Fa. Gianturco et T. Stoecklin, ELECTRON-SCATTERING FROM ACETYLENE - ELASTIC INTEGRAL AND DIFFERENTIAL CROSS-SECTIONS AT LOW ENERGIES, Journal of physics. B, Atomic molecular and optical physics, 27(24), 1994, pp. 5903-5921
Calculations have been carried out for the scattering of slow electron
s from acetylene molecules in the gas phase, using the fixed-nuclei (F
N) dynamical approximation and computing elastic cross sections only,
integral and differential. Ab initio results at the exact static-excha
nge (ESE) level have been supplemented by a model local potential desc
ribing short-range and long-range polarization forces. The target wave
function was obtained at the SCE level from a multicentre expansion ov
er Gaussian orbitals (GTOs). Both the static and exchange interactions
, V-st and V-ex, were obtained from a discrete basis by using multicen
tre orbitals and the separable exchange approximation. The final resul
ts are compared with available experiments and a detailed search for t
he 2.6 eV shape resonance is discussed. The very-low-energy computed c
ross sections also reveal the presence of a Ramsauer-Townsend (RT) min
imum.