Fig. 9: Structural characterization of Au239(SR)69 nanocluster.
From: Thermal dynamics and coalescence of Au144(SR)60 clusters from a machine-learned potential
a Computed PXRD function (blue) for the optimized Au239(SR)69 cluster compared to the measured PRXD data (red) for the Au210−230 (pMBA)70−80 compound. b the 50-atom inner core, indicating an FCC stacking fault and c the full structure of the Au239(SR)69 cluster, with the identified surface gold-thiolate moieties listed. Source data are provided as a Source Data file.
