Conductivity in Polyacetylene. 3. Ab Initio Calculations for a Two-Site Model for Electron Transfer
- 1 January 1996
- journal article
- research article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry
- Vol. 100 (15) , 6298-6303
- https://doi.org/10.1021/jp9528830
Abstract
No abstract availableKeywords
This publication has 5 references indexed in Scilit:
- Conductivity in polyacetylene. I. Ab initio calculation of charge localization, bond distances, and reorganization energy in model moleculesThe Journal of Chemical Physics, 1995
- Stage-1 phases of alkali-metal-doped conducting polymersPhysical Review B, 1992
- X-Ray Scattering from Sodium-Doped Polyacetylene: Incommensurate-Commensurate and Order-Disorder TransformationsPhysical Review Letters, 1987
- Chemical and Electrochemical Electron-Transfer TheoryAnnual Review of Physical Chemistry, 1964
- Über die Zuordnung von Wellenfunktionen und Eigenwerten zu den Einzelnen Elektronen Eines AtomsPhysica, 1934