Density scaling in viscous liquids: From relaxation times to four-point susceptibilities

We present numerical calculations of a four-point dynamic susceptibility, chi_4(t), for the Kob-Andersen Lennard-Jones mixture as a function of temperature T and density rho. Over a relevant range of T and rho, the full t-dependence of chi_4(t) and thus the maximum in chi_4(t), which is proportional to the dynamic correlation volume, are invariant for state points for which the scaling variable rho^gamma/T is constant. The value of the material constant gamma is the same as that which superposes the relaxation time, tau, of the system versus rho^gamma/T. Thus, the dynamic correlation volume is directly related to tau for any thermodynamic condition in the regime where density scaling holds. Finally, we examine the conditions under which the density scaling properties are related to the existence of strong correlations between pressure and energy fluctuations.Comment: 5 pages, 4 figures, updated reference

On the dependence of the avalanche angle on the granular layer thickness

A layer of sand of thickness h flows down a rough surface if the inclination is larger than some threshold value theta which decreases with h. A tentative microscopic model for the dependence of theta with h is proposed for rigid frictional grains, based on the following hypothesis: (i) a horizontal layer of sand has some coordination z larger than a critical value z_c where mechanical stability is lost (ii) as the tilt angle is increased, the configurations visited present a growing proportion $_s of sliding contacts. Instability with respect to flow occurs when z-z_s=z_c. This criterion leads to a prediction for theta(h) in good agreement with empirical observations.Comment: 6 pages, 2 figure

Mapping the Evolution of Optically-Generated Rotational Wavepackets in a Room Temperature Ensemble of D2_2

A coherent superposition of rotational states in D$_2$ has been excited by nonresonant ultrafast (12 femtosecond) intense (2 $\times$ 10$^{14}$ Wcm$^{-2}$) 800 nm laser pulses leading to impulsive dynamic alignment. Field-free evolution of this rotational wavepacket has been mapped to high temporal resolution by a time-delayed pulse, initiating rapid double ionization, which is highly sensitive to the angle of orientation of the molecular axis with respect to the polarization direction, $\theta$. The detailed fractional revivals of the neutral D$_2$ wavepacket as a function of $\theta$ and evolution time have been observed and modelled theoretically.Comment: 4 pages, 3 figures. Accepted for publication in Phys. Rev. A. Full reference to follow.

Physicochemical Properties of 4-(4-Hydroxyphenyl)-butan-2-one (‘Raspberry Ketone’) Evaluated Using a Computational Chemistry Approach

Raspberry ketone (RK) is a product of the phenylpropanoid pathway in a variety of plants and is the second mostexpensive natural flavouring in the world. It is also widely used as a nutritional supplement due to its reported ability to promotelipolysis and fat oxidation in vivo. We have evaluated the thermodynamics of RK using the correlation consistent ccCA-CBS-2approach which afforded calculation of (inter alia) the enthalpy of formation. To obtain pKa, log D, electrode potential, solubility,and reactivity indices, we used TPSS/def2-TZVP geometries followed by single-point energies obtained at the M06-2X/def2-TZVPP level of theory. We obtained ΔfHo = −299.4 ± 0.17 kJ·mol−1; the pKa and logD were found to be 9.95 and 1.84, respectively,consistent with chemometric predictions. Using the enthalpy of fusion obtained from theory, we evaluated the aqueous solubility ofRK to be in the region of 2.5 mg·mL−1 which is in agreement with limited literature reports. In terms of reactivity, we obtained aformal electrode potential of 1.29 V (vs SHE) at pH 7.4 and 298.15 K. The HOMO−LUMO energy separation in an aqueousenvironment was found to be ca. 7.8 eV, suggesting moderate chemical reactivity. Analysis of the frontier molecular orbitals usingconceptual density functional theory supported this and revealed a reactivity pattern consistent with the metabolite profile obtainedin mammals, namely, a propensity for nucleophilic attack at the carbonyl carbon and electrophilic addition of the benzene ring

The consequence of excess configurational entropy on fragility: the case of a polymer/oligomer blend

By taking advantage of the molecular weight dependence of the glass transition of polymers and their ability to form perfectly miscible blends, we propose a way to modify the fragility of a system, from fragile to strong, keeping the same glass properties, i.e. vibrational density of states, mean-square displacement and local structure. Both slow and fast dynamics are investigated by calorimetry and neutron scattering in an athermal polystyrene/oligomer blend, and compared to those of a pure 17-mer polystyrene considered to be a reference, of same Tg. Whereas the blend and the pure 17-mer have the same heat capacity in the glass and in the liquid, their fragilities differ strongly. This difference in fragility is related to an extra configurational entropy created by the mixing process and acting at a scale much larger than the interchain distance, without affecting the fast dynamics and the structure of the glass

