Atomistic simulation of structure and dynamics of columnar phases of hexabenzocoronene derivatives

Details Atomistic simulation of structure and dynamics of columnar phases of hexabenzocoronene derivatives Atomistic simulation of structure and dynamics of columnar phases of hexabenzocoronene derivatives

2006-07-27

arxiv.org/abs/cond-mat/0607713v1

Physics

Condensed Matter

Soft Condensed Matter

Scientific paper

10.1063/1.2354156

Using atomistic molecular dynamics simulations we study solid and liquid
crystalline columnar discotic phases formed by alkyl-substituted
hexabenzocoronene mesogens. Correlations between the molecular structure,
packing, and dynamical properties of these materials are established.

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