Modeling of secondary organic aerosol yields from laboratory chamber data

Laboratory chamber data serve as the basis for constraining models of secondary organic aerosol (SOA) formation. Current models fall into three categories: empirical two-product (Odum), product-specific, and volatility basis set. The product-specific and volatility basis set models are applied here to represent laboratory data on the ozonolysis of α-pinene under dry, dark, and low-NOx conditions in the presence of ammonium sulfate seed aerosol. Using five major identified products, the model is fit to the chamber data. From the optimal fitting, SOA oxygen-to-carbon (O/C) and hydrogen-to-carbon (H/C) ratios are modeled. The discrepancy between measured H/C ratios and those based on the oxidation products used in the model fitting suggests the potential importance of particle-phase reactions. Data fitting is also carried out using the volatility basis set, wherein oxidation products are parsed into volatility bins. The product-specific model is most likely hindered by lack of explicit inclusion of particle-phase accretion compounds. While prospects for identification of the majority of SOA products for major volatile organic compounds (VOCs) classes remain promising, for the near future empirical product or volatility basis set models remain the approaches of choice

Phase transition in the Higgs model of scalar dyons

In the present paper we investigate the phase transition "Coulomb--confinement" in the Higgs model of abelian scalar dyons -- particles having both, electric $e$ and magnetic $g$, charges. It is shown that by dual symmetry this theory is equivalent to scalar fields with the effective squared electric charge e^{*2}=e^2+g^2. But the Dirac relation distinguishes the electric and magnetic charges of dyons. The following phase transition couplings are obtained in the one--loop approximation: \alpha_{crit}=e^2_{crit}/4\pi\approx 0.19, \tilde\alpha_{crit}=g^2_{crit}/4\pi\approx 1.29 and \alpha^*_{crit}\approx 1.48.Comment: 16 pages, 2 figure

Energetic Components of Cooperative Protein Folding

A new lattice protein model with a four-helix bundle ground state is analyzed by a parameter-space Monte Carlo histogram technique to evaluate the effects of an extensive variety of model potentials on folding thermodynamics. Cooperative helical formation and contact energies based on a 5-letter alphabet are found to be insufficient to satisfy calorimetric and other experimental criteria for two-state folding. Such proteinlike behaviors are predicted, however, by models with polypeptide-like local conformational restrictions and environment-dependent hydrogen bonding-like interactions.Comment: 11 pages, 4 postscripts figures, Phys. Rev. Lett. (in press

Supercritical multicomponent solvent coal extraction

The yield of organic extract from the supercritical extraction of coal with larger diameter organic solvents such as toluene is increased by use of a minor amount of from 0.1 to 10% by weight of a second solvent such as methanol having a molecular diameter significantly smaller than the average pore diameter of the coal

Topological Bose-Mott Insulators in a One-Dimensional Optical Superlattice

We study topological properties of the Bose-Hubbard model with repulsive interactions in a one-dimensional optical superlattice. We find that the Mott insulator states of the single-component (two-component) Bose-Hubbard model under fractional fillings are topological insulators characterized by a nonzero charge (or spin) Chern number with nontrivial edge states. For ultracold atomic experiments, we show that the topological Chern number can be detected through measuring the density profiles of the bosonic atoms in a harmonic trap.Comment: 5 pages, published versio

The Dynamics of Charges Induced by a Charged Particle Traversing a Dielectric Slab

We studied the dynamics of surfacea and wake charges induced by a charged particle traversing a dielectric slab. It is shown that after the crossing of the slab first boundary, the induced on the slab surface charge (image charge) is transformed into the wake charge, which overflows to the second boundary when the particle crosses it. It is also shown, that the polarization of the slab is of an oscillatory nature, and the net induced charge in a slab remains zero at all stages of the motion.Comment: 12 pages, 1 figur

Fos co-operation with PTEN loss elicits keratoacanthoma not carcinoma due to p53/p21^WAF-induced differentiation triggered by GSK3b inactivation and reduced AKT activity

To investigate gene synergism in multistage skin carcinogenesis, the RU486-inducible cre/lox system was employed to ablate PTEN function [K14.cre/D5PTENflx] in mouse epidermis expressing activated v-fos [HK1.fos]. RU486-treated HK1.fos/D5PTENflx mice exhibited hyperplasia, hyperkeratosis and tumours that progressed to highly differentiated keratoacanthomas rather than carcinomas, due to re-expression of high p53 and p21WAF levels. Despite elevated MAP kinase activity, cyclin D1/E2 over expression and increased AKT activity forming areas of highly proliferative, papillomatous keratinocytes, increasing levels of GSK3b inactivation exceeded a threshold that induced p53/p21WAF expression to halt proliferation and accelerate differentiation, giving the hallmark keratosis of keratoacanthomas. A pivotal facet to this GSK3b-triggered mechanism centred on increasing p53 expression in basal layer keratinocytes. This reduced activated AKT expression and released inhibition of p21WAF, which accelerated keratinocyte differentiation, as indicated by unique basal layer expression of differentiation-specific keratin K1, alongside premature filaggrin and loricrin expression. Thus, fos synergism with PTEN loss elicited a benign tumour context where GSK3b-induced, p53/p21WAF expression continually switched AKT-associated proliferation into one of differentiation, preventing further progression. This putative compensatory mechanism required the critical availability of normal p53 and/or p21WAF otherwise deregulated fos, Akt and GSK3b associate with malignant progression

