Abstract
We propose two kinds of 2D carbon allotropes with a naphthyl-like group used as structural unit. We name them naphthylenes of the α, and β kinds, and study their atomic and electronic structure using density functional theory. We also investigate a set of nanoribbons cut out of naphthylenes. We show that these systems are usually metallic, with frontier states spread inside the structure, rather than at their edges. This results in a type of nanomaterials featuring controlled properties that can be tuned for targeted applications in nanoelectronics.
| Original language | English (US) |
|---|---|
| Pages (from-to) | 792-803 |
| Number of pages | 12 |
| Journal | Carbon |
| Volume | 153 |
| DOIs | |
| State | Published - Nov 2019 |
All Science Journal Classification (ASJC) codes
- General Chemistry
- General Materials Science
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