Evolution of the nuclear modification factors with rapidity and centrality in d + Au collisions at (sqrt)[N(S)N]=200 GeV

We report on a study of the transverse momentum dependence of nuclear modification factors R(dAu) for charged hadrons produced in deuteron + gold collisions at sqrt[s(NN)]=200 GeV, as a function of collision centrality and of the pseudorapidity (eta=0, 1, 2.2, 3.2) of the produced hadrons. We find a significant and systematic decrease of R(dAu) with increasing rapidity. The midrapidity enhancement and the forward rapidity suppression are more pronounced in central collisions relative to peripheral collisions. These results are relevant to the study of the possible onset of gluon saturation at energies reached at BNL RHIC.     

Detection of ultrasound-modulated photons in diffuse media using the photorefractive effect

Ultrasound-modulated optical tomography is a dual-wave sensing technique in which diffusive light in a turbid medium interacts with an imposed acoustic field. A phase-modulated photon field emanates from the interaction region and carries with it information about the optomechanical properties of the medium. We present a technique for detection of ultrasound-induced optical phase modulation using an adaptive, photorefractive-crystal-based interferometry system. Experimental results are presented demonstrating detection of ultrasound-modulated signals in highly scattering media by use of pulsed ultrasound insonation.     

The preparation of a fully differentiated "multiwarhead" siderophore precursor

A protected, fully differentiated siderophore analogue has been prepared so that "Trojan Horse"-like siderophore drug conjugates with different drugs can be synthesized. The key steps in the synthesis include controlled preparation of an unsymmetrical urea and its conversion to a fully differentiated isocyanurate by reaction with chloro(carbonyl) isocyanate.     

Solvability of a finite or infinite system of discontinuous quasimonotone differential equations

This paper proves the existence of solutions to the initial value problem

where may be discontinuous but is assumed to satisfy conditions of superposition-measurability, quasimonotonicity, quasisemicontinuity, and integrability. The set can be arbitrarily large (finite or infinite); our theorem is new even for . The proof is based partly on measure-theoretic techniques used in one dimension under slightly stronger hypotheses by Rzymowski and Walachowski. Further generalizations are mentioned at the end of the paper.

     

Environmental decision‐making using Bayesian networks: creating an environmental report card

Environmental report cards are popular mechanisms for summarising the overall status of an environmental system of interest. This paper describes the development of such a report card in the context of a study for Gladstone Harbour in Queensland, Australia. The harbour is within the World Heritage‐protected Great Barrier Reef and is the location of major industrial development, hence the interest in developing a way of reporting its health in a statistically valid, transparent and sustainable manner. A Bayesian network (BN) approach was used because of its ability to aggregate and integrate different sources of information, provide probabilistic estimates of interest and update these estimates in a natural manner as new information becomes available. BN modelling is an iterative process, and in the context of environmental reporting, this is appealing as model development can be initiated while quantitative knowledge is still under development, and subsequently refined as more knowledge becomes available. Moreover, the BN model helps build the maturity of the quantitative information needed and helps target investment in monitoring and/or process modelling activities to inform the approach taken. The model is able to incorporate spatial and temporal information and may be structured in such a way that new indicators of relevance to the underlying environmental gradient being monitored may replace less informative indicators or be added to the model with minimal effort. The model described here focuses on the environmental component, but has the capacity to also incorporate social, cultural and economic components of the Gladstone Harbour Report Card. Copyright © 2016 John Wiley & Sons, Ltd.     

Velocity and surface pressure measurements in an open cavity

Subsonic flow of approximately Mach 0.2 over cavities with L/D ratios of 5.16 and 1.49 were studied experimentally using particle image velocimetry (PIV), surface pressure measurements, and hot-wire measurements. The incoming boundary layer was turbulent in both cases. The PIV data was analyzed to yield mean flow characteristics, vorticity field information, and two-point statistics for the velocity field. The hot-wire data was combined with surface pressure measurements to detail the correlations between velocity and pressure fluctuations. An analysis of the correlation between surface pressure measurements shows contrasting characteristics for the two cavity aspect ratios. The PIV data was combined with surface pressure measurements through the application of quadratic stochastic estimation to predict the time-dependent behavior of the velocity field. An examination of the results supports the existence of different cavity flow modes, as has been suggested in much of the literature.     

Can Counter-Intuitive Halogen Bonding Be Coulombic?

We use the term “counter-intuitive” to describe an intermolecular interaction in which the electrostatic potentials of the interacting regions of the ground-state molecules have the same sign, both positive or both negative. In the present work, we consider counter-intuitive halogen bonding with nitrogen bases, in which both the halogen σ-hole and the nitrogen lone pair have negative potentials on their molecular surfaces. We show that these interactions can be treated as Coulombic despite the apparent repulsion between the ground-state molecules, provided that both electrostatics and polarization are explicitly taken into account. We demonstrate first that the energies of 20 counter-intuitive interactions with four nitrogen bases can be expressed very well in terms of just two molecular properties: the electrostatic potential of the halogen σ-hole and the average polarizability of the nitrogen base. Then we show that the same two properties can also represent the energies of an expanded data base that includes the 20 counter-intuitive plus an additional 20 weak and moderately-strong intuitive halogen bonding interactions (in which the σ-hole potentials are now positive).     

Large Hexadecametallic {MnIII–LnIII} Wheels: Synthesis,Structural, Magnetic,and Theoretical Characterization

The synthesis, gas sorption studies, magnetic properties, and theoretical studies of new molecular wheels of core type {Mn^III₈Ln^III₈} (Ln=Dy, Ho, Er, Y and Yb), using the ligand mdeaH₂, in the presence of ortho‐toluic or benzoic acid are reported. From the seven wheels studied the {Mn₈Dy₈} and {Mn₈Y₈} analogues exhibit SMM behavior as determined from ac susceptibility experiments in a zero static magnetic field. From DFT calculations a S=16 ground state was determined for the {Mn₈Y₈} complex due to weak ferromagnetic Mn^III–Mn^III interactions. Ab initio CASSCF+RASSI‐SO calculations on the {Mn₈Dy₈} wheel estimated the Mn^III–Dy^III exchange interaction as ?0.1 cm^?1. This weak exchange along with unfavorable single‐ion anisotropy of Dy^III/Mn^III ions, however, led to the observation of SMM behavior with fast magnetic relaxation. The orientation of the g‐anisotropy of the Dy^III ions is found to be perpendicular to the plane of the wheel and this suggests the possibility of toroidal magnetic moments in the cluster. The {Mn₈Ln₈} clusters reported here are the largest heterometallic Mn^IIILn^III wheels and the largest {3d–4f} wheels to exhibit SMM behavior reported to date.     

Gas-phase domino cyclization of phosphonium ylides leading to the total synthesis of Eustifoline D

Six stabilised phosphonium ylides bearing ortho-benzylaminophenyl and cinnamoyl (or a heterocyclic analogue) groups have been prepared and upon flash vacuum pyrolysis at 800 °C were found to undergo cascade cyclization processes to give mainly 3-styrylquinolines but also in some cases ring-fused carbazoles and other fused-ring heterocyclic products. By starting with an appropriate ring-methylated precursor the natural product Eustifoline D was obtained in 19% yield in the pyrolysis in addition to the 3-(2-furylethenyl)quinoline (46%).