Article ID Journal Published Year Pages File Type
5381906 Chemical Physics Letters 2013 5 Pages PDF
Abstract

- Atomic models of layers and tubes of fluorographene C4F are designed.
- Using DFTB method, their stability and electronic properties are predicted.
- The types of fluorine coverage are crucial for morphology of these materials.
- Some types of C4F structures aspire to the spontaneous folding.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
Layers and tubes of fluorographene C4F: Stability, structural and electronic properties from DFTB calculations
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