Direct observation of Coulomb correlation effects in polyacetylene

H. Thomann, L. K. Dalton, M. Grabowski, and T. C. Clarke
Phys. Rev. B 31, 3141 – Published 1 March 1985
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Abstract

We report the direct observation of electron-electron correlation effects in polyacetylene. Pristine 99% enriched13 cis-rich polyacetylene has been investigated by electron nuclear-nuclear triple (double-ENDOR) resonance spectroscopy. We observe an induced negative spin polarization of ρ/ρ+≃-0.33. Negative spin densities arise from spin exchange mechanisms which can only result from Coulomb effects. Theoretical analysis of experimental results within the soliton framework yields 3 eV for the effective on-site Coulomb repulsion.

  • Received 12 September 1984

DOI:https://doi.org/10.1103/PhysRevB.31.3141

©1985 American Physical Society

Authors & Affiliations

H. Thomann

  • Department of Chemistry, University of Southern California, Los Angeles, California 90089 and Corporate Research Science Laboratories, Exxon Research and Engineering Company, Annandale, New Jersey 08801

L. K. Dalton

  • Department of Chemistry, University of Southern California, Los Angeles, California 90089

M. Grabowski

  • Department of Physics, University of California, San Diego, La Jolla, California 92093

T. C. Clarke

  • IBM Thomas J. Watson Research Center, Yorktown Heights, New York 10598

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Vol. 31, Iss. 5 — 1 March 1985

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