Abstract
First-principles calculations show that the rich variety of image patterns found in carbon nanostructures with the atomic force and scanning tunneling microscopes can be rationalized in terms of the chemical reactivity of the tip and the distance range explored in the experiments. For weakly reactive tips, the Pauli repulsion dominates the atomic contrast and force maxima are expected on low electronic density positions as the hollow site. With reactive tips, the interaction is strong enough to change locally the hybridization of the carbon atoms, making it possible to observe atomic resolution in both the attractive and the repulsive regime although with inverted contrast. Regarding STM images, we show that in the near-contact regime, due to current saturation, bright spots correspond to hollow positions instead of atomic sites, providing an explanation for the most common hexagonal pattern found in the experiments.
- Received 17 November 2010
DOI:https://doi.org/10.1103/PhysRevLett.106.176101
© 2011 American Physical Society
Viewpoint
Proper carbon ID required
Published 25 April 2011
Simulations provide a guide to identifying atoms in high-resolution images of carbon nanomaterials.
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