BAND STRUCTURE CALCULATIONS ON POLYMERIC CHAINS.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Abstract

In this study, quantum mechanical calculations have been carried out to describe the electronic band structures for a number of structurally related polymeric chains in the undoped state. Values of the electronic band gaps E//g and band widths so obtained were then used to predict the possibility for electrical conductivity in these materials and to comment more generally on structure-conductivity relationships.

Original languageEnglish (US)
Title of host publicationPolymeric Materials Science and Engineering, Proceedings of the ACS Division of Polymeric Material
PublisherACS
Pages134-137
Number of pages4
ISBN (Print)0841209855
StatePublished - 1986
Externally publishedYes

Publication series

NamePolymeric Materials Science and Engineering, Proceedings of the ACS Division of Polymeric Material
Volume55
ISSN (Print)0743-0515

All Science Journal Classification (ASJC) codes

  • Chemical Engineering (miscellaneous)
  • Polymers and Plastics

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