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Where size matters
DOI: 10.1039/C2NR32517A, Paper
The energetics, structures and segregation of 98-atom AuPd nanoclusters have been investigated using a genetic algorithm global optimization technique with the Gupta empirical potential followed by local minimizations at the…
The content of this RSS Feed (c) The Royal Society of Chemistry
2012-11-24 12:41:11
Source: http://nanochemistry.blogspot.com/2012/11/dft-study-of-structures-and-energetics.html