MOLPRO Basis Query, element=Pr, basis=cc-pwCVQZ-DK3, l=p
Basis Pr p cc-pwCVQZ-DK3
| Primitives | Contractions... |
|---|
| 41141380.000000 | 0.000003 | -0.000003 | 0.000001 | -0.000000 | 0.000000 | 0.000000 | -0.000000 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
| 9401070.000000 | 0.000006 | -0.000005 | 0.000001 | -0.000001 | 0.000000 | 0.000000 | -0.000001 | -0.000001 | -0.000001 | 0.000000 | 0.000000 | 0.000000 |
| 2532069.000000 | 0.000018 | -0.000015 | 0.000004 | -0.000002 | 0.000000 | 0.000001 | -0.000002 | -0.000003 | -0.000003 | 0.000000 | 0.000000 | 0.000000 |
| 765143.600000 | 0.000042 | -0.000035 | 0.000009 | -0.000005 | 0.000001 | 0.000003 | -0.000005 | -0.000007 | -0.000008 | 0.000000 | 0.000000 | 0.000000 |
| 252657.000000 | 0.000105 | -0.000086 | 0.000023 | -0.000012 | 0.000003 | 0.000007 | -0.000012 | -0.000018 | -0.000020 | 0.000000 | 0.000000 | 0.000000 |
| 89850.550000 | 0.000259 | -0.000212 | 0.000058 | -0.000029 | 0.000006 | 0.000017 | -0.000030 | -0.000043 | -0.000048 | 0.000000 | 0.000000 | 0.000000 |
| 34166.210000 | 0.000662 | -0.000545 | 0.000149 | -0.000073 | 0.000017 | 0.000044 | -0.000078 | -0.000113 | -0.000128 | 0.000000 | 0.000000 | 0.000000 |
| 13853.800000 | 0.001734 | -0.001431 | 0.000391 | -0.000193 | 0.000044 | 0.000115 | -0.000205 | -0.000287 | -0.000316 | 0.000000 | 0.000000 | 0.000000 |
| 5977.540000 | 0.004623 | -0.003831 | 0.001049 | -0.000518 | 0.000117 | 0.000310 | -0.000552 | -0.000810 | -0.000918 | 0.000000 | 0.000000 | 0.000000 |
| 2731.717000 | 0.012265 | -0.010240 | 0.002821 | -0.001392 | 0.000315 | 0.000832 | -0.001475 | -0.002055 | -0.002249 | 0.000000 | 0.000000 | 0.000000 |
| 1312.812000 | 0.031393 | -0.026528 | 0.007371 | -0.003637 | 0.000823 | 0.002175 | -0.003885 | -0.005739 | -0.006547 | 0.000000 | 0.000000 | 0.000000 |
| 658.511000 | 0.073694 | -0.063653 | 0.017965 | -0.008856 | 0.002003 | 0.005299 | -0.009383 | -0.012985 | -0.014151 | 0.000000 | 0.000000 | 0.000000 |
| 342.217200 | 0.148708 | -0.132610 | 0.038252 | -0.018853 | 0.004267 | 0.011286 | -0.020214 | -0.030304 | -0.034956 | 0.000000 | 0.000000 | 0.000000 |
| 182.845800 | 0.237835 | -0.221605 | 0.065921 | -0.032453 | 0.007346 | 0.019436 | -0.034304 | -0.046305 | -0.049543 | 0.000000 | 0.000000 | 0.000000 |
| 99.947910 | 0.267905 | -0.251222 | 0.074931 | -0.036909 | 0.008358 | 0.022131 | -0.040140 | -0.064691 | -0.077847 | 0.000000 | 0.000000 | 0.000000 |
| 55.327810 | 0.193395 | -0.084772 | 0.002450 | -0.001178 | 0.000209 | 0.000513 | 0.001002 | 0.019064 | 0.037806 | 0.000000 | 0.000000 | 0.000000 |
| 30.797750 | 0.121015 | 0.255755 | -0.169010 | 0.083549 | -0.019149 | -0.051230 | 0.090175 | 0.103672 | 0.093393 | 0.000000 | 0.000000 | 0.000000 |
| 17.511220 | 0.113724 | 0.472145 | -0.330911 | 0.167887 | -0.038849 | -0.104108 | 0.197853 | 0.379227 | 0.536335 | 0.000000 | 0.000000 | 0.000000 |
| 10.084320 | 0.070374 | 0.303263 | -0.167998 | 0.076403 | -0.017118 | -0.047296 | 0.075034 | -0.048130 | -0.269461 | 1.000000 | 0.000000 | 0.000000 |
| 5.813673 | 0.016569 | 0.063626 | 0.279305 | -0.171023 | 0.041861 | 0.127197 | -0.267922 | -0.329707 | -0.264437 | 0.000000 | 1.000000 | 0.000000 |
| 3.291799 | 0.000098 | -0.014977 | 0.525764 | -0.346823 | 0.087931 | 0.227632 | -0.447269 | -1.233910 | -2.501440 | 0.000000 | 0.000000 | 0.000000 |
| 1.870842 | -0.000840 | -0.012478 | 0.312096 | -0.227257 | 0.057412 | 0.207630 | -0.361651 | 0.987827 | 5.573030 | 0.000000 | 0.000000 | 0.000000 |
| 1.063370 | -0.000181 | -0.003115 | 0.082623 | 0.157261 | -0.057389 | -0.356122 | 1.257470 | 2.249840 | -3.100200 | 0.000000 | 0.000000 | 0.000000 |
| 0.585371 | -0.000082 | -0.000955 | 0.036319 | 0.447967 | -0.151571 | -0.482581 | 0.614936 | -2.595220 | -2.638480 | 0.000000 | 0.000000 | 0.000000 |
| 0.325307 | -0.000024 | -0.000579 | 0.027203 | 0.411764 | -0.173964 | -0.087209 | -1.003500 | -0.664913 | 4.768260 | 0.000000 | 0.000000 | 0.000000 |
| 0.178634 | -0.000022 | -0.000260 | 0.011552 | 0.173410 | -0.075782 | 0.235065 | -0.830289 | 1.731330 | -1.848650 | 0.000000 | 0.000000 | 0.000000 |
| 0.090782 | 0.000002 | -0.000026 | 0.001578 | 0.026371 | 0.214599 | 0.545567 | 0.464651 | 0.220294 | -1.255130 | 0.000000 | 0.000000 | 0.000000 |
| 0.046706 | -0.000002 | -0.000007 | 0.000174 | 0.002003 | 0.490537 | 0.322906 | 0.548597 | -0.799428 | 1.062020 | 0.000000 | 0.000000 | 0.000000 |
| 0.024139 | 0.000001 | 0.000001 | 0.000014 | 0.000639 | 0.378792 | 0.042557 | 0.060053 | -0.064743 | 0.131778 | 0.000000 | 0.000000 | 0.000000 |
| 0.012318 | -0.000000 | -0.000000 | 0.000003 | -0.000056 | 0.076333 | 0.001413 | 0.005689 | -0.016232 | 0.020666 | 0.000000 | 0.000000 | 1.000000 |
Comment: Q. Lu and K.A. Peterson, J. Chem. Phys. 145, 054111 (2016)