S. Pleutin et Jl. Fave, An excitonic method based on PPP Hamiltonian: application to the dimerization of polyenes, SYNTH METAL, 101(1-3), 1999, pp. 302-303
Starting from the Pariser-Parr-Pople Hamiltonian, we have proposed an effec
tive Hamiltonian based on a local description of a conjugated polymer in te
rms of monomers. The model is adapted to the description of the ground and
low energy excited decreases.