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20162021
most citedDensity-functional calculations of multivalency-driven formation of Te-based monolayer materials with superior electronic and optical properties

566 citations · 1.1k across the 19 of their papers we have counts for

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physics.comp-ph2016★ 33 cited

Spin-orbit coupling effects on the stability of two competing structures in Pb/Si(111) and Pb/Ge(111)

Xiao-Yan Ren, Hyun-Jung Kim, Seho Yi +2

Using first-principles density-functional theory (DFT) calculations, we investigate the 4/3-monolayer structure of Pb on the Si(111) or Ge(111) surface within the two competing str…