摘要
The geometrical and electronic structure of tripotassium doped phenanthrene, K(3)C(14)H(10), has been studied by first-principles density-functional theory. The main effect of potassium doping is to inject charge in the narrow phenanthrene conduction band, rendering the system metallic. The Fermi surface for the experimental x-ray unit cell is composed of two sheets with marked one- and two-dimensional character respectively.
- 出版日期2011-10-3