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Calculations of electric and magnetic properties of triangular graphene fragments using density functional theory: Effects of edge functionalization and electric field
(Izmir Institute of Technology, 2013)
The triangular graphene flakes (N-TGFs) we consider have equilateral triangular shapes with zigzag edges, where N denotes the number of edge hexagonal cells in one side of the triangle. Termination of these N-TGF structures ...
Electric field controlled transport of water in graphene nano-channels
(American Institute of Physics Publishing, 2017-10)
Motivated by electrowetting-based flow control in nano-systems, water transport in graphene nano-channels is investigated as a function of the applied electric field. Molecular dynamics simulations are performed for deionized ...