Molecular simulation of the adsorption of rod/coil blends on nano-patterned surfaces

Abdullah Al Sunaidi*

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

4 Scopus citations

Abstract

The adsorption of rod/coil blends onto patterned surfaces with periodic stripes of width w was simulated using Monte-Carlo methods. The rods and the coils were taken to be fused monomers of diameter σ, interacting with the stripes by a square-well potential of depth ε and width σ. When the interaction was through excluded-volume interactions only, we observed segregation of the components in the adsorbed layer. The adsorbed rods are strongly aligned along the stripe for w = σ, but lose their orientational order for larger w. When a repulsive interaction between the rods and the coils was introduced, an increase in the surface coverage of the rods with better recognition of the stripes was observed.

Original languageEnglish
Pages (from-to)319-324
Number of pages6
JournalMacromolecular Theory and Simulations
Volume17
Issue number6
DOIs
StatePublished - 25 Aug 2008

Keywords

  • Monte Carlo simulation
  • Patterned surfaces
  • Polymer adsorption
  • Polymer segregation
  • Rod-coil

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Organic Chemistry
  • Polymers and Plastics
  • Inorganic Chemistry
  • Materials Chemistry

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