Abstract
We study the effect of flexibility and bend angle on systems of hard semiflexible boomerangs. These are modelled as two rodlike segments joined at one end with an angle that can fluctuate about a preferred angle. We use a second-virial theory for semiflexible chains with two segments, and numerically solve for the full orientation distribution function as a function of the four angles that determine the boomerang's orientation. We plot the single segment distributions as a function of two angles as well as the interarm angle distribution. For stiff boomerangs, we find prolate, oblate and biaxial nematic phases depending on the bend angle and density, in partial agreement with previous results on rigid boomerangs. For the case that the preferred interarm angle is 90º, however, we find that the biaxial nematic phase has four-fold rather than two-fold rotational symmetry, and thus requires fourth-rank order parameters to describe it. In addition, we find that flexibility drastically reduces the region of stability for the biaxial nematic phase, with the prolate nematic becoming more favourable.
| Original language | English |
|---|---|
| Pages (from-to) | 2812-2822 |
| Number of pages | 11 |
| Journal | Molecular Physics |
| Volume | 116 |
| Issue number | 21-22 |
| DOIs | |
| Publication status | Published - 17 Nov 2018 |
Funding
It is a great pleasure to congratulate Daan Frenkel on the occasion of his 70th birthday. His deep understanding and broad knowledge of science combined with his wit and enormous recollection of (non-)trivia on literally any topic have impressed RvR from his undergraduate days onward, and made every interaction with Daan a privilege and a pleasure. RvR is grateful for many years of Daan’s guidance, support and inspiration. We wish Daan good health and spirit for many years to come.We thank Massimiliano Chiappini, Marjolein Dijkstra and Simone Dussi for useful discussions. This work is part of the D-ITP consortium, a programme of the Netherlands Organisation for Scientific Research (NWO) that is funded by the Dutch Ministry of Education, Culture and Science (OCW). We also acknowledge financial support from an NWO-VICI grant.
Keywords
- biaxiality
- boomerangs
- colloids
- flexibility
- Liquid crystals