Interacting neural networks and the emergence of social structure

The article describes a computational model for the simulation of the emergence of social structure or social order, respectively. The model is theoretically based on the theory of social typifying by Berger and Luckmann. It consists of interacting artificial actors (agents), which are represented by two neural networks, an action net, and a perception net. By mutually adjusting of their actions, the agents are able to constitute a self‐organized social order in dependency of their personal characteristics and certain features of their environment. A fictitious example demonstrates the applicability of the model to problems of extra‐terrestrial robotics. © 2007 Wiley Periodicals, Inc. Complexity 12: 41–52, 2007     

Effect of electric field on the dielectric permittivity of betaine phosphite crystals in the paraelectric phase

Temperature dependences of the dielectric permittivity of betaine phosphite crystals are studied both without and under application of an electric bias. It is shown that, in view of the fact that the high-temperature improper ferroelastic (antiferrodistorsive) phase transition at T _c1=355 K is nearly tricritical, the nonlinear temperature dependence of inverse dielectric permittivity in the paraelectric phase and the effect of the field on the dielectric permittivity can be described within a phenomenological model containing two coupled (polar and nonpolar) order parameters with a negative coupling coefficient. An analysis of the model revealed that, in the case where two phase transitions, a nonpolar and a ferroelectric one, can occur in the crystal, all of its dielectric properties, including the polarization response in a field, can be described by one dimensionless parameter a. For the crystal under study, we have a=?2.5. This value of the parameter corresponds to a second-order ferroelectric transition far from the tricritical point, at which a=?1. It is shown that the polarization response in the paraelectric phase in an electric field calculated within this model differs radically from that in the ferroelectric phase-transition model for which the Curie-Weiss law holds in the paraelectric phase.     

Quantum logic properties of hypergraphs

In quantum logics, the notions of strong and full order determination and unitality for states on orthomodular posets are well known. These notions are defined for hypergraphs and their state spaces in a consistent manner and the relations between them and to the notions defined for orthomodular posets are discussed. The state space of a hypergraph is a polytope. This polytope is a simplex if and only if every superposition of pure states is a mixture of these same pure states. Isomorphic hypergraphs have convexly isomorphic state spaces. A class of hypergraphs is given whose group of automorphisms is group-isomorphic to the group of convex automorphisms of their state spaces.Work supported by the Swiss National Science Foundation.     

Time resolved analysis of steady and oscillating flow in the upper human airways

In this experimental study a thorough analysis of the steady and unsteady flow field in a realistic transparent silicone lung model of the first bifurcation of the upper human airways will be presented. To determine the temporal evolution of the flow time-resolved particle-image velocimetry recordings were performed for a Womersley number range 3.3 ≤ α ≤ 5.8 and Reynolds numbers of Re _D = 1,050, 1,400, and 2,100. The results evidence a highly three-dimensional and asymmetric character of the velocity field in the upper human airways, in which the influence of the asymmetric geometry of the realistic lung model plays a significant role for the development of the flow field in the respiratory system. At steady inspiration, the flow shows independent of the Reynolds number a large zone with embedded counter-rotating vortices in the left bronchia ensuring a continuous streamwise transport into the lung. At unsteady flow the critical Reynolds number, which describes the onset of vortices in the first bifurcation, is increased at higher Womersley number and decreased at higher Reynolds number. At expiration the unsteady and steady flows are almost alike.     

Reaction of 3‐Hydroxyquinoline‐2,4‐diones with Inorganic Thiocyanates in the Presence of Ammonium or Alkylammonium Ions: the Unexpected Replacement of a Hydroxy Group by an Amino Group

3‐Hydroxyquinoline‐2,4‐diones react with KSCN in the presence of the NH$\rm{{_{4}^{+}}}$ ions to generate 2,3‐dihydro‐3‐thioxoimidazo[1,5‐c]quinazolin‐5(6H)‐ones, 2,3‐dihydro‐2‐thioxo‐1H‐imidazo[4,5‐c]quinolin‐4(5H)‐ones, and products of molecular rearrangement of the 3‐aminoquinolinedione intermediates. Starting compounds with a benzyl (Bn) group at C(3) afford 3‐aminoquinolinediones, even when only AcONH₄ is used. The results of the reaction between 3‐hydroxyquinoline‐2,4‐diones and KSCN in the presence of BuNH₂ show that replacing a OH group with a secondary NH₂ group is also possible.     

