Theoretical insights into the structural, relative stable, electronic, and gas sensing properties of Pb n Au n (n = 2–12) clusters: a DFT study

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Abstract
The structural, relative stable and electronic properties of Pb n Au n ( n = 2–12) clusters are the first time to be reported, and Pb n Au n ( n = 4, 6, 8) clusters may serve as gas sensors.
Funding Information
  • National Natural Science Foundation of China (51664032)
  • National Natural Science Foundation of China (U1502271)
  • Yunnan Provincial Science and Technology Department (2014HA003)
  • Ministry of Science and Technology (2014RA4018)
  • Ministry of Education of the People's Republic of China (IRT_17R48)

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