Abstract
We find by ab initio simulations that significant overall tensile strain can be induced by pure bending in a wide range of two-dimensional crystals perpendicular to the bending moment, just like an accordion being bent to open. This bending-induced tensile strain increases in a power law with bent curvature and can be over 20% in monolayered black phosphorus and transition metal dichalcogenides at a moderate curvature of 2nm-1 but more than an order weaker in graphene and hexagon boron nitride. This accordion effect is found to be a quantum mechanical effect raised by the asymmetric response of chemical bonds and electron density to the bending curvature.
| Original language | English |
|---|---|
| Pages (from-to) | 71-76 |
| Number of pages | 6 |
| Journal | Acta Mechanica Sinica/Lixue Xuebao |
| Volume | 33 |
| Issue number | 1 |
| DOIs | |
| State | Published - 1 Feb 2017 |
| Externally published | Yes |
Keywords
- Accordion effect
- Bending to extension
- Density functional theory
- Monolayer black phosphorus
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