131
Views
5
CrossRef citations to date
0
Altmetric
Original Articles

Nearest neighbour considerations in Stillinger-Weber type potentials for diamond

, &
Pages 761-771 | Published online: 26 Oct 2010

References

  • Stillinger , F.H. and Weber , T.A. 1985 . "Computer simulation of local order in condensed phases of silicon" . Phys. Rev. B , 31 : 5262
  • Kluge , M.D. , Ray , J.R. and Rahman , A. 1986 . "Molecular dynamic calculation of elastic constants of silicon" . J. Chem. Phys. , 85 : 4028
  • Metiu , H. , Weakliem , P.C. and Zhang , Z. 1995 . "Missing dimer vacancies ordering on the Si(100) surface" . Surf. Sci. , 336 : 303
  • Stephenson , P.C.L. , Radny , M.W. and Smith , P.V. 1996 . "A modified Stillinger-Weber potential for modeling silicon surfaces" . Surf. Sci. , 366 : 177
  • Ding , K. and Andersen , H.C. 1986 . "Molecular dynamics simulation of amorphous germanium" . Phys. Rev. B , 34 : 6987
  • Laradji , M. , Landau , D.P. and Dunweg , B. 1995 . "Structural properties of Si(1-x)Ge(x) alloys: a Monte Carlo simulation with the Stillinger-Weber potential" . Phys. Rev. B , 51 : 4894
  • Stillinger , F.H. and Weber , T.A. 1989 . "Fluorination of the dimerized Si(100) surface studies by molecular dynamics simulation" . Phys. Rev. Lett. , 62 : 2144
  • Kohen , D. , Tully , J.C. and Stillinger , F.H. 1998 . "Modelling the interaction of hydrogen with silicon surfaces" . Surf. Sci. , 397 : 225
  • Balamane , H. , Halicioglu , T. and Tiller , W.A. 1992 . "Comparative study of silicon empirical interatomic potentials" . Phys. Rev. B , 46 (4) : 2250
  • Pearson , E. , Takai , T. , Halicioglu , T. and Tiller , W.A. 1984 . "Computer modeling of Si and SiC surfaces and surface processes relevant to crystal growth from the vapor" . J. Cryst. Growth , 70 : 33
  • Biswas , R. and Hamann , D.R. 1987 . "New classical models for silicon structural energies" . Phys. Rev. B , 36 : 6434
  • Dodson , B.W. 1987 . "Development of a many-body Tersoff-type potential for silicon" . Phys. Rev. B , 35 : 2795
  • Tersoff , J. 1988 . "Empirical interatomic potential for silicon with improved elastic properties" . Phys. Rev. B , 28 (14) : 9902
  • Bazant , M.Z. , Xaxiras , E. and Justo , J.F. 1997 . "Environment-dependent interatomic potential for bulk silicon" . Phys. Rev. B , 56 : 8542
  • Tersoff , J. 1988 . "Empirical interatomic potential for carbon, with applications to amorphous-carbon" . Phys. Rev. Lett. , 61 : 2879
  • Marks , N.A. 2000 . "Generalizing the environment-dependent interaction potential for Carbon" . Phys. Rev. B , 63 : 35401
  • Brenner , D.W. 1990 . "Empirical potential for hydrocarbons for use in simulating the chemical vapor deposition of diamond films" . Phys. Rev. B , 42 : 9458
  • Mahon , P. , Pailthorpe , B.A. and Bacskay , G.B. 1991 . "A quantum mechanical calculation of interatomic interactions in diamond" . Phil. Mag. B , 63 (6) : 1419 – 1430 .
  • Barnard , A.S. and Russo , S.P. 2001 . "Development of an improved Stillinger-Weber potential for tetrahedral carbon using ab initio (Hartree-Fock and MP2) methods" . Mol. Phys. , Submitted for Publication
  • Drexler , K.E. 1992 . Nanosystems: Molecular, Machinery, Manufacturing and Computation , New York : Wiley .
  • Barnard, A.S., Honours Thesis (Royal Melbourne Institute of Technology)
  • Cowley , E.R. 1988 . "Lattice dynamics of silicon with empirical many-body potentials" . Phys. Rev. Lett. , 60 : 2379
  • Wendel , H. and Martin , R.M. 1979 . "Theory of structural properties of covalent semiconductors" . Phys. Rev. B , 19 : 5251
  • McDonough , A. , Russo , S.P. and Snook , I.K. 2001 . "Long time behaviour of the velocity autocorrelation function for a moderately dense, soft-repulsive and Lennard Jones fluid" . Phys. Rev. E , 63 : 26109
  • Wang , C.Z. and Ho , K.M. 1993 . "Structure, dynamics, and electronic properties of diamondlike amorphous carbon" . Phys. Rev. Lett. , 71 : 1184
  • Windl , W. , Pavone , P. , Karch , K. , Schütt , O. , Strauch , D. , Giannozzi , P. and Baroni , S. 1993 . "Ab initio lattice dynamics of diamond" . Phys. Rev. B , 48 : 3164
  • Leach , G.I. 1996 . "Advances on molecular CAD" . Nanotechnology , 7 (3) : 197
  • Rapaport , D.C. 1995 . The Art of Molecular Dynamics Simulation , Cambridge, MA : Cambridge University Press .
  • Haile , J.M. 1992 . Molecular Dynamics Simulation , New York : Wiley .
  • Simmons , G. and Wang , H. 1971 . Single Crystal Elastic Constants and Calculated Aggregate Properties: A Handbook , Cambridge, MA : MIT .
  • Dolling , G. 1963 . Inelastic Scattering of Neutrons in Solids and Liquids , 2 Vienna : IAEA .
  • Gildenblat , G.Sh. and Schmidt , P.E. 1996 . Handbook Series on Semiconductor Parameters , Edited by: Levinshtein , M. , Rumyantsev , S. and Shur , M. 1 London : World Scientific .
  • Warren , J.L. , Yarnell , J.L. , Dolling , G. and Cowley , R.A. 1967 . "Lattice dynamics of diamond" . Phys. Rev. B , 158 : 805

Reprints and Corporate Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

To request a reprint or corporate permissions for this article, please click on the relevant link below:

Academic Permissions

Please note: Selecting permissions does not provide access to the full text of the article, please see our help page How do I view content?

Obtain permissions instantly via Rightslink by clicking on the button below:

If you are unable to obtain permissions via Rightslink, please complete and submit this Permissions form. For more information, please visit our Permissions help page.