Formation of metal vacancy arrays in coalesced WS2monolayer films

Danielle Reifsnyder Hickey, Dundar E. Yilmaz, Mikhail Chubarov, Saiphaneendra Bachu, Tanushree H Choudhury, Leixin Miao, Chenhao Qian, Joan M. Redwing, Adri C.T. Van Duin, Nasim Alem

Research output: Contribution to journalArticlepeer-review

8 Scopus citations


Defects have a profound impact on the electronic and physical properties of crystals. For two-dimensional (2D) materials, many intrinsic point defects have been reported, but much remains to be understood about their origin. Using scanning transmission electron microscopy imaging, this study discovers various linear arrays of W-vacancy defects that are explained in the context of the crystal growth of coalesced, monolayer WS2. Atomistic-scale simulations show that vacancy arrays can result from steric hindrance of bulky gas-phase precursors at narrowly separated growth edges, and that increasing the edge separation leads to various intact and defective growth modes, which are driven by competition between the catalytic effects of the sapphire substrate and neighboring growth edge. Therefore, we hypothesize that the arrays result from combined growth modes, which directly result from film coalescence. The connections drawn here will guide future synthetic and processing strategies to harness the engineering potential of defects in 2D monolayers.

Original languageEnglish (US)
Article number011003
Journal2D Materials
Issue number1
StatePublished - Jan 1 2021

All Science Journal Classification (ASJC) codes

  • General Chemistry
  • General Materials Science
  • Condensed Matter Physics
  • Mechanics of Materials
  • Mechanical Engineering


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