P. Dannetun et al., THE CHEMICAL AND ELECTRONIC-STRUCTURE OF THE INTERFACE BETWEEN ALUMINUM AND CONJUGATED POLYMERS OR MOLECULES, Synthetic metals, 55(1), 1993, pp. 212-217
The interaction between aluminum and alpha-omega-diphenyltetradecahept
aene (DP7), alpha-sexithienyl (6T), and poly(p-phenylenevinylene) (PPV
), respectively have been studied using both X-ray Photoelectron Spect
roscopy (XPS) and Ultraviolet Photoelectron Spectroscopy (UPS). The UP
S valence band spectra, are interpreted with the help of quantum chemi
cal calculations based upon Modified Neglect of Diatomic Overlap (MNDO
), Valence Effective Hamitonian (VEH) and ab initio Hartree-Fock metho
ds. DP7 is a model molecule for polyacetylene, while 6T is a model mol
ecule (an oligomer) of polythiophene. The results indicate that alumin
um reacts strongly with the surfaces of all of the materials studied.
The pi-electronic structure of each material was strongly modified. Fu
rthermore, aluminum reacts preferentially with the polyene part of DP7
, with the vinylene part of PPV, and with the alpha-carbons of the thi
ophene units of 6T.