Isomerism in Au28(SR)20 Nanocluster and Stable Structures.
J Am Chem Soc
; 138(5): 1482-5, 2016 Feb 10.
Article
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| MEDLINE
| ID: mdl-26817394
ABSTRACT
Understanding the isomerism phenomenon at the nanoscale is a challenging task because of the prerequisites of precise composition and structural information on nanoparticles. Herein, we report the ligand-induced, thermally reversible isomerization between two thiolate-protected 28-gold-atom nanoclusters, i.e. Au28(S-c-C6H11)20 (where -c-C6H11 = cyclohexyl) and Au28(SPh-(t)Bu)20 (where -Ph-(t)Bu = 4-tert-butylphenyl). The intriguing ligand effect in dictating the stability of the two Au28(SR)20 structures is further investigated via dispersion-corrected density functional theory calculations.
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MEDLINE
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En
Revista:
J Am Chem Soc
Año:
2016
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Article
País de afiliación:
Estados Unidos