Discotic (disc-like) molecules typically comprising a rigid aromatic core and flexible peripheral chains have been attracting growing interest because of their fundamental importance as model systems for the study of charge and energy transport and due to the possibilities of their application in organic electronic devices. This critical review covers various aspects of recent research on discotic liquid crystals, in particular, molecular design concepts, supramolecular structure, processing into ordered thin films and fabrication of electronic devices. The chemical structure of the conjugated core of discotic molecules governs, to a large extent, their intramolecular electronic properties. Variation of the peripheral flexible chains and of the aromatic core is decisive for the tuning of self-assembly in solution and in bulk. Supramolecular organization of discotic molecules can be effectively controlled by the choice of the processing methods. In particular, approaches to obtain suitable macroscopic orientations of columnar superstructures on surfaces, that is, planar uniaxial or homeotropic alignment, are discussed together with appropriate processing techniques. Finally, an overview of charge transport in discotic materials and their application in optoelectronic devices is given (234 references).

Discotic liquid crystals: a new generation of organic semiconductors

Light-driven phenomena both in living systems and nonliving materials have enabled truly fascinating and incredible dynamic architectures with terrific forms and functions. Recently, liquid crystalline materials endowed with photoresponsive capability have emerged as enticing systems. In this Review, we focus on the developments of light-driven liquid crystalline materials containing photochromic components over the past decade. Design and synthesis of photochromic liquid crystals (LCs), photoinduced phase transitions in LC, and photoalignment and photoorientation of LCs have been covered. Photomodulation of pitch, polarization, lattice constant and handedness inversion of chiral LCs is discussed. Light-driven phenomena and properties of liquid crystalline polymers, elastomers, and networks have also been analyzed. The applications of photoinduced phase transitions, photoalignment, photomodulation of chiral LCs, and photomobile polymers have been highlighted wherever appropriate. The combination of photoc...

Light-Driven Liquid Crystalline Materials: From Photo-Induced Phase Transitions and Property Modulations to Applications.

Field-Cycling NMR Relaxometry

Gas-phase spectroscopy lends itself ideally to the study of isolated molecules and provides important data for comparison with theory. In recent years, we have seen enormous progress in the study of biomolecular building blocks in the gas phase. The motivation for such work is threefold: (a) It is important to distinguish between intrinsic molecular properties and properties that result from the biological environment. (b) Gas-phase spectroscopy of clusters provides insights into fundamental interactions and into microsolvation. (c) Gas-phase data support quantum-chemical calculations. This review focuses on the current status of (poly)amino acids and DNA bases. Recent results help elucidate structure and hydrogen-bonded interactions, as well as showcase a successful interplay between theory and experiment.

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Gas-phase spectroscopy of biomolecular building blocks.

Density-functional theory (DFT) and its variations provide a fruitful approach to the computational modeling of the microscopic structures and phase behavior of soft-condensed matter. The methodology takes deep root in quantum mechanics but shares a mathematical similarity with a number of classical approaches in statistical mechanics. This review discusses different strategies commonly used to formulate the free-energy functional of complex fluids for either phenomena-oriented applications or as a generic description of the thermodynamic nonideality owing to various components of intermolecular forces. We emphasize the connections among different schemes of DFT approximations, their underlying assumptions, and inherent limitations. We also address extensions of equilibrium DFT to phenomenological theories for the dynamic properties of complex fluids and for the kinetics of phase transitions. In addition, we highlight the recent literature concerning applications of DFT to diverse static and time-dependent phenomena in complex fluids.

Density-Functional Theory for Complex Fluids

Second dielectric virial coefficient of fluid of nonspherical molecules

Defects and Textures in Liquid Crystals

Some practical considerations in the use of Metropolis and force-biased Monte Carlo simulations on liquids

The occurrence of pressure-driven reentrant phenomena in a binary mixture of liquid crystals exhibiting the phase sequence on cooling is observed in high-pressure experimental studies has been explained within the framework of Landau de Gennes theory. In this phenomenological theory, the free energy density is written as an expansion series containing terms involving powers of nematic and smectic () order parameters and the () and () coupling terms. The most important feature of the work is that the role of inverse layer spacing , which mimics an order parameter, couples with the order parameters. The influence of concentration on reentrant behaviour is also discussed by varying the coupling between the concentration variable and the order parameters. We found that the order parameters coupling terms and inverse of layer spacing play an important role and that the present analysis is in good qualitative agreement with the available experimental results.

Pressure-driven reentrance phenomena in a binary mixture of achiral liquid crystals: role of inverse layer spacing

In the present study, we report the dielectric behavior of a high temperature nematic liquid crystal (NLC) in both the planar as well as homeotropic alignments. To understand the mechanism of such high temperature NLC, we have performed dielectric spectroscopy in frequency range 100 Hz to 10 MHz. The different dielectric parameters, viz., effective dielectric permittivity and dielectric anisotropy of the sample have been determined with the variation of frequency and temperature. It is found that the dielectric parameters depend on dipole moment and rotation of side chain of molecule. The phase transition of this high temperature NLC has been confirmed by the DSC study.

Shri Singh

Papers

Second dielectric virial coefficient of fluid of nonspherical molecules

Defects and Textures in Liquid Crystals

Some practical considerations in the use of Metropolis and force-biased Monte Carlo simulations on liquids

Pressure-driven reentrance phenomena in a binary mixture of achiral liquid crystals: role of inverse layer spacing

Dielectric Relaxation Spectroscopy of Liquid Crystal in Nematogenic Mesophase