MOLPRO Basis Query, element=Mn, basis=cc-pwCV5Z, l=s
Basis Mn s cc-pwCV5Z
| Primitives | Contractions... |
|---|
| 137766000.000000 | 0.000000 | -0.000000 | 0.000000 | -0.000000 | -0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 24564000.000000 | 0.000001 | -0.000000 | 0.000000 | -0.000000 | -0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 5479990.000000 | 0.000003 | -0.000002 | 0.000000 | -0.000000 | -0.000000 | -0.000000 | 0.000000 | -0.000000 | 0.000000 | 0.000000 | 0.000000 |
| 1466640.000000 | 0.000016 | -0.000007 | 0.000002 | -0.000000 | -0.000001 | -0.000001 | 0.000002 | -0.000002 | 0.000000 | 0.000000 | 0.000000 |
| 454421.000000 | 0.000061 | -0.000029 | 0.000007 | -0.000002 | -0.000003 | -0.000005 | 0.000006 | -0.000007 | 0.000000 | 0.000000 | 0.000000 |
| 158216.000000 | 0.000205 | -0.000098 | 0.000024 | -0.000005 | -0.000010 | -0.000016 | 0.000022 | -0.000026 | 0.000000 | 0.000000 | 0.000000 |
| 60404.300000 | 0.000628 | -0.000300 | 0.000072 | -0.000016 | -0.000033 | -0.000051 | 0.000062 | -0.000073 | 0.000000 | 0.000000 | 0.000000 |
| 24793.600000 | 0.001772 | -0.000847 | 0.000204 | -0.000045 | -0.000089 | -0.000140 | 0.000189 | -0.000228 | 0.000000 | 0.000000 | 0.000000 |
| 10772.300000 | 0.004688 | -0.002247 | 0.000542 | -0.000120 | -0.000246 | -0.000389 | 0.000459 | -0.000543 | 0.000000 | 0.000000 | 0.000000 |
| 4895.540000 | 0.011723 | -0.005649 | 0.001369 | -0.000303 | -0.000596 | -0.000932 | 0.001287 | -0.001553 | 0.000000 | 0.000000 | 0.000000 |
| 2306.560000 | 0.027691 | -0.013493 | 0.003290 | -0.000728 | -0.001500 | -0.002384 | 0.002744 | -0.003235 | 0.000000 | 0.000000 | 0.000000 |
| 1119.560000 | 0.060965 | -0.030377 | 0.007519 | -0.001665 | -0.003255 | -0.005075 | 0.007197 | -0.008729 | 0.000000 | 0.000000 | 0.000000 |
| 557.381000 | 0.121399 | -0.063172 | 0.016021 | -0.003548 | -0.007380 | -0.011775 | 0.013111 | -0.015433 | 0.000000 | 0.000000 | 0.000000 |
| 283.778000 | 0.206724 | -0.116959 | 0.031132 | -0.006905 | -0.013332 | -0.020732 | 0.031040 | -0.038040 | 0.000000 | 0.000000 | 0.000000 |
| 147.436000 | 0.271655 | -0.180492 | 0.051879 | -0.011523 | -0.024617 | -0.039780 | 0.040286 | -0.047194 | 0.000000 | 0.000000 | 0.000000 |
| 78.022700 | 0.229626 | -0.199957 | 0.064554 | -0.014414 | -0.026079 | -0.039836 | 0.076120 | -0.096546 | 0.000000 | 0.000000 | 0.000000 |
| 41.967900 | 0.099935 | -0.091356 | 0.031095 | -0.006962 | -0.020888 | -0.037232 | -0.003929 | 0.011021 | 0.000000 | 0.000000 | 0.000000 |
| 22.877800 | 0.043357 | 0.170522 | -0.081344 | 0.018389 | 0.051231 | 0.090065 | -0.008212 | 0.002269 | 0.000000 | 0.000000 | 0.000000 |
| 12.584500 | 0.070976 | 0.456298 | -0.283085 | 0.066583 | 0.113030 | 0.183398 | -0.508202 | 0.723571 | 0.000000 | 0.000000 | 0.000000 |
| 6.941700 | 0.061958 | 0.405813 | -0.368328 | 0.090268 | 0.246677 | 0.467648 | -0.334345 | 0.628426 | 0.000000 | 0.000000 | 0.000000 |
| 3.806290 | 0.018787 | 0.122820 | -0.055990 | 0.011141 | -0.065085 | -0.212828 | 0.089694 | -1.386873 | 0.000000 | 0.000000 | 0.000000 |
| 2.050310 | 0.001456 | 0.009020 | 0.428551 | -0.123278 | -0.232440 | -0.768032 | 2.788472 | -3.618230 | 0.000000 | 0.000000 | 0.000000 |
| 1.068380 | -0.000050 | -0.001825 | 0.581962 | -0.209459 | -0.788469 | -1.249617 | -2.238707 | 8.747224 | 0.000000 | 0.000000 | 0.000000 |
| 0.536606 | -0.000084 | -0.001093 | 0.249608 | -0.192513 | 0.257125 | 2.412797 | -1.621514 | -6.944693 | 0.000000 | 0.000000 | 0.000000 |
| 0.183260 | -0.000001 | -0.000083 | 0.017280 | 0.075243 | 1.473500 | 0.722780 | 5.050226 | 1.920404 | 0.000000 | 0.000000 | 0.000000 |
| 0.105297 | 0.000010 | 0.000105 | -0.004795 | 0.409646 | -0.016420 | -2.521843 | -3.458040 | 2.767324 | 0.000000 | 0.000000 | 0.000000 |
| 0.051464 | 0.000011 | 0.000056 | 0.003440 | 0.513888 | -0.617679 | 0.330250 | -1.285068 | -4.803418 | 0.000000 | 0.000000 | 0.000000 |
| 0.024678 | 0.000004 | 0.000029 | 0.000081 | 0.164815 | -0.528590 | 0.957231 | 1.592708 | 2.302607 | 1.000000 | 0.000000 | 0.000000 |
| 5.822100 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 | 0.000000 |
| 1.991600 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 0.000000 | 1.000000 |
Comment: basis set from gbasis database