Abstract
The energy spectra and the electric and magnetic properties of one-dimensional (1D) stacks consisting of conjugated π-electron systems (polycyclic aromatic hydrocarbons and polymethines) with Tamm defects are investigated theoretically by means of the many-electron band theory. The conditions for the relative arrangement of the stacks in terms of the slip parameters for yielding different magnetic and electric ground-state properties are studied.
Original language | English |
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Pages (from-to) | 6232-6239 |
Number of pages | 8 |
Journal | Journal of Physical Chemistry C |
Volume | 112 |
Issue number | 16 |
DOIs | |
Publication status | Published - Apr 24 2008 |
Externally published | Yes |
All Science Journal Classification (ASJC) codes
- Electronic, Optical and Magnetic Materials
- Energy(all)
- Physical and Theoretical Chemistry
- Surfaces, Coatings and Films