The regulation effect of coordination number on the conductance of single-molecule junctions

Qiang Wan, Hong-Yang Guo,Yi-Fan Zhou, Jia-Nan Jiang,Wenbo Chen,Ju-Fang Zheng,Yong Shao,Ya-Hao Wang,Xiao-Shun Zhou

JOURNAL OF MATERIALS CHEMISTRY C(2023)

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摘要
Combining the STM break junction technique and theoretical simulation, we report that the presence of multiple anchoring sites leads to different configurations of single-molecule junctions by changing the interfacial coordination numbers. These distinct variations in electronic structures cause their conductance to change by about 2500-fold. The molecules with multiple anchoring sites offer opportunities for conductance regulation of single-molecule junctions via a switch between different coordination numbers.
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