OpenKIM Username: aklemenz
OpenKIM User ID: 1bdb5831-fd4b-4323-ac78-6796c7c36d58
Description of Work —
Tersoff-Brenner type reactive bond order potentials with screening functions for realistic description of bond breaking forces.
Materials
Si,C
Bibliography
L. Pastewka, A. Klemenz, P. Gumbsch, M. Moseler, "Screened empirical bond-order potentials for Si-C", Phys. Rev. B 87 (2013) 205410
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