Coloring triangle‐free graphs with local list sizes

We prove two distinct and natural refinements of a recent breakthrough result of Molloy (and a follow‐up work of Bernshteyn) on the (list) chromatic number of triangle‐free graphs. In both our results, we permit the amount of color made available to vertices of lower degree to be accordingly lower. One result concerns list coloring and correspondence coloring, while the other concerns fractional coloring. Our proof of the second illustrates the use of the hard‐core model to prove a Johansson‐type result, which may be of independent interest.     

Demixing and nematic behaviour of oblate hard spherocylinders and hard spheres mixtures: Monte Carlo simulation and Parsons–Lee theory

Parsons–Lee approach is formulated for the isotropic–nematic transition in a binary mixture of oblate hard spherocylinders and hard spheres. Results for the phase coexistence and for the equation of state in both phases for fluids with different relative size and composition ranges are presented. The predicted behaviour is in agreement with Monte Carlo simulations in a qualitative fashion. The study serves to provide a rational view of how to control key aspects of the behaviour of these binary nematogenic colloidal systems. This behaviour can be tuned with an appropriate choice of the relative size and molar fractions of the depleting particles. In general, the mixture of discotic and spherical particles is stable against demixing up to very high packing fractions. We explore in detail the narrow geometrical range where demixing is predicted to be possible in the isotropic phase. The influence of molecular crowding effects on the stability of the mixture when spherical molecules are added to a system of discotic colloids is also studied.     

化学气相沉积金刚石探测器测量辐射驱动内爆的硬X射线

金刚石探测器具有响应快、灵敏度高、动态范围大、平响应、击穿电压高、抗辐射等优点, 广泛运用于X射线测量. 利用化学气相沉积方法制备的光学级金刚石, 采用金属-金刚石-金属结构研制了X射线金刚石探测器. 在8ps激光器上的探测器响应性能考核表明, 整个探测器系统的响应时间为444 ps, 上升时间为175 ps, 载流子寿命为285 ps. 将探测器应用于神光Ⅲ原型装置的内爆物理实验硬X射线测量, 分别测量得到以注入黑腔的激光转化为主和靶丸内爆产生为主的硬X射线能流, 测得的峰值信号分别正比于激光总能量和反比于靶丸CH层厚度. 关键词： CVD金刚石探测器 硬X射线 激光能量     

On the freezing and structure of hard spheres under spherical confinement

The equation of state and the structure of hard spheres confined in spherical pores have been investigated via molecular dynamics for different pore radii ranging from 5.0 to 10.0?σ, where σ is the particle diameter. The hard boundary is chosen to capture the pure geometric effect of spherical confinement. A discontinuity in the equation of state was observed, indicating the onset of a freezing-like phase transition, which was similar to that of the bulk hard-sphere fluids. The behaviour of confined particles resembles that of the bulk with increase in the pore size, while its deviation from the bulk is found to be larger at the solid-like phase. For the pore radius below 5.0, FCC-like crystal clusters are not formed in spherically confined hard spheres.     

The measurement of solid–liquid interfacial energy in colloidal suspensions using grain boundary grooves

Interfacial energy is a fundamental physiochemical property of any multi-phase system. Among the most direct approaches for determining solid–liquid interfacial energy is a technique based on measuring the shape of grain boundary grooves in specimens subjected to a linear temperature gradient. This technique was adapted to crystallizing colloids in a gravitational field. Such colloids exhibit a freezing–melting phase transition and are important not only as self-assembling precursors to photonic crystals, but also as physical models of atomic and molecular systems. The grain boundary groove technique was tested using suspensions of sterically stabilized poly(methyl methacrylate) spheres, which have been shown to closely approximate the hard sphere potential. Whereas isotropic models did not fit grain boundary groove data well, the capillary vector model, which is suitable for both isotropic and anisotropic surface energies, produced γ₁₁₀?=?0.58?±?0.05 k _B T/σ². This value of interfacial energy is in agreement with many of the published values for hard spheres, supporting the validity of our grain boundary groove technique adaptations to colloidal systems in a gravitational field. Finally, kinks observed in groove profiles suggest a minimum anisotropy parameter of ε?=?0.029 for hard spheres.     

