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Spin-Peierls vs Peierls distortions in a family of conjugated polymers
García Bach, Ma. de los Ángeles; Valentí i Vall, M. Roser; Klein, D. J.
Universitat de Barcelona
Distortions in a family of conjugated polymers are studied using two complementary approaches: within a many-body valence bond approach using a transfer-matrix technique to treat the Heisenberg model of the systems, and also in terms of the tight-binding band-theoretic model with interactions limited to nearest neighbors. The computations indicate that both methods predict the presence or absence of the same distortions in most of the polymers studied.
04-05-2010
Polímers
Química física
Polymers
Physical chemistry
(c) The American Physical Society, 1997
Article
The American Physical Society
         

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