Abstract
Mesogene molecules located between different substrates form layered structures that properties depend on the morphology of the substrate and the distance between them. Properties of these mesogene phases anchored on a variety of substrates are intensively studied because of fundamental scientific reasons as well as for their vital potential applications in design of novel generations of displays and other optoelectronic devices. The process of forming 5-cyanobiphenyl mesogene phases anchored between graphene sheets and ordering effects and stability of these phases were studied using molecular dynamics computer simulations.
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References
Roscioni OM, Muccioli L, Zannoni C (2017) Predicting the conditions for homeotropic anchoring of liquid crystals at a soft surface. 4-n-Pentyl-4′-cyanobiphenyl on Alkylsilane self-assembled monolayers. ACS Appl Mater Interfaces 9:11993–12002. https://doi.org/10.1021/acsami.6b16438
Alam TM, Pearce CJ (2014) Impact of graphene incorporation on the orientational order of graphene/liquid crystal composites. Chem Phys Lett 592:7–13. https://doi.org/10.1016/j.cplett.2013.11.044
Manjuladevi V, Gupta RK, Kumar S (2012) Effect of functionalized carbon nanotube on electro-optic and dielectric properties of a liquid crystal. J Mol Liq 171:60–63. https://doi.org/10.1016/j.molliq.2012.03.026
Rasna MV, Zuhail KP, Manda R, Paik P, Haase W, Dhara S (2014) Discontinuous anchoring transition and photothermal switching in composites of liquid crystals and conducting polymer nanofibers. Phys Rev E 89:052503. https://doi.org/10.1103/PhysRevE.89.052503
Rahman M, Lee W (2009) Scientific duo of carbon nanotubes and nematic liquid crystals. J Phys D Appl Phys 42:063001–063013. https://doi.org/10.1088/0022-3727/42/6/063001
Tiberio G, Muccioli L, Berardi R, Zannoni C (2009) Towards in silico liquid crystals. Realistic transition temperatures and physical properties for n-cyanobiphenyls via molecular dynamics simulations. ChemPhysChem 10:125–136. https://doi.org/10.1002/cphc.200800231
Phillips JC, Braun R, Wang W, Gumbart J, Tajkhorshid E, Villa E, Chipot C, Skeel RD, Kalé L, Schulten K (2005) Scalable molecular dynamics with NAMD. J Comput Chem 26:1781–1802. https://doi.org/10.1002/jcc.20289
Humphrey W, Dalke A, Schulten K (1996) VMD – visual molecular dynamics. J Molec Graphics 14:33–38. https://doi.org/10.1016/0263-7855(96)00018-5
Allen MP, Tildesley DJ (1989) Computer simulation of liquids. Clarendon Press/Oxford University Press, Oxford [England]/New York
Górny K, Raczyński P, Dendzik Z, Gburski Z (2015) Odd−even effects in the dynamics of liquid crystalline thin films on the surface of single walled carbon and silicon carbide nanotubes: computer simulation study. J Phys Chem C 119:19266–19271. https://doi.org/10.1021/acs.jpcc.5b05961
Giorgino T (2014) Computing 1-D atomic densities in macromolecular simulations: the density profile tool for VMD. Comput Phys Commun 185:317–322. https://doi.org/10.1016/j.cpc.2013.08.022
Acknowledgment
This research was supported in part by PAAD Infrastructure co-financed by Operational Programme Innovative Economy, Objective 2.3.
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Raczyńska, V., Górny, K., Raczyński, P., Dendzik, Z. (2018). Percolation Threshold of 5-Cyanobiphenyl Mesogene Phases Between Graphene Planes: Computer Simulation Study. In: Fesenko, O., Yatsenko, L. (eds) Nanochemistry, Biotechnology, Nanomaterials, and Their Applications. NANO 2017. Springer Proceedings in Physics, vol 214. Springer, Cham. https://doi.org/10.1007/978-3-319-92567-7_17
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