The DOI matches its Crossref record; 13 of the 13 references it cites were found in a registry or an index.
Generalizing the environment-dependent interaction potential for carbon
Abstract
A transferable empirical potential for carbon is developed by extending the environment-dependent interaction potential proposed for silicon. Generalized coordination functions, parametrized using ab initio data, describe dihedral rotation, nonbonded $\ensuremath{\pi}$-repulsion and fractional coordination. Elastic constants agree well with experiment, and simulations of liquid carbon compare very favorably with Car-Parrinello calculations. Amorphous networks generated by liquid quench have properties superior to those of the Tersoff, Brenner, and orthogonal tight-binding methods.
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Cites
Brenner, D. W. (1990) · Physical Review B · doi:10.1103/physrevb.42.9458 · Cited by 4,030
Porezag, D., Frauenheim, T., Köhler, T., Seifert, G., & Kaschner, R. (1995) · Physical Review B · doi:10.1103/physrevb.51.12947 · Cited by 2,201
Empirical Interatomic Potential for Carbon, with Applications to Amorphous Carbon
Tersoff, J. (1988) · Physical Review Letters · doi:10.1103/physrevlett.61.2879 · Cited by 1,960
Empirical chemical pseudopotential theory of molecular and metallic bonding
Abell, G. C. (1985) · Physical Review B · doi:10.1103/physrevb.31.6184 · Cited by 519
Interatomic potential for silicon defects and disordered phases
Justo, J. F., Bazant, M. Z., Kaxiras, E., Bulatov, V. V., & Yip, S. (1998) · Physical Review B · doi:10.1103/physrevb.58.2539 · Cited by 464
Environment-dependent interatomic potential for bulk silicon
Bazant, M. Z., Kaxiras, E., & Justo, J. F. (1997) · Physical Review B · doi:10.1103/physrevb.56.8542 · Cited by 419
Structural and Electronic Properties of Amorphous Carbon
Galli, G., Martin, R. M., Car, R., & Parrinello, M. (1989) · Physical Review Letters · doi:10.1103/physrevlett.62.555 · Cited by 322
Doerner, R., Hübinger, B., & Martienssen, W. (1994) · Physical Review E · doi:10.1103/physreve.50.r12 · Cited by 297
Environment-dependent tight-binding potential model
Tang, M. S., Wang, C. Z., Chan, C. T., & Ho, K. M. (1996) · Physical Review B · doi:10.1103/physrevb.53.979 · Cited by 259
The Art and Science of an Analytic Potential
Brenner, D. W. (2000) · physica status solidi (b) · doi:10.1002/(sici)1521-3951(200001)217:1<23::aid-pssb23>3.0.co;2-n · Cited by 254
Cited by
Microscopic Simulations of Electrochemical Double-Layer Capacitors
Jeanmairet, G., Rotenberg, B., & Salanne, M. (2022) · Chemical Reviews · doi:10.1021/acs.chemrev.1c00925 · Cited by 303
Metadata
- Authors
- Marks, N. A.
- Venue
- Physical Review B
- Publisher
- American Physical Society (APS)
- Published
- 2000-12-22
- Volume
- 63
- Issue
- 3
- ISSN
- 0163-1829 (ISSN-L)
- 1095-3795
- OpenAlex
- W2017864353
- Cited by
- 329
- References
- 13
- FWCI
- 3.56
- Type
- journal article
- Language
- en
- Open access
- closed
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