MOLPRO Basis Query, element=La, basis=cc-pwCVQZ-X2C, l=p
Basis La p cc-pwCVQZ-X2C
Primitives | Contractions... |
39914070.000000 | 0.000002 | -0.000002 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 |
8993620.000000 | 0.000004 | -0.000003 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
2402647.000000 | 0.000012 | -0.000010 | 0.000003 | -0.000001 | 0.000000 | 0.000001 | -0.000001 | -0.000002 | -0.000002 | 0.000000 | 0.000000 | 0.000000 |
721679.400000 | 0.000031 | -0.000025 | 0.000007 | -0.000003 | 0.000001 | 0.000002 | -0.000003 | -0.000005 | -0.000005 | 0.000000 | 0.000000 | 0.000000 |
237257.600000 | 0.000082 | -0.000066 | 0.000017 | -0.000009 | 0.000003 | 0.000006 | -0.000009 | -0.000013 | -0.000016 | 0.000000 | 0.000000 | 0.000000 |
84108.070000 | 0.000215 | -0.000174 | 0.000046 | -0.000024 | 0.000007 | 0.000015 | -0.000023 | -0.000033 | -0.000036 | 0.000000 | 0.000000 | 0.000000 |
31936.670000 | 0.000579 | -0.000468 | 0.000123 | -0.000065 | 0.000017 | 0.000041 | -0.000063 | -0.000093 | -0.000116 | 0.000000 | 0.000000 | 0.000000 |
12957.230000 | 0.001580 | -0.001281 | 0.000338 | -0.000177 | 0.000046 | 0.000114 | -0.000173 | -0.000237 | -0.000249 | 0.000000 | 0.000000 | 0.000000 |
5601.076000 | 0.004348 | -0.003539 | 0.000935 | -0.000491 | 0.000125 | 0.000314 | -0.000479 | -0.000718 | -0.000923 | 0.000000 | 0.000000 | 0.000000 |
2565.430000 | 0.011766 | -0.009644 | 0.002561 | -0.001344 | 0.000339 | 0.000862 | -0.001313 | -0.001770 | -0.001784 | 0.000000 | 0.000000 | 0.000000 |
1235.564000 | 0.030423 | -0.025231 | 0.006758 | -0.003546 | 0.000892 | 0.002264 | -0.003464 | -0.005257 | -0.006933 | 0.000000 | 0.000000 | 0.000000 |
620.987000 | 0.071844 | -0.060867 | 0.016550 | -0.008674 | 0.002180 | 0.005566 | -0.008481 | -0.011272 | -0.010903 | 0.000000 | 0.000000 | 0.000000 |
323.315200 | 0.145887 | -0.127555 | 0.035453 | -0.018568 | 0.004672 | 0.011860 | -0.018177 | -0.028296 | -0.038962 | 0.000000 | 0.000000 | 0.000000 |
173.029200 | 0.235586 | -0.215102 | 0.061602 | -0.032212 | 0.008100 | 0.020716 | -0.031525 | -0.039701 | -0.032020 | 0.000000 | 0.000000 | 0.000000 |
94.708220 | 0.270018 | -0.249943 | 0.072247 | -0.037787 | 0.009524 | 0.024056 | -0.037080 | -0.065700 | -0.109632 | 0.000000 | 0.000000 | 0.000000 |
52.498210 | 0.197478 | -0.096937 | 0.008334 | -0.004527 | 0.001050 | 0.003147 | -0.003900 | 0.024661 | 0.108041 | 0.000000 | 0.000000 | 0.000000 |
29.370620 | 0.118479 | 0.228887 | -0.146379 | 0.075860 | -0.019301 | -0.050784 | 0.078527 | 0.058927 | -0.087467 | 0.000000 | 0.000000 | 0.000000 |
16.839600 | 0.108540 | 0.455929 | -0.303725 | 0.161483 | -0.041796 | -0.104408 | 0.164530 | 0.377809 | 0.828455 | 0.000000 | 0.000000 | 0.000000 |
9.860389 | 0.073590 | 0.327872 | -0.202325 | 0.101675 | -0.025391 | -0.074037 | 0.119751 | -0.075042 | -0.869115 | 1.000000 | 0.000000 | 0.000000 |
5.772019 | 0.021726 | 0.089220 | 0.198391 | -0.128466 | 0.035224 | 0.115730 | -0.230308 | -0.072684 | 1.100840 | 0.000000 | 1.000000 | 0.000000 |
3.272785 | 0.000609 | -0.014006 | 0.513080 | -0.340192 | 0.097316 | 0.218710 | -0.318291 | -1.161700 | -4.052360 | 0.000000 | 0.000000 | 0.000000 |
1.844231 | -0.001107 | -0.017292 | 0.371942 | -0.288476 | 0.082631 | 0.307741 | -0.626219 | 0.108680 | 5.755330 | 0.000000 | 0.000000 | 0.000000 |
1.002645 | -0.000349 | -0.004785 | 0.105866 | 0.127906 | -0.058221 | -0.369722 | 1.337230 | 3.309330 | -2.160340 | 0.000000 | 0.000000 | 0.000000 |
0.536811 | -0.000069 | -0.001224 | 0.042583 | 0.482766 | -0.198667 | -0.658429 | 0.715185 | -3.481060 | -3.428450 | 0.000000 | 0.000000 | 0.000000 |
0.285174 | -0.000069 | -0.000970 | 0.035595 | 0.443832 | -0.230367 | 0.046613 | -1.455280 | 0.067858 | 5.664510 | 0.000000 | 0.000000 | 0.000000 |
0.142116 | -0.000009 | -0.000254 | 0.010741 | 0.146639 | -0.025149 | 0.376995 | -0.575082 | 1.934010 | -3.720260 | 0.000000 | 0.000000 | 0.000000 |
0.083330 | -0.000006 | -0.000021 | 0.000222 | -0.001575 | 0.338615 | 0.443744 | 0.708695 | -0.468314 | 0.476424 | 0.000000 | 0.000000 | 0.000000 |
0.044699 | 0.000002 | -0.000004 | 0.000481 | 0.008645 | 0.498618 | 0.254433 | 0.449929 | -0.580569 | 0.420345 | 0.000000 | 0.000000 | 0.000000 |
0.023422 | -0.000001 | -0.000000 | -0.000104 | -0.002238 | 0.288004 | 0.024654 | 0.067912 | -0.133143 | 0.376271 | 0.000000 | 0.000000 | 0.000000 |
0.011575 | 0.000000 | 0.000000 | 0.000027 | 0.000554 | 0.040347 | 0.001559 | -0.000158 | 0.004847 | -0.044674 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)