Jr. Sabin et al., THE RELATIVE IMPORTANCE OF TEMPERATURE AND ISOTOPE EFFECTS ON THE DIPOLE OSCILLATOR STRENGTH DISTRIBUTION OF H-2, Theoretica Chimica Acta, 89(5-6), 1994, pp. 375-382
The calculation of the effects of temperature and isotopic composition
on the energy weighted moments of the dipole oscillator strength dist
ribution of H-2 in the random phase approximation to the polarization
propagator are reported. It is seen that the effect of isotopic compos
ition is small, while that of temperature is of an order accessible to
experiment. We find that all the mean excitation energies I(mu), for
mu = - 1, 0, 1, decrease with temperature as does the dipole oscillato
r strength moment S(mu) for mu > 0, while the opposite is true for mu
< 0. These effects are interpreted in terms of the bond length depende
nce of the excitation energies.