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Negatively curved graphitic sheet model of amorphous carbon
Abstract
A computational method has been developed for generating graphitic carbon structures on an arbitrary smooth surface and with a given number of carbon rings. Using both periodic and random surfaces for constraint, many extended graphitic carbon structures have been generated. The energy relative to graphite and the bulk elastic properties have been calculated. Like their periodic counterparts, the random structures are found to be exceptionally stable. Their radial distribution functions match closely those of films of amorphous carbon grown on NaCl substrates from sublimated graphite.
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Citations
Cited by
Georgakilas, V., Perman, J. A., Tucek, J., & Zboril, R. (2015) · Chemical Reviews · doi:10.1021/cr500304f · Cited by 2,147
Zhang, L., Zhang, F., Yang, X., Long, G., Wu, Y., Zhang, T., Leng, K., Huang, Y., Ma, Y., Yu, A., et al. (2013) · Scientific Reports · doi:10.1038/srep01408 · Cited by 721
Structural Analysis of Molecular Materials Using the Pair Distribution Function
Terban, M. W., & Billinge, S. J. L. (2022) · Chemical Reviews · doi:10.1021/acs.chemrev.1c00237 · Cited by 426
Tetrahedral bonding in amorphous carbon
McKenzie, D. R. (1996) · Reports on Progress in Physics · doi:10.1088/0034-4885/59/12/002 · Cited by 400
Carbogenic molecular sieves: synthesis, properties and applications
Foley, H. C. (1995) · Microporous Materials · doi:10.1016/0927-6513(95)00014-z · Cited by 254
Metadata
- Authors
- Townsend, S. J., Lenosky, T. J., Muller, D. A., Nichols, C. S., & Elser, V.
- Venue
- Physical Review Letters
- Publisher
- American Physical Society (APS)
- Published
- 1992-08-10
- Volume
- 69
- Issue
- 6
- Pages
- 921-924
- ISSN
- 0031-9007 (ISSN-L)
- OpenAlex
- W1999214184
- Cited by
- 236
- References
- 0
- FWCI
- 9.88
- Type
- journal article
- Language
- en
- Open access
- closed
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- Townsend, S. J., Lenosky, T. J., Muller, D. A., Nichols, C. S., & Elser, V. (1992). Negatively curved graphitic sheet model of amorphous carbon. Physical Review Letters. https://doi.org/10.1103/physrevlett.69.921
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Contains information from the Semantic Scholar Academic Graph Datasets, made available under the ODC Attribution License (ODC-BY 1.0).
Semantic Scholar’s data is described in: Kinney, R., et al. (2023). The Semantic Scholar Open Data Platform. arXiv:2301.10140.
