The generalized identification of truly interfacial molecules (ITIM) algorithm for nonplanar interfaces

We present a generalized version of the ITIM algorithm for the identification of interfacial molecules, which is able to treat arbitrarily shaped interfaces. The algorithm exploits the similarities between the concept of probe sphere used in ITIM and the circumsphere criterion used in the α-shapes approach, and can be regarded either as a reference-frame independent version of the former, or as an extended version of the latter that includes the atomic excluded volume. The new algorithm is applied to compute the intrinsic orientational order parameters of water around a dodecylphosphocholine and a cholic acid micelle in aqueous environment, and to the identification of solvent-reachable sites in four model structures for soot. The additional algorithm introduced for the calculation of intrinsic density profiles in arbitrary geometries proved to be extremely useful also for planar interfaces, as it allows to solve the paradox of smeared intrinsic profiles far from the interface. © 2013 American Institute of Physics

Coupling and higher-order effects in the 12C(d,p)13C and 13C(p,d)12C reactions

Coupled channels calculations are performed for the 12C(d,p)13C and 13C(p,d)12C reactions between 7 and 60 MeV to study the effect of inelastic couplings in transfer reactions. The effect of treating transfer beyond Born approximation is also addressed. The coupling to the 12C 2+ state is found to change the peak cross-section by up to 15 %. Effects beyond Born approximation lead to a significant renormalization of the cross-sections, between 5 and 10 % for deuteron energies above 10 MeV, and larger than 10 % for lower energies. We also performed calculations including the remnant term in the transfer operator, which has a small impact on the 12C(d,p)13C(g.s.) and 13C(p,d)12C(g.s.) reactions. Above 30 MeV deuteron energy, the effect of the remnant term is larger than 10 % for the 12C(d,p)13C(3.09 MeV) reaction and is found to increase with decreasing neutron separation energy for the 3.09 MeV state of 13C. This is of importance for transfer reactions with weakly bound nuclei.Comment: 7 pages, 7 figures, submitted to Phys. Rev.

Random parking, Euclidean functionals, and rubber elasticity

We study subadditive functions of the random parking model previously analyzed by the second author. In particular, we consider local functions $S$ of subsets of $\mathbb{R}^d$ and of point sets that are (almost) subadditive in their first variable. Denoting by $\xi$ the random parking measure in $\mathbb{R}^d$, and by $\xi^R$ the random parking measure in the cube $Q_R=(-R,R)^d$, we show, under some natural assumptions on $S$, that there exists a constant $\bar{S}\in \mathbb{R}$ such that % $$\lim_{R\to +\infty} \frac{S(Q_R,\xi)}{|Q_R|}\,=\,\lim_{R\to +\infty}\frac{S(Q_R,\xi^R)}{|Q_R|}\,=\,\bar{S}$$ % almost surely. If $\zeta \mapsto S(Q_R,\zeta)$ is the counting measure of $\zeta$ in $Q_R$, then we retrieve the result by the second author on the existence of the jamming limit. The present work generalizes this result to a wide class of (almost) subadditive functions. In particular, classical Euclidean optimization problems as well as the discrete model for rubber previously studied by Alicandro, Cicalese, and the first author enter this class of functions. In the case of rubber elasticity, this yields an approximation result for the continuous energy density associated with the discrete model at the thermodynamic limit, as well as a generalization to stochastic networks generated on bounded sets.Comment: 28 page

Cosmological Consequences of Nearly Conformal Dynamics at the TeV scale

Nearly conformal dynamics at the TeV scale as motivated by the hierarchy problem can be characterized by a stage of significant supercooling at the electroweak epoch. This has important cosmological consequences. In particular, a common assumption about the history of the universe is that the reheating temperature is high, at least high enough to assume that TeV-mass particles were once in thermal equilibrium. However, as we discuss in this paper, this assumption is not well justified in some models of strong dynamics at the TeV scale. We then need to reexamine how to achieve baryogenesis in these theories as well as reconsider how the dark matter abundance is inherited. We argue that baryonic and dark matter abundances can be explained naturally in these setups where reheating takes place by bubble collisions at the end of the strongly first-order phase transition characterizing conformal symmetry breaking, even if the reheating temperature is below the electroweak scale $\sim 100$ GeV. We also discuss inflation as well as gravity wave smoking gun signatures of this class of models.Comment: 22 pages, 7 figure

