Abstract
Peierls lattice distortion has been investigated in substituted polyacetylenes. We find that the Peierls dimerization could be suppressed by the substitution of hydrogen atoms with phenyl or methyl. A study on an oligomer by a Lanczos exact diagonalization algorithm indicates that the inclusion of Hubbard repulsion does not change the result. The expected quadrimerization, which is required by the Peierls theorem, does not appear in poly(methyl-acetylene).
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.