THEORETICAL DETERMINATION OF SPECTRAL-LINES FOR THE ZN ATOM AND THE ZNH MOLECULE

Authors
JAMORSKI C DARGELOS A TEICHTEIL C DAUDEY JP
Citation
C. Jamorski et al., THEORETICAL DETERMINATION OF SPECTRAL-LINES FOR THE ZN ATOM AND THE ZNH MOLECULE, The Journal of chemical physics, 100(2), 1994, pp. 917-925
Citations number
29
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
The Journal of chemical physics → ACNP
ISSN journal
00219606
Volume
100
Issue
2
Year of publication
1994
Pages
917 - 925
Database
ISI
SICI code
0021-9606(1994)100:2<917:TDOSFT>2.0.ZU;2-5
Abstract
Theoretical calculations of the low lying excited states of the Zn ato m and ZnH molecule are reported. An averaged relativistic effective co re potential is used for the 1s(2) 2s(2) 2p(4) 3d(10) electrons; of Zn and the polarization and intrashell correlation effects are treated w ith a semiempirical core polarization potential. Spin-orbit splittings are incorporated into the correlated electronic states.