Generation of Vorticity and Velocity Dispersion by Orbit Crossing

We study the generation of vorticity and velocity dispersion by orbit crossing using cosmological numerical simulations, and calculate the backreaction of these effects on the evolution of large-scale density and velocity divergence power spectra. We use Delaunay tessellations to define the velocity field, showing that the power spectra of velocity divergence and vorticity measured in this way are unbiased and have better noise properties than for standard interpolation methods that deal with mass weighted velocities. We show that high resolution simulations are required to recover the correct large-scale vorticity power spectrum, while poor resolution can spuriously amplify its amplitude by more than one order of magnitude. We measure the scalar and vector modes of the stress tensor induced by orbit crossing using an adaptive technique, showing that its vector modes lead, when input into the vorticity evolution equation, to the same vorticity power spectrum obtained from the Delaunay method. We incorporate orbit crossing corrections to the evolution of large scale density and velocity fields in perturbation theory by using the measured stress tensor modes. We find that at large scales (k~0.1 h/Mpc) vector modes have very little effect in the density power spectrum, while scalar modes (velocity dispersion) can induce percent level corrections at z=0, particularly in the velocity divergence power spectrum. In addition, we show that the velocity power spectrum is smaller than predicted by linear theory until well into the nonlinear regime, with little contribution from virial velocities.Comment: 27 pages, 14 figures. v2: reorganization of the material, new appendix. Accepted by PR

Bounding wide composite vector resonances at the LHC

In composite Higgs models (CHMs), electroweak precision data generically push colourless composite vector resonances to a regime where they dominantly decay into pairs of light top partners. This greatly attenuates their traces in canonical collider searches, tailored for narrow resonances promptly decaying into Standard Model final states. By reinterpreting the CMS same-sign dilepton (SS2$\ell$) analysis at the Large Hadron Collider (LHC), originally designed to search for top partners with electric charge $5/3$, we demonstrate its significant coverage over this kinematical regime. We also show the reach of the 13 TeV run of the LHC, with various integrated luminosity options, for a possible upgrade of the SS2$\ell$ search. The top sector of CHMs is found to be more fine-tuned in the presence of colourless composite resonances in the few TeV range.Comment: 9 pages, 5 figures. Minor corrections for publication in JHE

The geochemistry of gem opals as evidence of their origin

International audienceSeventy-seven gem opals from ten countries were analyzed by inductively coupled plasma-mass spectrometry (ICP-MS) through a dilution process, in order to establish the nature of the impurities. The results are correlated to the mode of formation and physical properties and are instrumental in establishing the geographical origin of a gem opal. The geochemistry of an opal is shown to be dependant mostly on the host rock, at least for examples from Mexico and Brazil, even if modified by weathering processes. In order of decreasing concentration, the main impurities present are Al, Ca, Fe, K, Na, and Mg (more than 500 ppm). Other noticeable elements in lesser amounts are Ba, followed by Zr, Sr, Rb, U, and Pb. For the first time, geochemistry helps to discriminate some varieties of opals. The Ba content, as well as the chondritenormalized REE pattern, are the keys to separating sedimentary opals (BaN110 ppm, Eu and Ce anomalies) from volcanic opals (Bab110 ppm, no Eu or Ce anomaly). The Ca content, and to a lesser extent that of Mg, Al, K and Nb, helps to distinguish gem opals from different volcanic environments. The limited range of concentrations for all elements in precious (play-of-color) compared to common opals, indicates that this variety must have very specific, or more restricted, conditions of formation. We tentatively interpreted the presence of impurities in terms of crystallochemistry, even if opal is a poorly crystallized or amorphous material. The main replacement is the substitution of Si4+ by Al3+ and Fe3+. The induced charge imbalance is compensated chiefly by Ca2+, Mg2+, Mn2+, Ba2+, K+, and Na+. In terms of origin of color, greater concentrations of iron induce darker colors (from yellow to "chocolate brown"). This element inhibits luminescence for concentrations above 1000 ppm, whereas already a low content in U (=1 ppm) induces a green luminescence

Predictions from Heavy New Physics Interpretation of the Top Forward-Backward Asymmetry

We derive generic predictions at hadron colliders from the large forward-backward asymmetry observed at the Tevatron, assuming the latter arises from heavy new physics beyond the Standard Model. We use an effective field theory approach to characterize the associated unknown dynamics. By fitting the Tevatron t \bar t data we derive constraints on the form of the new physics. Furthermore, we show that heavy new physics explaining the Tevatron data generically enhances at high invariant masses both the top pair production cross section and the charge asymmetry at the LHC. This enhancement can be within the sensitivity of the 8 TeV run, such that the 2012 LHC data should be able to exclude a large class of models of heavy new physics or provide hints for its presence. The same new physics implies a contribution to the forward-backward asymmetry in bottom pair production at low invariant masses of order a permil at most.Comment: 11 pages, 6 figures. v2: added remarks on EFT validity range, dijet bounds and UV completions; matches published versio

Extrapolation of neutron-rich isotope cross-sections from projectile fragmentation

Using the measured fragmentation cross sections produced from the 48Ca and 64Ni beams at 140 MeV per nucleon on 9Be and 181Ta targets, we find that the cross sections of unmeasured neutron rich nuclei can be extrapolated using a systematic trend involving the average binding energy. The extrapolated cross-sections will be very useful in planning experiments with neutron rich isotopes produced from projectile fragmentation. The proposed method is general and could be applied to other fragmentation systems including those used in other radioactive ion beam facilities.Comment: accepted for publication in Europhysics Letter