MOLPRO Basis Query, element=Cs, basis=VQZ-PP, l=p
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)
Basis Cs p VQZ-PP
| Primitives | Contractions... |
|---|
| 8.996260 | -0.007697 | 0.001479 | 0.000000 | 0.000000 | 0.000000 |
| 5.621440 | 0.039593 | -0.007575 | 0.000000 | 0.000000 | 0.000000 |
| 3.418720 | -0.017564 | 0.004319 | 0.000000 | 0.000000 | 0.000000 |
| 1.772490 | -0.214967 | 0.037406 | 0.000000 | 0.000000 | 0.000000 |
| 0.550753 | 0.357225 | -0.068747 | 0.000000 | 0.000000 | 0.000000 |
| 0.282784 | 0.497061 | -0.097360 | 0.000000 | 0.000000 | 0.000000 |
| 0.142527 | 0.276106 | -0.101040 | 0.000000 | 0.000000 | 0.000000 |
| 0.064460 | 0.044195 | -0.039244 | 0.000000 | 0.000000 | 0.000000 |
| 0.040086 | -0.003444 | 0.221687 | 1.000000 | 0.000000 | 0.000000 |
| 0.019157 | 0.001919 | 0.589355 | 0.000000 | 1.000000 | 0.000000 |
| 0.008980 | -0.000264 | 0.321805 | 0.000000 | 0.000000 | 1.000000 |
Comment: J.G. Hill and K.A. Peterson, J. Chem. Phys. 147, 244106 (2017)