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Register a new userGeometrical Frustration and Static Correlations in Hard-Sphere Glass Formers
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We analytically and numerically characterize the structure of hard-sphere fluids in order to review various geometrical frustration scenarios of the glass transition. We find generalized polytetrahedral order to be correlated with increasing fluid packing fraction, but to become increasingly irrelevant with increasing dimension. We also find the growth in structural correlations to be modest in the dynamical regime accessible to computer simulations.
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We develop a novel method based in the sparse random graph to account the interplay between geometric frustration and disorder in cluster magnetism. Our theory allows to introduce the cluster network connectivity as a controllable parameter. Two types of inner cluster geometry are considered: triangular and tetrahedral. The theory was developed for a general, non-uniform intra-cluster interactions, but in the present paper the results presented correspond to uniform, anti-ferromagnetic (AF) intra-clusters interactions $J_{0}/J$. The clusters are represented by nodes on a finite connectivity random graph, and the inter-cluster interactions are random Gaussian distributed. The graph realizations are treated in replica theory using the formalism of order parameter functions, which allows to calculate the distribution of local fields and, as a consequence, the relevant observable. In the case of triangular cluster geometry, there is the onset of a classical Spin Liquid state at a temperature $T^{*}/J$ and then, a Cluster Spin Glass (CSG) phase at a temperature $T_{f}/J$. The CSG ground state is robust even for very weak disorder or large negative $J_{0}/J$. These results does not depend on the network connectivity. Nevertheless, variations in the connectivity strongly affect the level of frustration $f_{p}=-Theta_{CW}/T_{f}$ for large $J_{0}/J$. In contrast, for the non-frustrated tetrahedral cluster geometry, the CSG ground state is suppressed for weak disorder or large negative $J_{0}/J$. The CSG boundary phase presents a re-entrance which is dependent on the network connectivity.
We study in detail the predictions of various theoretical approaches, in particular mode-coupling theory (MCT) and kinetically constrained models (KCMs), concerning the time, temperature, and wavevector dependence of multi-point correlation functions that quantify the strength of both induced and spontaneous dynamical fluctuations. We also discuss the precise predictions of MCT concerning the statistical ensemble and microscopic dynamics dependence of these multi-point correlation functions. These predictions are compared to simulations of model fragile and strong glass-forming liquids. Overall, MCT fares quite well in the fragile case, in particular explaining the observed crucial role of the statistical ensemble and microscopic dynamics, while MCT predictions do not seem to hold in the strong case. KCMs provide a simplified framework for understanding how these multi-point correlation functions may encode dynamic correlations in glassy materials. However, our analysis highlights important unresolved questions concerning the application of KCMs to supercooled liquids.
There exists a variety of theories of the glass transition and many more numerical models. But because the models need built-in complexity to prevent crystallization, comparisons with theory can be difficult. We study the dynamics of a deeply supersaturated emph{monodisperse} four-dimensional (4D) hard-sphere fluid, which has no such complexity, but whose strong intrinsic geometrical frustration inhibits crystallization, even when deeply supersaturated. As an application, we compare its behavior to the mode-coupling theory (MCT) of glass formation. We find MCT to describe this system better than any other structural glass formers in lower dimensions. The reduction in dynamical heterogeneity in 4D suggested by a milder violation of the Stokes-Einstein relation could explain the agreement. These results are consistent with a mean-field scenario of the glass transition.
We study the phase diagram of a topological string-net type lattice model in the presence of geometrically frustrated interactions. These interactions drive several phase transitions that reduce the topological order, leading to a rich phase diagram including both Abelian ($mathbb{Z}_2$) and non-Abelian ($text{Ising}times overline{text{Ising}}$) topologically ordered phases, as well as phases with broken translational symmetry. Interestingly, one of these phases simultaneously exhibits (Abelian) topological order and long-ranged order due to translational symmetry breaking, with non-trivial interactions between excitations in the topological order and defects in the long-ranged order. We introduce a variety of effective models, valid along certain lines in the phase diagram, which can be used to characterize both topological and symmetry-breaking order in these phases, and in many cases allow us to characterize the phase transitions that separate them. We use exact diagonalization and high-order series expansion to study areas of the phase diagram where these models break down, and to approximate the location of the phase boundaries.
The smallest maximum kissing-number Voronoi polyhedron of 3d spheres is the icosahedron and the tetrahedron is the smallest volume that can show up in Delaunay tessalation. No periodic lattice is consistent with either and hence these dense packings are geometrically frustrated. Because icosahedra can be assembled from almost perfect tetrahedra, the terms icosahedral and polytetrahedral packing are often used interchangeably, which leaves the true origin of geometric frustration unclear. Here we report a computational study of freezing of 4d hard spheres, where the densest Voronoi cluster is compatible with the symmetry of the densest crystal, while polytetrahedral order is not. We observe that, under otherwise comparable conditions, crystal nucleation in 4d is less facile than in 3d. This suggest that it is the geometrical frustration of polytetrahedral structures that inhibits crystallization.
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