Javvaji, Brahmanandam and Budarapu, Pattabhi R. and Sutrakar, V. K. and Mahapatra, D. Roy and Paggi, Marco and Zi, Goangseup and Rabczuk, Timon Mechanical properties of Graphene: Molecular dynamics simulations correlated to continuum based scaling laws. Computational Materials Science, 125. pp. 319-326. ISSN 0927-0256 (2016)
Full text not available from this repository.Abstract
In this paper, the combined effect of domain size, lattice orientation and crack length on the mechanical properties of Graphene, namely the yield strength and strain, are studied extensively based on molecular dynamics simulations. Numerical predictions are compared with the continuum-based laws of size effect and multifractal scaling. The yield strength is found to vary with the specimen size as ≈L^{−1/3}, which is in agreement with the multifractal scaling law, and with the inverse square of the initial crack length as ≈a^{-1/2}, according to the Griffith’s energy criterion for fracture.
| Item Type: | Article |
|---|---|
| Identification Number: | https://doi.org/10.1016/j.commatsci.2016.08.016 |
| Additional Information: | SCOPUS ID: 2-s2.0-84987973879 |
| Projects: | ERC StG CA2PVM 306622 |
| Funders: | European Research Council |
| Uncontrolled Keywords: | Graphene fracture; Molecular dynamics; Size-scale effects; Size effect law; Multifractal scaling law; Lattice orientation effect |
| Subjects: | T Technology > TA Engineering (General). Civil engineering (General) |
| Research Area: | Computer Science and Applications |
| Depositing User: | Prof Marco Paggi |
| Date Deposited: | 27 Dec 2016 09:06 |
| Last Modified: | 27 Dec 2016 09:06 |
| URI: | http://eprints.imtlucca.it/id/eprint/3617 |
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