Self-organization of 1-methylnaphthalene on the surface of artificial snow grains: a combined experimental-computational approach

A combined experimental-computational approach was used to study the self-organization and microenvironment of 1-methylnaphthalene (1MN) deposited on the surface of artificial snow grains from vapors at 238 K. The specific surface area of this snow (1.1 × 10(4) cm(2) g(-1)), produced by spraying very fine droplets of pure water from a nebulizer into liquid nitrogen, was determined using valerophenone photochemistry to estimate the surface coverage by 1MN. Fluorescence spectroscopy at 77 K, in combination with molecular dynamics simulations, and density functional theory (DFT) and second-order coupled cluster (CC2) calculations, provided evidence for the occurrence of ground- and excited-state complexes (excimers) and other associates of 1MN on the snow grains' surface. Only weak excimer fluorescence was observed for a loading of 5 × 10(-6) mol kg(-1), which is ～2-3 orders of magnitude below monolayer coverage. However, the results indicate that the formation of excimers is favored at higher surface loadings (>5 × 10(-5) mol kg(-1)), albeit still being below monolayer coverage. The calculations of excited states of monomer and associated moieties suggested that a parallel-displaced arrangement is responsible for the excimer emission observed experimentally, although some other associations, such as T-shape dimer structures, which do not provide excimer emission, can still be relatively abundant at this surface concentration. The hydrophobic 1MN molecules, deposited on the ice surface, which is covered by a relatively flexible quasi-liquid layer at 238 K, are then assumed to be capable of dynamic motion resulting in the formation of energetically preferred associations to some extent. The environmental implications of organic compounds' deposition on snow grains and ice are discussed.     

A molecular clip throws new light on the complexes formed by a family of cyclam-cored dendrimers with Zn(II) ions. Efficient energy transfer in the heteroleptic complexes

Complexation of Zn(II) ions by cyclam cored dendrimers appended with four (G0), eight (G1) and 16 naphthyl chromophores (G2) at the periphery have been investigated in CH?CN-CH?Cl? 1?:?1 (v/v) solution by absorption and emission, ESI-mass and 1H NMR spectroscopy. The results obtained can be interpreted by the formation of complexes of 2?:?1 dendrimer to metal stoichiometry, at low metal ion concentration, and 1?:?1 complexes upon further addition of Zn(II) ions, for all the dendrimer generations. Upon addition of a molecular clip C2? consisting of two anthracene sidewalls bridged by a benzene group with two sulfate substituents in the para positions, heteroleptic complexes of general formula [GnZnC] are formed. Interestingly, in these complexes, a very efficient quenching (practically 100%) of the dendrimer naphthyl luminescence and sensitization (ca. 90%) of the clip anthracene emission take place. The complex [G2ZnC] exhibits a very high molar absorption coefficient in the UV spectral region owing to the 16 naphthyl chromophores of the dendrimer and the two anthracene units of the clip (ε = 1.7 × 10? M?1 cm?1 at 263 nm). Furthermore, the excitation energy absorbed by the naphthyl chromophores is efficiently funneled to the two anthracene units of the clip, which emits in the blue spectral region.     

A family of 13 tetranuclear zinc(II)-lanthanide(III) complexes of a [3+3] Schiff-base macrocycle derived from 1,4-diformyl-2,3-dihydroxybenzene

A family of thirteen tetranuclear heterometallic zinc(II)-lanthanide(III) complexes of the hexa-imine macrocycle (L(Pr))(6-), with general formula Zn(II)(3)Ln(III)(L(Pr))(NO(3))(3)·xsolvents (Ln = La, Ce, Pr, Nd, Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm or Yb), were prepared in a one-pot synthesis using a 3:1:3:3 reaction of zinc(II) acetate, the appropriate lanthanide(III) nitrate, the dialdehyde 1,4-diformyl-2,3-dihydroxybenzene (H(2)L(1)) and 1,3-diaminopropane. A hexanuclear homometallic zinc(II) macrocyclic complex [Zn(6)(L(Pr))(OAc)(5)(OH)(H(2)O)]·3H(2)O was obtained using a 2:0:1:1 ratio of the same reagents. A control experiment using a 1:0:1:1 ratio failed to generate the lanthanide-free [Zn(3)(L(Pr))] macrocyclic complex. The reaction of H(2)L(1) and zinc(II) acetate in a 1:1 ratio yielded the pentanuclear homometallic complex of the dialdehyde H(2)L(1), [Zn(5)(L(1))(5)(H(2)O)(6)]·3H(2)O. An X-ray crystal structure determination revealed [Zn(3)(II)Pr(III)(L(Pr))(NO(3))(2)(DMF)(3)](NO(3))·0.9DMF has the large ten-coordinate lanthanide(III) ion bound in the central O(6) site with two bidentate nitrate anions completing the O(10) coordination sphere. The three square pyramidal zinc(II) ions are in the outer N(2)O(2) sites with a fifth donor from DMF. Measurement of the magnetic properties of [Zn(II)(3)Dy(III)(L(Pr))(NO(3))(3)(MeOH)(3)]·4H(2)O with a weak external dc field showed that it has a frequency-dependent out-of-phase component of ac susceptibility, indicative of slow relaxation of the magnetization (SMM behaviour). Likewise, the Er and Yb analogues are field-induced SMMs; the latter is only the second example of a Yb-based SMM. The neodymium, ytterbium and erbium complexes are luminescent in the solid phase, but only the ytterbium and neodymium complexes show strong lanthanide-centred luminescence in DMF solution.