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4
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0025384937
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R. G. Hoagland, M. S. Daw, S. M. Foiles, and M. I. Baskes, J. Mater. Res. 5, 313 (1990).
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Hoagland, R.G.1
Daw, M.S.2
Foiles, S.M.3
Baskes, M.I.4
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8
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0001100863
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Materials Research Society R. W. Siegel, J. R. Weertman, and R. Sinclair
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A. F. Voter and S. P. Chen, in Characterization of Defects in Materials, edited by R. W. Siegel, J. R. Weertman, and R. Sinclair, MRS Symposia Proceedings No. 82 (Materials Research Society, Pittsburgh, 1987), p. 175.
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Voter and, A.F.1
Chen, S.P.2
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10
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0001552123
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V. B. Deyirmenjian, V. Heine, M. C. Payne, V. Milman, R. M. Lynden-Bell, and M. W. Finnis, Phys. Rev. B 52, 15 191 (1995).
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Deyirmenjian, V.B.1
Heine, V.2
Payne, M.C.3
Milman, V.4
Lynden-Bell, R.M.5
Finnis, M.W.6
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12
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85037919950
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This potential is (Formula presented) with (Formula presented) (Formula presented) and (Formula presented)
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This potential is (Formula presented) with (Formula presented) (Formula presented) and (Formula presented)
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-
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13
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85037873502
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The binding energy and vibrational energy of (Formula presented) the (111) homodiffusion barrier, the adsorption energy per atom on Al (111), and the binding energy of (Formula presented) on Al (111) with respect to isolated adatoms are (Formula presented) (Formula presented) 0.04 eV, 2.42 eV, and 0.50 eV. They compare very well with the reference values (all ab initio values from Ref. 13 unless otherwise specified) (Formula presented) (Formula presented) experimental, Ref. 16), (Formula presented) (experimental, Ref. 15), 0.04 eV, 3.06 eV, and 0.58 eV. The local-density approximation (LDA) adsorption energy is larger than ours due to the known LDA overbinding, but the two values agree well when expressed in percentage of the bulk binding energy (Formula presented)
-
The binding energy and vibrational energy of (Formula presented) the (111) homodiffusion barrier, the adsorption energy per atom on Al (111), and the binding energy of (Formula presented) on Al (111) with respect to isolated adatoms are (Formula presented) (Formula presented) 0.04 eV, 2.42 eV, and 0.50 eV. They compare very well with the reference values (all ab initio values from Ref. 13 unless otherwise specified) (Formula presented) (Formula presented) experimental, Ref. 16), (Formula presented) (experimental, Ref. 15), 0.04 eV, 3.06 eV, and 0.58 eV. The local-density approximation (LDA) adsorption energy is larger than ours due to the known LDA overbinding, but the two values agree well when expressed in percentage of the bulk binding energy (Formula presented)
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19
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36549091815
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Z. Fu, G. W. Lemire, G. A. Bishea and M. D. Morse, J. Chem. Phys. 93, 8420 (1990).
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Fu, Z.1
Lemire, G.W.2
Bishea, G.A.3
Morse, M.D.4
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20
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-
85037888364
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-
The local normal at the impact site is defined as the direction connecting the impact point to the center of mass of the atoms contained in a circle centered on the impact point and with radius of 10 grid spacings.
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The local normal at the impact site is defined as the direction connecting the impact point to the center of mass of the atoms contained in a circle centered on the impact point and with radius of 10 grid spacings.
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24
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85037914224
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This is due in part to the intrinsic asymmetry produced by the choice of the closest highest-coordination site among those within the (Formula presented) circle.
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This is due in part to the intrinsic asymmetry produced by the choice of the closest highest-coordination site among those within the (Formula presented) circle.
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25
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0004073261
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), and references therein] that the binding energy of metals in a structure with local coordination (Formula presented) is given semiquantitatively by (Formula presented) with (Formula presented) and (Formula presented) constants.
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It is known [see, e.g., M. Methfessel, D. Hennig, and M. Scheffler, Appl. Phys. A: Solids Surf. 55, 442 (1995), and references therein] that the binding energy of metals in a structure with local coordination (Formula presented) is given semiquantitatively by (Formula presented) with (Formula presented) and (Formula presented) constants.
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Appl. Phys. A: Solids Surf.
, vol.55
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Methfessel, M.1
Hennig, D.2
Scheffler, M.3
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28
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0029370638
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L. J. Friedrich, S. K. Dew, M. Brett, and T. Smy, Thin Solid Films 226, 83 (1995);
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Thin Solid Films
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Friedrich, L.J.1
Dew, S.K.2
Brett, M.3
Smy, T.4
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29
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0345420167
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S. S. Winterton, T. Smy, S. K. Dew, and M. J. Brett, J. Appl. Phys. 78, 3572 (1995);
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Winterton, S.S.1
Smy, T.2
Dew, S.K.3
Brett, M.J.4
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30
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5344257548
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L. J. Friedrich, D. S. Gardner, S. K. Dew, M. J. Brett, and T. Smy, J. Vac. Sci. Technol. B 15, 1780 (1997).
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Friedrich, L.J.1
Gardner, D.S.2
Dew, S.K.3
Brett, M.J.4
Smy, T.5
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