Cross sections and beta values for ligand-field-split Br 3d orbitals in HBr

Citation
Yf. Hu et al., Cross sections and beta values for ligand-field-split Br 3d orbitals in HBr, J PHYS B, 32(16), 1999, pp. 4091-4100
Citations number
38
Categorie Soggetti
Physics
Journal title
JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS
ISSN journal
09534075 → ACNP
Volume
32
Issue
16
Year of publication
1999
Pages
4091 - 4100
Database
ISI
SICI code
0953-4075(19990828)32:16<4091:CSABVF>2.0.ZU;2-T
Abstract
The ligand field in HBr results in the splitting of the Br3d orbitals into the 3d(delta) (d(x2-y2), d(xy)), 3d(pi) (d(xz), d(yz)), and 3d(sigma) (d(z) 2) orbitals. In core ionized HBr, the stronger spin-orbit splitting removes the remaining degeneracies and results in five different Br 3d eigenstates from linear combinations of the 3d(delta), 3d(pi), and 3d(sigma) orbitals. In high-resolution Pr 3d photoelectron spectra, as presented in this work, these five peaks are resolved. The photoelectron cross sections and beta v alues for the different d orbitals have been studied from 5 to 25 eV above threshold. The relative intensities for the different 3d orbitals are quite different at different analysis angles, showing that the beta values are d ifferent. Multiple-scattering-X alpha calculations give results in semiquan titative agreement with experiment.