1. Impact of curvature on nematic topological defectsLuka Mesarec, 2018, doktorska disertacija Opis: Topological defects (TDs) appear almost unavoidably in continuous symmetry breaking phase transitions. The topological origin makes their key features independent of systems' microscopic details; therefore TDs display many universalities. Because of their strong impact on numerous material properties and their significant role in several technological applications it is of strong interest to find simple and robust mechanisms controlling the positioning and local number of TDs. There are strong evidences that in physics the fields are fundamental entities of nature and not particles. If this is the case then topological defects (TDs) might play the role of fundamental particles. An adequate testing ground to study and gain fundamental understanding of TDs are nematic liquid crystals. We present a numerical study of TDs within effectively two dimensional closed soft films exhibiting inplane orientational ordering. Popular examples of such class of systems are liquid crystalline shells and various biological membranes.
We analyze the impact of extrinsic and intrinsic curvature on positions of topological defects (TDs) in twodimensional (2D) nematic films. We demonstrate that both these curvature contributions are commonly present and are expected to be weighted by comparable elastic constants. A simple Landaude Gennes approach in terms of tensor nematic order parameter is used to numerically demonstrate impact of the curvatures on position of TDs on 2D ellipsoidal nematic shells. We introduce the Effective Topological Charge Cancellation mechanism controlling localised positional assembling tendency of TDs and the formation of pairs (defect,antidefect) on curved surfaces. Furthermore, we estimate a critical depinning threshold to form pairs (defect,antidefect) using the electrostatic analogy. Finally, we show how one could efficiently switch among qualitatively different structures by using a relative volume of ordered shells, which represents a relatively simple naturally accessible control parameter.
In doctoral thesis, we developed theoretical model of erythrocyte membrane by using a hybrid HelfrichLandau type mesoscopic approach, taking into account inplane membrane ordering. We demonstrate that the derived extrinsic membrane energy term, which strongly depends on the local orientations of the molecules, is essential for the predicted broadening of the range of the relative volumes corresponding to the stable discocyte shapes, which is otherwise very narrow if only intrinsic curvature energy term dominates. Ključne besede: Topological defects, Continuum fields, Nematic liquid crystals, Biological membranes, Nematic shells, Landaude Gennes formalism, Topological charge, Nanoparticles, Gaussian curvature, Electrostatic analogy, Intrinsic curvature, Extrinsic curvature, Crystal growth nucleation, Relative
volume Objavljeno: 09.03.2018; Ogledov: 1316; Prenosov: 110 Celotno besedilo (23,66 MB) 
2. Interplay between art and science in educationSamo Kralj, Boris Aberšek, Irena Kralj, 2014, izvirni znanstveni članek Opis: Music can be viewed as a structure formed by notes. Different structures in music have potential to yield enormously rich diversity of different melodies. Music is a typical example where a structure defines a property. Similar concepts could be also exploited in education, in presented case in nanosciences, which are typical representatives of soft materials the structure of which can be strongly manipulated with local geometry and presence of appropriate nanoparticles. The objects of study, named also LC shells, will be exploited as basic unit elements for future soft colloidal crystals. A different arrangement of colloids within the crystal would result in different physical properties in a similar way as different packing of atoms results in different crystals made of real atoms. In presented research will be demonstrated, how relevant basic mechanisms in thin films of nematic liquid crystals could be explained in a classroom and used as a case study, also for explanation of many other physical properties. This research topic is still in its infancy. At this stage only various defect structures in relatively simple geometries (spherical and elliptical) will be analyzed. There is a need to find simple ways to control sensitively the valence of LC shells and in particular to develop strategies to assemble them in crystal structures of desired symmetry. This would allow tailoring specific optical dispersion relations or other physical property of interest and make new ways to teach different physical properties on the "music" based approach. Ključne besede: teaching strategies, music education, nanosciences, topological defects Objavljeno: 15.12.2017; Ogledov: 794; Prenosov: 50 Celotno besedilo (1,19 MB) Gradivo ima več datotek! Več...

3. Vesiculation of biological membrane driven by curvature induced frustrations in membrane orientational orderingDalija Povše Jesenek, Šárka Perutková, Wojciech Góźdź, Veronika KraljIglič, Aleš Iglič, Samo Kralj, 2013, izvirni znanstveni članek Opis: Membrane budding often leads to the formation and release of microvesicles. The latter might play an important role in long distance celltocell communication, owing to their ability to move with body fluids. Several mechanisms exist which might trigger the pinching off of globular buds from the parent membrane (vesiculation). In this paper, we consider the theoretical impacts of topological defects (frustrations) on this process in the membranes that exhibit global inplane orientational order. A Landau–de Gennes theoretical approach is used in terms of tensor orientational order parameters. The impact of membrane shapes on position and the number of defects is analyzed. In studied cases, only defects with winding numbers m = ±1/2 appear, where we refer to the number of defects with m = 1/2 as defects, and with m = –1/2 as antidefects. It is demonstrated that defects are attracted to regions with maximal positive Gaussian curvature, K. On the contrary, antidefects are attracted to membrane regions exhibiting minimal negative values of K. We show on membrane structures exhibiting spherical topology that the coexistence of regions with K > 0 and K < 0 might trigger formation of defect–antidefect pairs for strong enough local membrane curvatures. Critical conditions for triggering pairs are determined in several demonstrative cases. Then the additionally appeared antidefects are assembled at the membrane neck, where K < 0. Consequent strong local fluctuations of membrane constituent anisotropic molecules might trigger membrane fission neck rupture, enabling a membrane fission process and the release of membrane daughter microvesicles (ie, vesiculation). Ključne besede: structural transitions, topological defects, membrane microvesicles, membrane curvature, membrane fission, vesiculation Objavljeno: 03.08.2017; Ogledov: 662; Prenosov: 336 Celotno besedilo (4,92 MB) Gradivo ima več datotek! Več...