Piezoelectric copolymer hydrophones for ultrasonic field characterization

Hydrophones to be used in the characterization of medical ultrasonic transducers have been fabricated using a new polyvinylidene fluoride/trifluoroethylene (VF2/VF3) copolymer. The copolymer has an advantage over VF2 in that it does not require prestretching before poling. Thin copolymer films can be cast from solution and then poled using the corona discharge method. As there is a need for small‐diameter hydrophones to provide good spatial resolution in measuring highly focused ultrasonic beams, hydrophones with diameter as small as 0.1 mm have been made. Both needle‐type and line hydrophones have been tested and their performance reported. In the case of line hydrophones, the output signal is proportional to the line integral of the acoustic pressure and a computer tomographic technique has been used to reconstruct the beam profiles

Modelling the physical multiphase interactions of HNO₃ between snow and air on the Antarctic Plateau (Dome C) and coast (Halley)

Emissions of nitrogen oxide (NO_<i>x</i>  =  NO + NO₂) from the photolysis of nitrate (NO₃⁻) in snow affect the oxidising capacity of the lower troposphere especially in remote regions of high latitudes with little pollution. Current air&ndash;snow exchange models are limited by poor understanding of processes and often require unphysical tuning parameters. Here, two multiphase models were developed from physically based parameterisations to describe the interaction of nitrate between the surface layer of the snowpack and the overlying atmosphere. The first model is similar to previous approaches and assumes that below a threshold temperature, <i>T</i>_o, the air&ndash;snow grain interface is pure ice and above <i>T</i>_o a disordered interface (DI) emerges covering the entire grain surface. The second model assumes that air&ndash;ice interactions dominate over all temperatures below melting of ice and that any liquid present above the eutectic temperature is concentrated in micropockets. The models are used to predict the nitrate in surface snow constrained by year-round observations of mixing ratios of nitric acid in air at a cold site on the Antarctic Plateau (Dome C; 75°06′ S, 123°33′ E; 3233 m a.s.l.) and at a relatively warm site on the Antarctic coast (Halley; 75°35′ S, 26°39′ E; 35 m a.s.l). The first model agrees reasonably well with observations at Dome C (<i>C</i>_v(RMSE)  =  1.34) but performs poorly at Halley (<i>C</i>_v(RMSE)  =  89.28) while the second model reproduces with good agreement observations at both sites (<i>C</i>_v(RMSE)  =  0.84 at both sites). It is therefore suggested that in winter air–snow interactions of nitrate are determined by non-equilibrium surface adsorption and co-condensation on ice coupled with solid-state diffusion inside the grain, similar to Bock et al. (2016). In summer, however, the air&ndash;snow exchange of nitrate is mainly driven by solvation into liquid micropockets following Henry's law with contributions to total surface snow NO₃⁻ concentrations of 75 and 80 % at Dome C and Halley, respectively. It is also found that the liquid volume of the snow grain and air&ndash;micropocket partitioning of HNO₃ are sensitive to both the total solute concentration of mineral ions within the snow and pH of the snow. The second model provides an alternative method to predict nitrate concentration in the surface snow layer which is applicable over the entire range of environmental conditions typical for Antarctica and forms a basis for a future full 1-D snowpack model as well as parameterisations in regional or global atmospheric chemistry models

In-vivo magnetic resonance imaging of hyperpolarized silicon particles

Silicon-based micro and nanoparticles have gained popularity in a wide range of biomedical applications due to their biocompatibility and biodegradability in-vivo, as well as a flexible surface chemistry, which allows drug loading, functionalization and targeting. Here we report direct in-vivo imaging of hyperpolarized 29Si nuclei in silicon microparticles by MRI. Natural physical properties of silicon provide surface electronic states for dynamic nuclear polarization (DNP), extremely long depolarization times, insensitivity to the in-vivo environment or particle tumbling, and surfaces favorable for functionalization. Potential applications to gastrointestinal, intravascular, and tumor perfusion imaging at sub-picomolar concentrations are presented. These results demonstrate a new background-free imaging modality applicable to a range of inexpensive, readily available, and biocompatible Si particles.Comment: Supplemental Material include