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https://dspace.iiti.ac.in/handle/123456789/7774
| Title: | Stability analysis of zigzag boron nitride nanoribbons |
| Authors: | Rai, Hari Mohan Kumar, Rajesh Sagdeo, Pankaj R. |
| Issue Date: | 2015 |
| Publisher: | American Institute of Physics Inc. |
| Citation: | Rai, H. M., Late, R., Saxena, S. K., Kumar, R., Sagdeo, P. R., Jaiswal, N. K., & Srivastava, P. (2015). Stability analysis of zigzag boron nitride nanoribbons. Paper presented at the AIP Conference Proceedings, , 1661 doi:10.1063/1.4915414 |
| Abstract: | We have explored the structural stability of bare and hydrogenated zigzag boron nitride nanoribbons (ZBNNRs). In order to investigate the structural stability, we calculate the cohesive energy for bare, one-edge and both edges H-terminated ZBNNRs with different widths. It is found that the ZBNNRs with width Nz=8 are energetically more favorable than the lower-width counterparts (Nz<8). Bare ZBNNRs have been found energetically most stable as compared to the edge terminated ribbons. Our analysis reveals that the structural stability is a function of ribbon-width and it is not affected significantly by the type of edge-passivation (one-edge or both-edges). © 2015 AIP Publishing LLC. |
| URI: | https://doi.org/10.1063/1.4915414 https://dspace.iiti.ac.in/handle/123456789/7774 |
| ISBN: | 9.78074E+12 |
| ISSN: | 0094-243X |
| Type of Material: | Conference Paper |
| Appears in Collections: | Department of Physics |
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