β Scribed by Miyabi Hiyama; Suehiro Iwata
No coin nor oath required. For personal study only.
The photoelectron spectrum of HCI up to 32 eV is analyzed with ab initio MO CI calculations. The potential energy curves of most of the highly excited states of the ion HCl* are correctly drawn to near the dissociation limit, and the Franck-Condon factors (FCF) from the neutral ground state are evaluated. By comparing the experimental spectrum with the theoretical FCF distribution, six observed bands between 20 and 32 eV are assigned. One ofthem turns out to be a Rydberg state converged to the ground state of HCl'+
π SIMILAR VOLUMES
The photoelectron spectrum of carbon tetrafluoride is compared with X-ray emission spectra and with molecular orbital calculations. The ionization energies at 22.2 and 25.1 eV are related to the 2t2 and 2al orbitals, respectively. With this result all "molecular orbital" states of CF$ are identifie
## Ckuhtions \\irh LI Ixge basis set including nuny poLmzat~on functions .UC reported for SF,. The feasibility of such aIcuIations is discussed. By adding Koopmans' corrections IS calculated previously to the more accurate b&es of the orbital energies obtained here the sssigmmznt problem of the ra