Glass transition in fullerenes: mode-coupling theory predictions

We report idealized mode-coupling theory results for the glass transition of ensembles of model fullerenes interacting via phenomenological two-body potentials. Transition lines are found for C60, C70 and C96 in the temperature-density plane. We argue that the observed glass-transition behavior is indicative of kinetic arrest that is strongly driven by the inter-particle attraction in addition to excluded-volume repulsion. In this respect, these systems differ from most standard glass-forming liquids. They feature arrest that occurs at lower densities and that is stronger than would be expected for repulsion-dominated hard-sphere-like or Lennard-Jones-like systems. The influence of attraction increases with increasing the number of carbon atoms per molecule. However, unrealistically large fullerenes would be needed to yield behavior reminiscent of recently investigated model colloids with strong short-ranged attraction (glass-glass transitions and logarithmic decay of time-correlation functions).Comment: 10 pages, 5 figure

The Dynamics of Silica Melts under High Pressure: Mode-Coupling Theory Results

The high-pressure dynamics of a computer-modeled silica melt is studied in the framework of the mode-coupling theory of the glass transition (MCT) using static-structure input from molecular-dynamics (MD) computer simulation. The theory reproduces the experimentally known viscosity minimum (diffusivity maximum) as a function of density or pressure and explains it in terms of a corresponding minimum in its critical temperature. This minimum arises from a gradual change in the equilibrium static structure which shifts from being dominated by tetrahedral ordering to showing the cageing known from high-density liquids. The theory is in qualitative agreement with computer simulation results.Comment: Presented at ESF EW Glassy Liquids under Pressure, to be published in Journal of Physic

Idealized glass transitions under pressure: dynamics versus thermodynamics

The interplay of slow dynamics and thermodynamic features of dense liquids is studied by examinining how the glass transition changes depending on the presence or absence of Lennard-Jones-like attractions. Quite different thermodynamic behavior leaves the dynamics unchanged, with important consequences for high-pressure experiments on glassy liquids. Numerical results are obtained within mode-coupling theory (MCT), but the qualitative features are argued to hold more generally. A simple square-well model can be used to explain generic features found in experiment.Comment: to be published in Phys. Rev. Let

Magnetic order in CaFe1-xCoxAsF (x = 0, 0.06, 0.12) superconductor compounds

A Neutron Powder Diffraction (NPD) experiment has been performed to investigate the structural phase transition and magnetic order in CaFe1-xCoxAsF superconductor compounds (x = 0, 0.06, 0.12). The parent compound CaFeAsF undergoes a tetragonal to orthorhombic phase transition at 134(3) K, while the magnetic order in form of a spin-density wave (SDW) sets in at 114(3) K. The antiferromagnetic structure of the parent compound has been determined with a unique propagation vector k = (1,0,1) and the Fe saturation moment of 0.49(5)uB aligned along the long a-axis. With increasing Co doping, the long range antiferromagnetic order has been observed to coexist with superconductivity in the orthorhombic phase of the underdoped CaFe0.94Co0.06AsF with a reduced Fe moment (0.15(5)uB). Magnetic order is completely suppressed in optimally doped CaFe0.88Co0.12AsF. We argue that the coexistence of SDW and superconductivity might be related to mesoscopic phase separation.Comment: 4pages, 4figure

Client Adaptation improves Federated Learning with Simulated Non-IID Clients

We present a federated learning approach for learning a client adaptable, robust model when data is non-identically and non-independently distributed (non-IID) across clients. By simulating heterogeneous clients, we show that adding learned client-specific conditioning improves model performance, and the approach is shown to work on balanced and imbalanced data set from both audio and image domains. The client adaptation is implemented by a conditional gated activation unit and is particularly beneficial when there are large differences between the data distribution for each client, a common scenario in federated learning.Comment: 11 pages, 11 figures. To appear at International Workshop on Federated Learning for User Privacy and Data Confidentiality in Conjunction with ICML 202

Role of structural relaxations and vibrational excitations in the high-frequency dynamics of liquids and glasses

We present theoretical investigation on the high-frequency collective dynamics in liquids and glasses at microscopic length scales and terahertz frequency region based on the mode-coupling theory for ideal liquid-glass transition. We focus on recently investigated issues from inelastic-X-ray-scattering and computer-simulation studies for dynamic structure factors and longitudinal and transversal current spectra: the anomalous dispersion of the high-frequency sound velocity and the nature of the low-frequency excitation called the boson peak. It will be discussed how the sound mode interferes with other low-lying modes present in the system. Thereby, we provide a systematic explanation of the anomalous sound-velocity dispersion in systems -- ranging from high temperature liquid down to deep inside the glass state -- in terms of the contributions from the structural-relaxation processes and from vibrational excitations called the anomalous-oscillation peak (AOP). A possibility of observing negative dispersion -- the {\em decrease} of the sound velocity upon increase of the wave number -- is argued when the sound-velocity dispersion is dominated by the contribution from the vibrational dynamics. We also show that the low-frequency excitation, observable in both of the glass-state longitudinal and transversal current spectra at the same resonance frequency, is the manifestation of the AOP. As a consequence of the presence of the AOP in the transversal current spectra, it is predicted that the transversal sound velocity also exhibits the anomalous dispersion. These results of the theory are demonstrated for a model of the Lennard-Jones system.Comment: 25 pages, 22 figure

Spitzer Space Telescope evidence in NGC 6791: no super-mass-loss at super-solar metallicity to explain helium white dwarfs?

We use archival Spitzer Space Telescope photometry of the old, super-solar metallicity massive open cluster NGC 6791 to look for evidence of enhanced mass loss, which has been postulated to explain the optical luminosity function and low white dwarf masses in this benchmark cluster. We find a conspicuous lack of evidence for prolificacy of circumstellar dust production that would have been expected to accompany such mass loss. We also construct the optical and infrared luminosity functions, and demonstrate that these fully agree with theoretical expectations. We thus conclude that there is no evidence for the mass loss of super-solar metallicity red giants to be sufficiently high that they can avoid the helium flash at the tip of the red giant branch.Comment: accepted for publication in ApJ Letter

Neutron diffraction study on phase transition and thermal expansion of SrFeAsF

The magnetic ordering and crystal structure of iron pnictide SrFeAsF was investigated by using neutron powder diffraction method. With decreasing temperature, the tetragonal to orthorhombic phase transition is found at 180 K, while the paramagnetic to antiferromagnetic phase transition set in at 133 K. Similar to the parent compound of other iron pnictide system, the striped Fe magnetism is confirmed in antiferromagnetic phase and the Fe moment of 0.58(6) uB aligned along long a axis. The thermal expansion of orthorhombic phase of SrFeAsF is also investigated. Based on the Grueneisen approximation and Debye approximation for internal energy, the volume of SrFeAsF can be well fitted with Debye temperature of 347(5) K. The experimental atomic displacement parameters for different crystallographic sites in SrFeAsF are analyzed with Debye model. The results suggested that the expansion of FeAs layers plays an important role in determining the thermal expansion coefficient.Comment: 4 pages, 3 figure

Colloidal gelation and non-ergodicity transitions

Within the framework of the mode coupling theory (MCT) of structural relaxation, mechanisms and properties of non-ergodicity transitions in rather dilute suspensions of colloidal particles characterized by strong short-ranged attractions are studied. Results building on the virial expansion for particles with hard cores and interacting via an attractive square well potential are presented, and their relevance to colloidal gelation is discussed.Comment: 10 pages, 4 figures; Talk at the Conference: "Unifying Concepts in Glass Physics" ICTP Trieste, September 1999; to be published in J. Phys.: Condens. Matte