[CPMD-list] nanocrystals

Prof. Sushil Auluck aulucfph at iitr.ernet.in
Sun Mar 27 06:49:01 CEST 2005


hi,
    could anyone let me know if you are using cpmd for doing
calculations of nanowires,quantum dots, etc where you have atoms
in say 1/1000 of the unit cell only and the remaining unit cell is empty.
    regards
    s.auluck

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  Prof. Sushil Auluck			Phone: +91-1332-274075(Home)        
  Department of Physics			       +91-1332-285010(Home)    	
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     						sauluck at gmail.com    
http://www.iitr.ernet.in/departments/PH/people/faculty/facthtml/aulucfph.htm
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