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Document type:
Journal Article 
Author(s):
Bar, M.; Dinh, P. M.; Moskaleva, L. V.; Reinhard, P. G.; Rosch, N.; Suraud, E. 
Title:
Modeling of the deposition of Na Clusters on MgO(001) 
Abstract:
We investigate the dynamics of deposition of small Na clusters on MgO(001) surface. A hierarchical modeling is used combining quantum mechanical with molecular mechanical description. Full time-dependent density-functional theory is used for the cluster electrons while the substrate atoms are treated at a classical level. We consider Na(6) and Na(8) at various impact energies. We analyze the dependence on cluster geometry, trends with impact energy, and energy balance. We compare the results wit...    »
 
Congress title:
ISI Document Delivery No.: 526RP Times Cited: 5 Cited Reference Count: 59 Baer, M. Dinh, P. M. Moskaleva, L. V. Reinhard, P. -G. Roesch, N. Suraud, E. Moskaleva, Lyudmila/D-1889-2012 5 Amer physical soc College pk 
Journal title:
Physical Review B 
Year:
2009 
Journal volume:
80 
Journal issue:
19 
Pages contribution:
12