Application of lattice dynamics and molecular dynamics techniques to minerals and their surfaces

被引:17
|
作者
Parker, SC [1 ]
de Leeuw, NH
Bourova, E
Cooke, DJ
机构
[1] Univ Bath, Dept Chem, Bath BA2 7AY, Avon, England
[2] Univ Reading, Dept Chem, Reading RG6 6AD, Berks, England
来源
MOLECULAR MODELING THEORY: APPLICATIONS IN THE GEOSCIENCES | 2001年 / 42卷
关键词
D O I
10.2138/rmg.2001.42.3
中图分类号
P3 [地球物理学]; P59 [地球化学];
学科分类号
0708 ; 070902 ;
摘要
[No abstract available]
引用
收藏
页码:63 / 82
页数:20
相关论文
共 50 条
  • [21] Molecular Dynamics: from basic techniques to applications (A Molecular Dynamics Primer)
    Hernandez, E. R.
    EAV08: ADVANCED SUMMER SCHOOL IN PHYSICS 2008: FRONTIERS IN CONTEMPORARY PHYSICS, 4TH EDITION, 2008, 1077 : 95 - 123
  • [22] A parallel molecular dynamics algorithm for polycrystalline minerals
    Yerraguntla, V
    Karki, BB
    Kikuchi, H
    Saini, S
    MSV '05: PROCEEDINGS OF THE 2005 INTERNATIONAL CONFERENCE ON MODELING, SIMULATION AND VISUALIZATION METHODS, 2005, : 201 - 207
  • [23] STATIC LATTICE ENERGY MINIMIZATION AND LATTICE-DYNAMICS CALCULATIONS ON ALUMINOSILICATE MINERALS
    WINKLER, B
    DOVE, MT
    LESLIE, M
    AMERICAN MINERALOGIST, 1991, 76 (3-4) : 313 - 331
  • [24] A molecular dynamics study of uranyl-carbonate complexes adsorbed on basal surfaces of clay minerals
    Li L.
    Liu X.
    Lu X.
    Chinese Journal of Geochemistry, 2015, 34 (2): : 143 - 155
  • [25] Hybrid molecular dynamics for lattice supersymmetry
    Donini, A
    Guagnelli, M
    PHYSICS LETTERS B, 1996, 383 (03) : 301 - 306
  • [26] LATTICE DYNAMICS OF SIMPLE MOLECULAR CRYSTALS
    DONKERSLOOT, MC
    WALMSLEY, SH
    MOLECULAR PHYSICS, 1970, 19 (02) : 183 - +
  • [27] Dynamics of Ag clusters on complex surfaces: Molecular dynamics simulations
    Alkis, S.
    Krause, J. L.
    Fry, J. N.
    Cheng, H. -P.
    PHYSICAL REVIEW B, 2009, 79 (12)
  • [28] CLUSTER-BETHE LATTICE METHOD IN APPLICATION TO THE ATOM DYNAMICS OF CRYSTAL SURFACES.
    Kaminski, B.
    Kapelewski, J.
    Journal of Technical Physics, 1983, 24 (01): : 13 - 24
  • [29] MOLECULAR-DYNAMICS ON POROUS SURFACES
    DRAKE, JM
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1985, 189 (APR-): : 109 - PHYS
  • [30] DYNAMICS OF MOLECULAR-TRANSFORMATION AT SURFACES
    HO, W
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1985, 190 (SEP): : 129 - COL