Development of a first-principles many-body potential for beryllium.

作者: Estela Blaisten-Barojas , S. N. Khanna

DOI: 10.1103/PHYSREVLETT.61.1477

关键词:

摘要:

参考文章(22)
I.L. Garzón, Estela Blaisten-Barojas, Effect of three-body interactions on the early stages of atomic cluster growth Chemical Physics Letters. ,vol. 124, pp. 84- 89 ,(1986) , 10.1016/0009-2614(86)85018-7
E. Blaisten-Barojas, O. Novaro, L.W. Bruch, Non-additive interactions in liquid helium solvent effects Molecular Physics. ,vol. 37, pp. 599- 606 ,(1979) , 10.1080/00268977900100471
L. W. Bruch, E. Blaisten‐Barojas, O. Novaro, Role of three‐body interactions in trimer binding The Journal of Chemical Physics. ,vol. 67, pp. 4701- 4705 ,(1977) , 10.1063/1.434637
B. M. Axilrod, E. Teller, Interaction of the van der Waals Type Between Three Atoms The Journal of Chemical Physics. ,vol. 11, pp. 299- 300 ,(1943) , 10.1063/1.1723844
Mark H. McAdon, William A. Goddard, Generalized valence bond studies of metallic bonding: naked clusters and applications to bulk metals The Journal of Physical Chemistry. ,vol. 91, pp. 2607- 2626 ,(1987) , 10.1021/J100294A032
Estela Blaisten-Barojas, D. Levesque, Molecular-dynamics simulation of silicon clusters Physical Review B. ,vol. 34, pp. 3910- 3916 ,(1986) , 10.1103/PHYSREVB.34.3910
B. P. Feuston, R. K. Kalia, P. Vashishta, Fragmentation of silicon microclusters: A molecular-dynamics study Physical Review B. ,vol. 35, pp. 6222- 6239 ,(1987) , 10.1103/PHYSREVB.35.6222
Frank H. Stillinger, Thomas A. Weber, Computer simulation of local order in condensed phases of silicon Physical Review B. ,vol. 31, pp. 5262- 5271 ,(1985) , 10.1103/PHYSREVB.31.5262
Krishnan Raghavachari, Theoretical study of small silicon clusters: Equilibrium geometries and electronic structures of Sin (n=2–7,10) Journal of Chemical Physics. ,vol. 84, pp. 5672- 5686 ,(1986) , 10.1063/1.449927
R. Car, M. Parrinello, Unified Approach for Molecular Dynamics and Density-Functional Theory Physical Review Letters. ,vol. 55, pp. 2471- 2474 ,(1985) , 10.1103/PHYSREVLETT.55.2471