A qualitative evaluation of healthy weight services in a local authority in England

Objective The purpose of this study was to evaluate the healthy weight services in one local authority in England, where obesity levels have been above the national average since 2006. Design We conducted process and outcome evaluation using a qualitative methodology. Data were generated in focus group discussions and semi-structured interviews with clients, practitioners, healthcare professionals and volunteers. Results Ninety-one individuals from six services participated in the evaluation. Staff competencies and empowerment outcomes were identified as areas of strength. However, despite examples of excellent practice and enthusiastic recommendations from clients, access and referral processes were areas of weakness. Conclusion In England, local authorities have an important role to play in tackling obesity. It is crucial that they are provided with the tools to be able to implement healthy weight interventions effectively. A whole-systems approach presents a real opportunity for staff in local authorities and public health to work collaboratively and innovatively towards the same goal of continuous improvement in obesity management

Associations between the combined physical activity environment, socioeconomic status, and 1 obesity: a cross-sectional study

Aims: This study investigates associations between the combined physical activity environment and obesity and explores any sub-group effects by individual-level socioeconomic status. Methods: In a large cross-sectional cohort (n = 22,889) from the Yorkshire Health Study, body mass index was calculated using self-reported height and weight and obesity was defined as a body mass index ≥ 30. The physical activity environment was split into ‘unfavourable physical activity’, ‘moderately favourable physical activity’ and ‘favourable physical activity’ environments. This was based on the count of parks and physical activity facilities within a 2 km radial buffer centred on home addresses. A favourable physical activity environment was defined as having ≥1 physical activity facility and ≥1 park, unfavourable as having no physical activity facility and park and any other combinations defined as moderately favourable. Logistic regression (odds ratios) identified associations with obesity. Results: Relative to ‘unfavourable physical activity environments’, individuals within favourable physical activity environments were less likely to be obese (odds ratio = 0.90; 95% confidence interval = 0.82–0.97), and there was no effect for moderately favourable environment. Furthermore, once stratified by education level, this relationship was only present for those of higher education. Conclusion: Our findings provide novel UK evidence and is one of the first papers internationally that highlights the importance of considering the interplay of individual-level socioeconomic factors when investigating associations between the physical activity environment and obesity

Searches for New Quarks and Leptons Produced in Z-Boson Decay

We have searched for events with new-particle topologies in 390 hadronic Z decays with the Mark II detector at the SLAC Linear Collider. We place 95%-confidence-level lower limits of 40.7 GeV/c^2 for the top-quark mass, 42.0 GeV/c^2 for the mass of a fourth-generation charge - 1/3 quark, and 41.3 GeV/c^2 for the mass of an unstable Dirac neutral lepton

Measurement of Z Decays into Lepton Pairs

We present measurements by the Mark II experiment of the ratios of the leptonic partial widths of the Z boson to the hadronic partial width. The results are Γ_(ee)/Γ_(had)=0.037_(-0.012^()+0.016),Γ_(µµ)/Γ_(had)=0.053-_(0.015)^(+0.020), and Γ_(ττ)/Γ_(had)=0.066_(-0.017)^(+0.021), in good agreement with the standard-model prediction of 0.048. From the average leptonic width result, Γ_(ll)/Γ_(had)=0.053_(-0.009)^(+0.010), we derive Γ_(had)=1.56_(-0.24)^(+0.28) GeV. We find for the vector coupling constants of the tau and muon v_τ^2=0.31±0.31_(-0.30)^(+0.43) and v_μ^2=0.05±0.30_(-0.23)^(+0.34)

Multi-stage scheme for nonlinear Breit-Wheeler pair-production utilising ultra-intense laser-solid interactions

Multi-petawatt (PW) lasers enable intensities exceeding 1023 W cm-2, at which point quantum electrodynamics (QED) processes, such as electron-positron pair-production via the nonlinear Breit-Wheeler process, will play a significant role in laser-plasma interactions. Using 2D QED-particle-in-cell simulations, we present a two-stage scheme in which nonlinear pair-production is induced via an ultra-intense laser-solid interaction. The first stage is the generation of a γ-ray beam, through the interaction of an ultra-intense laser pulse with a thick target, whose features are found to be strongly dependent on collective plasma effects. This compact, high energy γ-ray beam (characterised by a divergence half-angle ∼10° and average photon energy ∼10 MeV) then interacts with two counter-propagating laser pulses. By varying the laser polarisation and angle of incidence, we show that in the case of two circularly polarised laser pulses propagating at an angle equal to the divergence half-angle of the γ-ray beam, the produced positron distribution is highly anisotropic compared to the case of a standard head-on collision