4. Curvaturecontrolled topological defectsLuka Mesarec, Pavlo Kurioz, Aleš Iglič, Wojciech Góźdź, Samo Kralj, izvirni znanstveni članek Opis: Effectively, twodimensional (2D) closed films exhibiting inplane orientational ordering (ordered shells) might be instrumental for the realization of scaled crystals. In them, ordered shells are expected to play the role of atoms. Furthermore, topological defects (TDs) within them would determine their valence. Namely, bonding among shells within an isotropic liquid matrix could be established via appropriate nanobinders (i.e., linkers) which tend to be attached to the cores of TDs exploiting the defect core replacement mechanism. Consequently, by varying configurations of TDs one could nucleate growth of scaled crystals displaying different symmetries. For this purpose, it is of interest to develop a simple and robust mechanism via which one could control the position and number of TDs in such atoms. In this paper, we use a minimal mesoscopic model, where variational parameters are the 2D curvature tensor and the 2D orientational tensor order parameter. We demonstrate numerically the efficiency of the effective topological defect cancellation mechanism to predict positional assembling of TDs in ordered films characterized by spatially nonhomogeneous Gaussian curvature. Furthermore, we show how one could efficiently switch among qualitatively different structures by using a relative volume v of ordered shells, which represents a relatively simple naturally accessible control parameter. Ključne besede: topological defects, Gaussian curvature, selfassembling, crystal growth nucleation Objavljeno: 20.07.2017; Ogledov: 695; Prenosov: 345 Celotno besedilo (6,77 MB) Gradivo ima več datotek! Več...

5. Effective topological charge cancelation mechanismLuka Mesarec, Wojciech Góźdź, Aleš Iglič, Samo Kralj, 2016, izvirni znanstveni članek Opis: Topological defects (TDs) appear almost unavoidably in continuous symmetry breaking phase transitions. The topological origin makes their key features independent of systems’ microscopic details; therefore TDs display many universalities. Because of their strong impact on numerous material properties and their significant role in several technological applications it is of strong interest to find simple and robust mechanisms controlling the positioning and local number of TDs. We present a numerical study of TDs within effectively two dimensional closed soft films exhibiting inplane orientational ordering. Popular examples of such class of systems are liquid crystalline shells and various biological membranes. We introduce the Effective Topological Charge Cancellation mechanism controlling localised positional assembling tendency of TDs and the formation of pairs {defect, antidefect} on curved surfaces and/or presence of relevant “impurities” (e.g. nanoparticles). For this purpose, we define an effective topological charge Δmeff consisting of real, virtual and smeared curvature topological charges within a surface patch Δς identified by the typical spatially averaged local Gaussian curvature K. We demonstrate a strong tendency enforcing Δmeff → 0 on surfaces composed of Δς exhibiting significantly different values of spatially averaged K. For Δmeff ≠ 0 we estimate a critical depinning threshold to form pairs {defect, antidefect} using the electrostatic analogy. Ključne besede: topological defects, topological charge, numerical studies, orientational ordering, nematic liquid crystals, liquid crystalline shells, biological membranes, nanoparticles, Gaussian curvature, electrostatic analogy, annihilation, topology Objavljeno: 23.06.2017; Ogledov: 600; Prenosov: 277 Celotno besedilo (2,15 MB) Gradivo ima več datotek! Več...

6. Numerical study of membrane configurationsLuka Mesarec, Miha Fošnarič, Samo Penič, Veronika KraljIglič, Samo Kralj, Wojciech Góźdź, Aleš Iglič, 2014, izvirni znanstveni članek Opis: We studied biological membranes of spherical topology within the framework of the spontaneous curvature model. Both Monte Carlo simulations and the numerical minimization of the curvature energy were used to obtain the shapes of the vesicles. The shapes of the vesicles and their energy were calculated for different values of the reduced volume. The vesicles which exhibit inplane ordering were also studied. Minimal models have been developed in order to study the orientational ordering in colloids coated with a thin sheet of nematic liquid crystal (nematic shells).The topological defects are always present on the surfaces with the topology of a sphere.The location of the topological defects depends strongly on the curvature of the surface. We studied the nematic ordering and the formation of topological defects on vesicles obtained by the minimization of the spontaneous curvature energy. Ključne besede: biological membranes, vesicles, spontaneous curvature model, Monte Carlo simulations, nematic shells, orientational ordering, topological defects Objavljeno: 14.06.2017; Ogledov: 568; Prenosov: 301 Celotno besedilo (4,38 MB) Gradivo ima več datotek! Več...

7. Field induced memory effects in random nematicsAmid Ranjkesh Siahkal, Milan Ambrožič, Samo Kralj, T. J. Sluckin, 2014, izvirni znanstveni članek Opis: We studied numerically external field induced memory effects in randomly perturbed nematic liquid crystals. Random anisotropy nematictype lattice model was used. The impurities imposing orientational disorder were randomly spatially distributed with the concentration p below the percolation threshold. Simulations were carried for finite temperatures, where we varied p, interaction strength between LC molecules, and impurities and external field B. In the {B, T} plane we determined lines separating short range—quasi long range and quasi long range—long range order. Furthermore, crossover regime separating external field and random field dominated regime was estimated. We calculated remanent nematic ordering in samples at B = 0 as a function of the previously experienced external field strength B. Ključne besede: liquid crystal, topological defects, random disorder Objavljeno: 14.06.2017; Ogledov: 671; Prenosov: 286 Celotno besedilo (2,15 MB) Gradivo ima več datotek! Več...
