✍ Scribed by C. Rolfs; W. Trost; E. Kuhlmann; R. Krämer; F. Riess
No coin nor oath required. For personal study only.
📜 SIMILAR VOLUMES
The ground and low-lying excited states of Tic are investigated using a CASSCF-externally contracted Cl spproach\_ The c;tlculations yield a 3X\* ground state, but the lx+ state is only 780 cm-t h&her and r3nnot be ruled out. The low-lying states have some triple bond character. The nature of the bo
The structure, harmonic frequencies and binding energies of the low-lying states of MgN$ have been computed at the multireference con&nation interaction level of theory. The charge-quadrupole interaction results in a linear 'Z+ ground state of MgN: , as expected. The excited states can arise from ei
## Relativistic CI calculations on the low-lying states of BiF(O+, 1, 2, O+ (II)) arising from the Q\*P\* configuration are carried out. Comparison calculations of the X-s states without spin-orbit interaction (3Z-, IX+ and 'A) are also presented. These calculations enable the assignment of three