MOLPRO Basis Query, element=Ba, basis=def2-TZVPD, l=d
Basis Ba d def2-TZVPD
Primitives | Contractions... |
0.966315 | -0.908938 |
0.893828 | 0.947240 |
0.273195 | 0.322057 |
0.103891 | 0.000000 |
0.035578 | 0.000000 |
Comment: Rappoport, Furche: J. Chem. Phys. 133, 134105 (2010)
|