 | 0.059863 | -0.025520 | -0.050295 | -0.059274 | 0.051145 | -0.090987 | 0.000000 |
99.225427 | 0.011052 | 0.130706 | -0.052754 | -0.089591 | 0.061805 | -0.028017 | 0.011979 | 0.023110 | 0.019104 | 0.021129 | 0.040147 | 0.000000 |
61.274210 | -0.001828 | 0.268013 | -0.627842 | -0.609170 | 0.466846 | -0.218022 | 0.093642 | 0.191504 | 0.277440 | -0.466972 | 0.429341 | 0.000000 |
37.437349 | 0.004931 | 0.218429 | -0.565513 | -0.640676 | 0.491629 | -0.229198 | 0.098413 | 0.198640 | 0.234170 | -0.174414 | 0.347631 | 0.000000 |
22.773036 | -0.002310 | 0.063332 | -0.124345 | 0.080130 | -0.070594 | 0.029117 | -0.012143 | -0.033991 | -0.015790 | -0.162973 | -0.251121 | 0.000000 |
14.285777 | 0.003035 | -0.001893 | 0.088021 | 0.737385 | -0.876680 | 0.492062 | -0.217855 | -0.459887 | -0.731217 | 1.536230 | -1.261750 | 0.000000 |
8.984844 | -0.001439 | -0.002777 | 0.075689 | 0.527701 | -0.894460 | 0.527833 | -0.234795 | -0.505165 | -0.570790 | -0.052034 | -0.345221 | 0.000000 |
5.566373 | 0.001322 | -0.001686 | 0.016530 | 0.140144 | 0.155068 | -0.159023 | 0.074377 | 0.204111 | 0.233301 | 0.697445 | -0.150034 | 0.000000 |
3.327173 | -0.000803 | 0.000645 | 0.002123 | 0.042368 | 0.871534 | -0.810656 | 0.388774 | 0.994699 | 1.966060 | -6.454420 | 10.544600 | 0.000000 |
2.007090 | 0.000584 | -0.000158 | -0.000712 | 0.019824 | 0.478515 | -0.608054 | 0.310063 | 1.020810 | 1.127640 | 4.810000 | -19.274900 | 0.000000 |
1.238595 | -0.000380 | 0.000228 | 0.000527 | 0.003602 | 0.096343 | 0.096189 | -0.069236 | -1.317640 | -3.941960 | 5.919860 | 9.912590 | 0.000000 |
0.733773 | 0.000218 | -0.000105 | -0.000304 | 0.000671 | 0.031069 | 0.560023 | -0.338555 | -1.308590 | -0.802226 | -8.300640 | 7.781170 | 0.000000 |
0.434816 | -0.000116 | 0.000061 | 0.000182 | 0.000303 | 0.021092 | 0.522570 | -0.410142 | -0.003374 | 2.985960 | -0.456652 | -12.024900 | 0.000000 |
0.247648 | 0.000051 | -0.000024 | -0.000071 | 0.000126 | 0.007559 | 0.164473 | -0.252127 | 0.995132 | 1.006260 | 4.583900 | 3.092240 | 0.000000 |
0.122773 | -0.000021 | 0.000010 | 0.000032 | 0.000004 | 0.000700 | 0.032351 | 0.112519 | 0.949764 | -1.924200 | -0.543049 | 4.570510 | 0.000000 |
0.064724 | 0.000010 | -0.000005 | -0.000015 | -0.000000 | 0.001163 | 0.081389 | 0.513626 | -0.088607 | -0.753791 | -2.170420 | -3.969760 | 0.000000 |
0.032671 | -0.000004 | 0.000002 | 0.000006 | -0.000002 | 0.001100 | 0.080324 | 0.504802 | -0.647893 | 0.793140 | 0.573049 | -0.314523 | 0.000000 |
0.016370 | 0.000001 | -0.000000 | -0.000001 | -0.000000 | 0.000232 | 0.016551 | 0.105037 | -0.258584 | 0.456650 | 0.660144 | 1.282310 | 1.000000 |
Comment: R. Feng and K.A. Peterson, J. Chem. Phys. 147, 084108 (2017)