Jamming and crystallization in athermal polymer packings

Dense packings of chains of hard spheres possess characteristic features that do not have a counterpart in corresponding packings of monomeric spheres especially near the maximally random jammed (MRJ) state. From the modelling perspective the additional requirement that spheres keep their connectivity while maximizing the occupied volume fraction imposes severe constraints on generation algorithms of dense chain configurations. The extremely sluggish dynamics imposed by the uncrossability of chains precludes the use of deterministic or stochastic dynamics to generate all but dilute polymer packings. As a viable alternative, especially tailored chain-connectivity-altering Monte Carlo (MC) algorithms have been developed that bypass this kinetic hindrance and have actually been able to produce packings of hard-sphere chains in a volume fraction range spanning from infinite dilution up to the MRJ state. Such very dense athermal polymer packings share a number of structural features with packings of monomeric hard spheres, but also display unique characteristics due to the constraints imposed by connectivity. We give an overview of the most relevant results of our recent modeling work on packings of freely-jointed chains of tangent hard spheres about the MRJ state, local structure, chain dimensions and their scaling with density, topological constraints in the form of entanglements and knots, contact network at jamming, and entropically driven crystallization.     

Equation of state and stability of the helium-hydrogen mixture at cryogenic temperature

The equation of state and the stability of the helium-molecular hydrogen mixture at cryogenic temperature up to moderate pressure are studied by means of current molecular physics methods and statistical mechanics perturbation theory. The phase separation, segregation and hetero-coordination are investigated by calculating the Gibbs energy depending on the mixture composition, pressure and temperature. Low temperature quantum effects are incorporated via cumulant approximations of the Wigner-Kirkwood expansion. The interaction between He and H₂ is determined by Double Yukawa potentials. The equation of state is derived from the hard sphere system by using the scaled particle theory. The behavior of the mixture over a wide range of pressure is explored with the excess Gibbs energy of mixing and the concentration fluctuations in the long wavelength limit. The theory is compared to cryogenic data and Monte-Carlo calculation predictions. Contrary to previous similar works, the present theory retrieves the main features of the mixture below 50 K, such as the critical point and the condensation-freezing curve, and is found to be usable well below 50 K. However, the method does not distinguish the liquid from the solid phase. The binary mixture is found to be unstable against species separation at low temperature and low pressure corresponding to very cold interstellar medium conditions, essentially because H₂ alone condenses at very low pressure and temperature, contrary to helium.     

Effect of anodizing conditions on the cell morphology of anodic films on AA2024-T3 alloy

The effects of applied current density, anodizing time, and electrolyte temperature on the cell and pore morphology of anodic films and the voltage-time response obtained during galvanostatic anodizing of AA2024-T3 alloy in sulphuric acid electrolytes have been studied. Scanning electron microscopy was employed to observe the film morphology. Sponge-like porous structure was promoted by anodizing at relatively low current density and high electrolyte temperature. In contrast, linear porous structure was favoured under the converse conditions. Intermediate conditions resulted in films containing either sequential layers of the 2 morphologies or a morphology incorporating features of the 2 types; such conditions were associated with anodizing voltages in the range 25 to 35 V. The reasons for the morphological differences are proposed to be due to interactions between film growth stresses and stresses arising from oxygen evolution on the development of the alumina cells.     

Speeds of sound and isothermal compressibility of ternary liquid systems: Application of Flory’s statistical theory and hard sphere models

Speeds of sound and densities of three ternary liquid systems namely, toluene + n-heptane + n-hexane (I), cyclohexane + n-heptane + n-hexane (II) and n-hexane + n-heptane + n-decane (III) have been measured as a function of the composition at 298.15 K at atmospheric pressure. The experimental isothermal compressibility has been evaluated from measured values of speeds of sound and density. The isothermal compressibility of these mixtures has also been computed theoretically using different models for hard sphere equations of state and Flory’s statistical theory. Computed values of isothermal compressibility have been compared with experimental findings. A satisfactory agreement has been observed. The superiority of Flory’s statistical theory has been established quite reasonably over hard sphere models.      

Dynamics of polydisperse hard-spheres under strong confinement

We use molecular simulation to probe the connection between local structure and the unusual re-entrant dynamics observed for polydisperse hard-sphere liquids confined in thin slit pores. The local structure is characterised by calculating 2-D bond-orientational order parameters associated with square and hexatic order for particles in the layer adjacent to the confining walls. When the wall separation is commensurate with the average particle size, the particles primarily exhibit local hexatic order, whereas local square order increases in prevalence for incommensurate geometries. The relaxation time extracted from the ensemble-averaged mean-square displacement increases exponentially with the static correlation length associated with hexatic local order in strongly confined commensurate geometries, in agreement with theoretical predictions for dynamical slowing. Square order, by contrast, is not associated with a growing length scale for either commensurate or incommensurate geometries, indicating that it is strongly geometrically frustrated. Our results suggest that the influence of bond-orientational order on dynamical slowing may be altered by changing the extent of confinement.