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Title: Selective Facet Reactivity During Cation Exchange in Cadmium Sulfide Nanorods

Journal Article · · Journal of the American Chemical Society
OSTI ID:962717

The partial transformation of ionic nanocrystals through cation exchange has been used to synthesize nanocrystal heterostructures. We demonstrate that the selectivity for cation exchange to take place at different facets of the nanocrystal plays an important role in determining the resulting morphology of the binary heterostructure. In the case of copper I (Cu+) cation exchange in cadmium sulfide (CdS) nanorods, the reaction starts preferentially at the ends of the nanorods such that copper sulfide (Cu2S) grows inwards from either end. The resulting morphology is very different from the striped pattern obtained in our previous studies of silver I (Ag+) exchange in CdS nanorods where non-selective nucleation of silver sulfide (Ag2S) occurs. From interface formation energies calculated for several models of epitaxialconnections between CdS and Cu2S or Ag2S, we infer the relative stability of each interface during the nucleation and growth of Cu2S or Ag2S within the CdS nanorods. The epitaxial connections of Cu2S to the end facets of CdS nanorods minimize the formation energy, making these interfaces stable throughout the exchange reaction. However, as the two end facets of wurtzite CdS nanorods are crystallographically nonequivalent, asymmetric heterostructures can be produced.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)
Sponsoring Organization:
Computational Research Division; Materials Sciences Division
DOE Contract Number:
DE-AC02-05CH11231
OSTI ID:
962717
Report Number(s):
LBNL-1385E; JACSAT; TRN: US200916%%350
Journal Information:
Journal of the American Chemical Society, Vol. 131, Issue 14; ISSN 0002-7863
Country of Publication:
United States
Language:
English