A PHOTOELECTRON-SPECTROSCOPY STUDY OF THE CHARGE-INDUCED PI-ELECTRONIC STRUCTURAL-CHANGES IN ALPHA,OMEGA-DIPHENYLTETRADECAHEPTAENE - A MODEL MOLECULE FOR POLYACETYLENE
M. Logdlund et al., A PHOTOELECTRON-SPECTROSCOPY STUDY OF THE CHARGE-INDUCED PI-ELECTRONIC STRUCTURAL-CHANGES IN ALPHA,OMEGA-DIPHENYLTETRADECAHEPTAENE - A MODEL MOLECULE FOR POLYACETYLENE, Synthetic metals, 57(2-3), 1993, pp. 4722-4727
The pi-electronic structural changes in a diphenylpolyene, alpha,omega
-diphenyltetraheptaene, or DP7, have been studied upon gradually dopin
g with sodium, using X-ray and Ultraviolet Photoelectron Spectroscopy,
XPS and UPS. The spectra are interpreted with the help of the results
from Austin Model 1 (AM1) and Valence Effective Hamiltonian (VEH) qua
ntum chemical calculations. The results of the doping with sodium can
be discussed in terms of two confined solitons on the polyene part of
the molecule, which results in two new energy levels in the originally
forbidden energy pp.