ADIABATIC POTENTIAL CURVES FOR THE CD-2 DIMER

Authors
CZUCHAJ E REBENTROST F STOLL H PREUSS H
Citation
E. Czuchaj et al., ADIABATIC POTENTIAL CURVES FOR THE CD-2 DIMER, Chemical physics letters, 225(1-3), 1994, pp. 233-239
Citations number
19
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
Chemical physics letters → ACNP
ISSN journal
00092614
Volume
225
Issue
1-3
Year of publication
1994
Pages
233 - 239
Database
ISI
SICI code
0009-2614(1994)225:1-3<233:APCFTC>2.0.ZU;2-6
Abstract
Potential energy curves and dipole transition moments for a number of electronic states of the Cd2 dimer are presented and discussed. They a re derived using the MRCI(SD) procedure for the valence electrons of t he species, while the core electrons are represented by semi-empirical l-dependent pseudopotentials. The effect of spin-orbit coupling is no t investigated.