Condensation of all-cis-tetraphenylcyclotetrasiloxanetetraol in ammonia: new method for preparation of ladder-like polyphenylsilsesquioxanes

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Rearragnement of 1-allyloxy-2-allylthio-4-methyl-benzene TO 2,4-dimethyl-6-allyl-7 hydroxy-2,3-dihydrobenzothiophene

1-Allyloxy-2-allylthio-4-methylbenzene rearranges in NN-diethylaniline at 215°C with migration of allyloxy and allylthio groups to form 2,4-dimethyl-6-allyl-7-hydroxy-2,3dihydrobenzothiophene.M. V. Lomonosov State University, Moscow 119899. Translated from Khimiya Geterotsiklicheskikh Soedinenii, No. 4, pp. 480–482, 1994. Original article submitted March 5, 1994.     

Destruction of a solid film under the action of ultrashort laser pulse

Molecular-dynamics (MD) simulation of the destruction of a crystal film heated by a femtosecond laser pulse was carried out. Heating is assumed to be instantaneous, because there is no time for the material to be displaced during the pulse. Film destruction is caused by the interaction of unloading waves. It can be considered as a model of a more complex process of splitting out of a thin surface layer from a massive target in the case where the layer remains solid after heating. It was found that the crystal order is broken due to the stretching strains and to the strong anisotropy of residual stress, resulting in a bipartition of the layer separating from the target. The lattice stretching and the formation of anisotropic stresses are due to the expansion of a heated lattice.     

Thermal effects and flat direction baryogenesis

We provide a detailed numerical study of the influence of thermal effects on the original picture of the Affleck-Dine baryogenesis. These effects are found to modify the results greatly in some cases. We estimate the baryon/entropy ratio and provide numerical results on the typical behavior of the charge as a function of the strength of the potential and other parameters.     

A new, fast and efficient synthesis of 3-aryl indenones: intramolecular cyclization of 1,3-diarylpropynones in superacids

1,3-Diarylpropynones were cleanly converted to the corresponding 3-arylindenones in various superacidic media. This new, simple, one-pot reaction proved to be efficient (yields up to 95%) and very fast (reaction time less than 30 min).     

Probing structural relaxation in complex fluids by critical fluctuations

Complex fluids, such as polymer solutions and blends, colloids, and gels, are of growing interest in fundamental and applied soft-condensed-matter science. A common feature of all such systems is the presence of a mesoscopic structural length scale intermediate between the atomic and macroscopic scales. This mesoscopic structure of complex fluids is often fragile and sensitive to external perturbations. Complex fluids are frequently viscoelastic (showing a combination of viscous and elastic behavior), with their dynamic response depending on the time and length scales. Recently, noninvasive methods to infer the rheological response of complex fluids have gained popularity through the technique of microrheology, where the diffusion of probe spheres in a viscoelastic fluid is monitored with the aid of light scattering or microscopy. Here, we propose an alternative to traditional microrheology that does not require doping of probe particles in the fluid (which can sometimes drastically alter the molecular environment). Instead, our proposed method makes use of the phenomenon of “avoided crossing” between modes associated with the structural relaxation and critical fluctuations that are spontaneously generated in the system.     

Estimating the observation parameters of a switching Poisson stream at random moments

We investigate the properties of maximum likelihood estimators in observation schemes of random variables that arrive at random time moments on a Poisson trajectory defined on some ergodic process.Translated from Vychislitel'naya i Prikladnaya Matematika, No. 59, pp. 98–105, 1986.     

Crossover Critical Behavior in the Three-Dimensional Ising Model

The character of critical behavior in physical systems depends on the range of interactions. In the limit of infinite range of the interactions, systems will exhibit mean-field critical behavior, i.e., critical behavior not affected by fluctuations of the order parameter. If the interaction range is finite, the critical behavior asymptotically close to the critical point is determined by fluctuations and the actual critical behavior depends on the particular universality class. A variety of systems, including fluids and anisotropic ferromagnets, belongs to the three-dimensional Ising universality class. Recent numerical studies of Ising models with different interaction ranges have revealed a spectacular crossover between the asymptotic fluctuation-induced critical behavior and mean-field-type critical behavior. In this work, we compare these numerical results with a crossover Landau model based on renormalization-group matching. For this purpose we consider an application of the crossover Landau model to the three-dimensional Ising model without fitting to any adjustable parameters. The crossover behavior of the critical susceptibility and of the order parameter is analyzed over a broad range (ten orders) of the scaled distance to the critical temperature. The dependence of the coupling constant on the interaction range, governing the crossover critical behavior, is discussed.     

Orbital-selective Mott-insulator transition in Ca 2 - x Sr x RuO 4

The electronic structures of the metallic and insulating phases of the alloy series Ca_2-xSr_xRuO₄ ( 0 ? x ? 2) are calculated using LDA, LDA+U and Dynamical Mean-Field Approximation methods. In the end members the groundstate respectively is an orbitally non-degenerate antiferromagnetic insulator (x = 0) and a good metal (x = 2). For x > 0.5 the observed Curie-Weiss paramagnetic metallic state which possesses a local moment with the unexpected spin S = 1/2, is explained by the coexistence of localized and itinerant Ru-4d-orbitals. For 0.2 < x < 0.5 we propose a state with partial orbital and spin ordering. An effective model for the localized orbital and spin degrees of freedom is discussed. The metal-insulator transition at x = 0.2 is attributed to a switch in the orbital occupation associated with a structural change of the crystal. Received 27 July 2001     

A census of semisymmetric cubic graphs on up to 768 vertices

A list is given of all semisymmetric (edge- but not vertex-transitive) connected finite cubic graphs of order up to 768. This list was determined by the authors using Goldschmidt's classification of finite primitive amalgams of index (3,3), and a computer algorithm for finding all normal subgroups of up to a given index in a finitely-presented group. The list includes several previously undiscovered graphs. For each graph in the list, a significant amount of information is provided, including its girth and diameter, the order of its automorphism group, the order and structure of a minimal edge-transitive group of automorphisms, its Goldschmidt type, stabiliser partitions, and other details about its quotients and covers. A summary of all known infinite families of semisymmetric cubic graphs is also given, together with explicit rules for their construction, and members of the list are identified with these. The special case of those graphs having K_1,3 as a normal quotient is investigated in detail. Supported in part by N.Z. Marsden Fund (grant no. UOA 124) and N.Z. Centres of Research Excellence Fund (grant no. UOA 201) Supported in part by “Ministrstvo za šolstvo, znanost in šport Slovenije”, research program no. 101-506. Supported in part by research projects no. Z1-4186-0101 and no. Z1-3124-0101. The fourth author would like to thank the University of Auckland for hospitality during his visit there in 2003.