Small germanium sulfide clusters: mass spectrometry and density functional calculations

被引:4
|
作者
BelBruno, Joseph J. [1 ]
Burnin, Andrei
机构
[1] Dartmouth Coll, Ctr Nanomat Res, Hanover, NH 03755 USA
关键词
LASER-ABLATION; AB-INITIO; SULFUR; IONS; MOLECULES;
D O I
10.1039/c003704d
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Germanium sulfide clusters were generated by laser ablation of a solid sample. The resulting molecules were analyzed in a time-of-flight mass spectrometer. In addition to atomic germanium and diatomic sulfur, the spectra exhibited evidence for the existence of clusters containing up to four germanium atoms. Unlike the more commonly observed log-normal distribution of clusters as a function of cluster size, the abundance and even the appearance of a particular cluster appeared to depend upon the likelihood of forming the cluster from a smaller molecule. The potential structures of the observed clusters were computationally investigated using a density-functional approach.
引用
收藏
页码:8557 / 8563
页数:7
相关论文
共 50 条
  • [31] Geometries and stabilities of chromium doped nitrogen clusters: mass spectrometry and density functional theory studies
    Jiang, Zaifu
    Fu, Peixin
    Chen, Meicheng
    Chen, Chen
    Chen, Bole
    Dai, Wei
    Ding, Kewei
    Lu, Cheng
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2024, 26 (20) : 14538 - 14546
  • [32] A density functional study of small nickel clusters
    Michelini, MC
    Diez, RP
    Jubert, AH
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1998, 70 (4-5) : 693 - 701
  • [33] A DENSITY FUNCTIONAL STUDY OF SMALL NIOBIUM CLUSTERS
    Alvarado-Leyva, Pedro G.
    Sosa-Hernandez, Elisa M.
    SURFACE REVIEW AND LETTERS, 2009, 16 (06) : 815 - 820
  • [34] Density functional study of small molybdenum clusters
    Diez, RP
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2000, 76 (01) : 105 - 112
  • [35] Density Functional Approach: To Study Copper Sulfide Nanoalloy Clusters
    Ranjan, Prabhat
    Chakraborty, Tanmoy
    ACTA CHIMICA SLOVENICA, 2019, 66 (01) : 173 - 181
  • [36] Density functional calculations of the hyperpolarisabilities of small molecules
    Cohen, AJ
    Handy, NC
    Tozer, DJ
    CHEMICAL PHYSICS LETTERS, 1999, 303 (3-4) : 391 - 398
  • [37] Density functional studies of small platinum clusters
    Yang, SH
    Drabold, DA
    Adams, JB
    Ordejon, P
    Glassford, K
    JOURNAL OF PHYSICS-CONDENSED MATTER, 1997, 9 (05) : L39 - L45
  • [38] Impact of oxygen on the diffusion of silicon in germanium: density functional theory calculations
    Chroneos, Alexander
    Bracht, Hartmut
    SEMICONDUCTOR SCIENCE AND TECHNOLOGY, 2010, 25 (04)
  • [39] A computational investigation of copper-doped germanium and germanium clusters by the density-functional theory
    Wang, J
    Han, JG
    JOURNAL OF CHEMICAL PHYSICS, 2005, 123 (24): : 1 - 12
  • [40] Supercell and cluster density functional calculations of the thermal stability of the divacancy in germanium
    Janke, C.
    Jones, R.
    Coutinho, J.
    Oeberg, S.
    Briddon, P. R.
    MATERIALS SCIENCE IN SEMICONDUCTOR PROCESSING, 2006, 9 (4-5) : 484 - 488