Steinmann, P.; Smith, Ana-Sunčana; Birang, E.; McBride, A.; Javili, A. (2021) Atomistic two-, three- and four-body potentials. Spatial and material settings. Journal of the Mechanics and Physics of Solids, 154 . ISSN 0022-5096
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Official URL: https://www.sciencedirect.com/science/article/pii/...
Abstract
In molecular dynamics or molecular statics (MD/MS) multi-body potentials empirically capture the energetic interactions in atomistic system senabling the computation of the corresponding atomistic forces as energetic conjugates to the atomistic positions.
| Item Type: | Article |
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| Uncontrolled Keywords: | MD/MS ; atomistic forces ; atomistic potential |
| Subjects: | NATURAL SCIENCES > Physics NATURAL SCIENCES > Physics > Condensed Matter Physics |
| Divisions: | Division of Physical Chemistry |
| Depositing User: | Ana Sunčana Smith |
| Date Deposited: | 11 Nov 2021 05:52 |
| URI: | http://fulir.irb.hr/id/eprint/6569 |
| DOI: | 10.1016/j.jmps.2021.104507 |
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