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Chinese Physics, 2003, Vol. 12(2): 164-168    DOI: 10.1088/1009-1963/12/2/308
ATOMIC AND MOLECULAR PHYSICS Prev   Next  

Time dependent density functional calculation of plasmon response in clusters

Wang Feng (王锋)a, Zhang Feng-Shou (张丰收)b, Eric Suraudc
a Center for Atomic and Molecular Nanoscience, Tsinghua University, Beijing 100084, China; b Institute of Modern Physics, Chinese Academy of Sciences, Lanzhou 730000, China; c Laboratoire de Physique Quantique, Université Paul Sabatier, 118 route de Narbonne, 31062 Toulouse Cedex, France
Abstract  We have introduced a theoretical scheme for the efficient description of the optical response of a cluster based on the time-dependent density functional theory. The practical implementation is done by means of the fully fledged time-dependent local density approximation scheme, which is solved directly in the time domain without any linearization. As an example we consider the simple Na2 cluster and compute its surface plasmon photoabsorption cross section, which is in good agreement with the experiments.
Keywords:  optical response of cluster      time-dependent density functional theory  
Received:  02 May 2002      Revised:  14 October 2002      Accepted manuscript online: 
PACS:  61.46.-w (Structure of nanoscale materials)  
  71.15.Mb (Density functional theory, local density approximation, gradient and other corrections)  
  73.20.Mf (Collective excitations (including excitons, polarons, plasmons and other charge-density excitations))  

Cite this article: 

Wang Feng (王锋), Zhang Feng-Shou (张丰收), Eric Suraud Time dependent density functional calculation of plasmon response in clusters 2003 Chinese Physics 12 164

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