Molecular dynamics simulation of the dynamics of supercooled silica

被引:63
作者
Horbach, J [1 ]
Kob, W [1 ]
Binder, K [1 ]
机构
[1] Johannes Gutenberg Univ Mainz, Inst Phys, D-55099 Mainz, Germany
来源
PHILOSOPHICAL MAGAZINE B-PHYSICS OF CONDENSED MATTER STATISTICAL MECHANICS ELECTRONIC OPTICAL AND MAGNETIC PROPERTIES | 1998年 / 77卷 / 02期
关键词
D O I
10.1080/13642819808204955
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We present the results of a large-scale computer simulation of supercooled silica. We find that at high temperatures the diffusion constants show a non-Arrhenius temperature dependence, whereas at low temperature this dependence is compatible with an Arrhenius law. We demonstrate that at low temperatures the intermediate scattering function shows a two-step relaxation behaviour and that it obeys the time-temperature superposition principle. We also discuss the wave-vector dependence of the non-ergodicity parameter and the time and temperature dependences of the non-Gaussian parameter.
引用
收藏
页码:297 / 303
页数:7
相关论文
共 25 条
  • [1] Angell CA, 1985, RELAXATION COMPLEX S
  • [2] BARRAT JL, 1991, ANNU REV PHYS CHEM, V42, P23, DOI 10.1146/annurev.physchem.42.1.23
  • [3] DIFFUSION OF SILICON IN AMORPHOUS SILICA
    BREBEC, G
    SEGUIN, R
    SELLA, C
    BEVENOT, J
    MARTIN, JC
    [J]. ACTA METALLURGICA, 1980, 28 (03): : 327 - 333
  • [4] LOW-FREQUENCY MODES IN VITREOUS SILICA
    BUCHENAU, U
    PRAGER, M
    NUCKER, N
    DIANOUX, AJ
    AHMAD, N
    PHILLIPS, WA
    [J]. PHYSICAL REVIEW B, 1986, 34 (08): : 5665 - 5673
  • [5] Neutron scattering evidence for localized soft modes in amorphous polymers
    Buchenau, U
    Pecharroman, C
    Zorn, R
    Frick, B
    [J]. PHYSICAL REVIEW LETTERS, 1996, 77 (04) : 659 - 662
  • [6] Slow dynamics of water molecules in supercooled states
    Gallo, P
    Sciortino, F
    Tartaglia, P
    Chen, SH
    [J]. PHYSICAL REVIEW LETTERS, 1996, 76 (15) : 2730 - 2733
  • [7] RELAXATION PROCESSES IN SUPERCOOLED LIQUIDS
    GOTZE, W
    SJOGREN, L
    [J]. REPORTS ON PROGRESS IN PHYSICS, 1992, 55 (03) : 241 - 376
  • [8] GOTZE W, 1991, LIQUIDS FREEZING GLA
  • [9] Finite size effects in simulations of glass dynamics
    Horbach, J
    Kob, W
    Binder, K
    Angell, CA
    [J]. PHYSICAL REVIEW E, 1996, 54 (06) : R5897 - R5900
  • [10] HORBACH J, 1997, IN PRESS