Physics – Condensed Matter – Soft Condensed Matter
Scientific paper
2009-11-18
Liquid Crystals, 37, 45-56 (2010)
Physics
Condensed Matter
Soft Condensed Matter
9 figures. Accepted for publication in liquid crystals
Scientific paper
10.1080/02678290903362840
We use density--functional theory to study the structure of two-dimensional defects inside a circular nematic nanocavity. The density, nematic order parameter, and director fields, as well as the defect core energy and core radius, are obtained in a thermodynamically consistent way for defects with topological charge $k=+1$ (with radial and tangential symmetries) and $k=+1/2$. An independent calculation of the fluid elastic constants, within the same theory, allows us to connect with the local free--energy density predicted by elastic theory, which in turn provides a criterion to define a defect core boundary and a defect core free energy for the two types of defects. The radial and tangential defects turn out to have very different properties, a feature that a previous Maier--Saupe theory could not account for due to the simplified nature of the interactions --which caused all elastic constants to be equal. In the case with two $k=+1/2$ defects in the cavity, the elastic r\'egime cannot be reached due to the small radii of the cavities considered, but some trends can already be obtained.
las Heras Daniel de
Mederos Luis
Velasco Enrique
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