Modification of structural and chemisorption properties of small palladium clusters supported on the MgO(0 0 1) surface from density functional calculations

被引：0
作者：
Neyman, Konstantin M.
Roesch, Notker
Pacchioni, Gianfranco
机构：
来源：
Applied Catalysis A:General | 2000年 / 191卷 / 01期
关键词：
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
页码：3 / 13
相关论文
共 50 条
  • [31] Probing the geometric structures and bonding properties in Nb2Si20 -/0 clusters by density functional theory calculations
    Lu, Sheng-Jie
    Wu, Li-Shun
    Lin, Feng
    CHEMICAL PHYSICS LETTERS, 2018, 709 : 60 - 64
  • [32] Theoretical investigation on SiC(1 1 1)/Al4C3(0 0 0 1) interface using density functional theory calculations
    Li, Jian
    Cui, Youming
    Chen, Yuanbo
    Lv, Xianghong
    Luo, Xian
    MATERIALS TODAY COMMUNICATIONS, 2019, 21
  • [33] Density functional study of structural and electronic properties of cube-like MgO clusters
    Chem Phys Lett, 1-2 (53):
  • [34] A density functional study on adsorption and dissociation of O2 on Ir(1 0 0) surface
    Erikat, I. A.
    Hamad, B. A.
    Khalifeh, J. M.
    CHEMICAL PHYSICS, 2011, 385 (1-3) : 35 - 40
  • [35] Structural, magnetic, and electronic properties of small M -Pt (M = Fe, Co, and Ni) clusters: Insight from density -functional calculations
    Li, Lei
    Huang, Rao
    Zhang, Yang
    Wen, Yuhua
    JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS, 2020, 512
  • [36] Geometries and electronic properties of NbnV(0, ±1) (n = 1−6) clusters studied by density-functional theory
    X. X. Jin
    J. G. Du
    G. Jiang
    X. Luo
    X. W. Wang
    The European Physical Journal D, 2011, 64 : 323 - 329
  • [37] Density functional study of the structural and electronic properties of tetra-aluminum oxide [image omitted] (3 n 8,=0,-1) clusters
    Zhong, Ming-Min
    Kuang, Xiao-Yu
    Wang, Huai-Qian
    Li, Hui-Fang
    Zhao, Ya-Ru
    MOLECULAR PHYSICS, 2011, 109 (04) : 603 - 612
  • [38] Unique Structural and Functional Properties of A1A0 ATPase/Synthase from Archaea
    Vidova, Monika
    Smigan, Peter
    CHEMICKE LISTY, 2010, 104 (05): : 309 - 317
  • [39] Density functional study of structures, stabilities and electronic properties of AgAunA (A=0,+1; n=1 12) clusters: comparison with pure gold clusters
    Ranjan, Prabhat
    Chakraborty, Tanmoy
    Kumar, Ajay
    MATERIALS SCIENCE-POLAND, 2020, 38 (01): : 97 - 107
  • [40] Geometric and magnetic properties of Pt clusters supported on graphene: Relativistic density-functional calculations
    Blonski, Piotr
    Hafner, Juergen
    JOURNAL OF CHEMICAL PHYSICS, 2011, 134 (15)
12345