POTENTIAL-ENERGY CURVE OF THE X0(-STATE OF HGAR DETERMINED FROM A0(+)((3)PI) -] XO(+) AND B1((3)SIGMA(+)) -] XO(+) FLUORESCENCE-SPECTRA()((1)SIGMA(+)) GROUND)
J. Koperski, POTENTIAL-ENERGY CURVE OF THE X0(-STATE OF HGAR DETERMINED FROM A0(+)((3)PI) -] XO(+) AND B1((3)SIGMA(+)) -] XO(+) FLUORESCENCE-SPECTRA()((1)SIGMA(+)) GROUND), Chemical physics, 211(1-3), 1996, pp. 191-201
A0(+)((3) Pi) --> X0(+)((1) Sigma(+)) and B1((3) Sigma(+)) --> X0(+)((
1) Sigma(+)) fluorescence spectra of HgAr van der Waals molecules were
previously produced in a pulsed supersonic molecular beam crossed wit
h a pulsed dye-laser beam, following excitation of single vibronic lev
els. The dispersed fluorescence displayed characteristic Condon intern
al diffraction (CID) patterns consisting of bound-free reflection type
, continuous spectra, and also bound-bound discrete features. An analy
sis of the A0(+) --> X0(+) and B1 --> X0(+) bound-bound spectra indica
tes that a Morse function is an adequate representation of the X0(+) p
otential energy (PE) curve below the dissociation limit. In simulation
of the A0(+) --> X0(+) bound-free spectra the Morse, Lennard-Jones (n
- 6) and Maitland-Smith functions were tested, and the Maitland-Smith
potential was found to be a good representation of the repulsive wall
of the X0(+) PE curve above the dissociation limit over the internucl
ear separation range R = 2.8-3.5 Angstrom.