Molecular-dynamics simulation of Ge rapidly cooled from the molten state into the amorphous state

被引:29
|
作者
Bording, JK [1 ]
机构
[1] Univ Oslo, Dept Phys, N-0316 Oslo, Norway
来源
PHYSICAL REVIEW B | 2000年 / 62卷 / 11期
关键词
D O I
10.1103/PhysRevB.62.7103
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We present molecular-dynamics simulations of the atomic arrangement in molten and amorphous germanium. We start with 512 atoms in a supercell and then heat it above the melting temperature. Subsequent rapid quenching results in a continuous random network (CRN) with a radial distribution function (RDF) in excellent agreement with the results from accurate diffraction experiments of other investigators. We analyze the topology of the molten and amorphous structures and present angular distribution functions, coordination number, and ring statistics.
引用
收藏
页码:7103 / 7109
页数:7
相关论文
共 50 条
  • [21] A COMPARATIVE DIELECTRIC STUDY ON THE MOLECULAR-DYNAMICS OF THE LIQUID-CRYSTALLINE AND THE AMORPHOUS STATE OF COPOLYESTERS
    AHUMADA, O
    EZQUERRA, TA
    NOGALES, A
    BALTACALLEJA, FJ
    ZACHMANN, HG
    MACROMOLECULAR RAPID COMMUNICATIONS, 1995, 16 (12) : 899 - 904
  • [22] DECOUPLING EFFECTS IN COMPUTER-SIMULATION OF LIQUID-STATE MOLECULAR-DYNAMICS
    EVANS, MW
    GRIGOLINI, P
    MARCHESONI, F
    CHEMICAL PHYSICS LETTERS, 1983, 95 (06) : 544 - 547
  • [23] BETA-RELAXATION IN A HIGHLY SUPERCOOLED STATE VIA MOLECULAR-DYNAMICS SIMULATION
    MURANAKA, T
    HIWATARI, Y
    PHYSICAL REVIEW E, 1995, 51 (04) : R2735 - R2738
  • [24] MOLECULAR-DYNAMICS OF PHYSICAL AGING IN THE GLASSY STATE
    SIMHA, R
    CURRO, JG
    ROBERTSON, RE
    POLYMER ENGINEERING AND SCIENCE, 1984, 24 (14): : 1071 - 1078
  • [25] Molecular-dynamics simulation of Ge film growth by cluster deposition
    Lu, HW
    Feng, JY
    MODELLING AND SIMULATION IN MATERIALS SCIENCE AND ENGINEERING, 2000, 8 (04) : 621 - 628
  • [26] MOLECULAR-DYNAMICS CALCULATION OF THE EQUATION OF STATE OF ALKANES
    TOXVAERD, S
    JOURNAL OF CHEMICAL PHYSICS, 1990, 93 (06): : 4290 - 4295
  • [27] UNDERSTANDING MOLECULAR-DYNAMICS QUANTUM-STATE BY QUANTUM-STATE
    LAWRANCE, WD
    MOORE, CB
    PETEK, H
    SCIENCE, 1985, 227 (4689) : 895 - 901
  • [28] CRACK-PROPAGATION IN AN AMORPHOUS SOLID - A MOLECULAR-DYNAMICS SIMULATION
    CHAKI, TK
    LI, JCM
    JOURNAL OF METALS, 1985, 37 (08): : A4 - A4
  • [29] MOLECULAR-DYNAMICS SIMULATION OF AMORPHOUS-SILICON WITH TERSOFF POTENTIAL
    OHIRA, T
    INAMURO, T
    ADACHI, T
    SOLAR ENERGY MATERIALS AND SOLAR CELLS, 1994, 34 (1-4) : 565 - 570
  • [30] MOLECULAR-DYNAMICS SIMULATION OF VAPOR-DEPOSITED AMORPHOUS ICE
    ESSMANN, U
    GEIGER, A
    JOURNAL OF CHEMICAL PHYSICS, 1995, 103 (11): : 4678 - 4692