Multistep Dissociation of Fluorine Molecules under Extreme Compression.

All elements that form diatomic molecules, such as H_{2}, N_{2}, O_{2}, Cl_{2}, Br_{2}, and I_{2}, are destined to become atomic solids under sufficiently high pressure. However, as revealed by many experimental and theoretical studies, these elements show very different propensity and transition paths due to the balance of reduced volume, lone pair electrons, and interatomic bonds. The study of F under pressure can illuminate this intricate behavior since F, owing to its unique position on the periodic table, can be compared with H, with N and O, and also with other halogens. Nevertheless, F remains the only element whose solid structure evolution under pressure has not been thoroughly studied. Using a large-scale crystal structure search method based on first principles calculations, we find that, before reaching an atomic phase, F solid transforms first into a structure consisting of F_{2} molecules and F polymer chains and then into a structure consisting of F polymer chains and F atoms, a distinctive evolution with pressure that has not been seen in any other elements. Both intermediate structures are found to be metallic and become superconducting, a result that adds F to the elemental superconductors

High temperature superconductivity of quaternary hydrides XM3Be4H32 (X, M = Ca, Sr, Ba, Y, La, Ac, Th) under moderate pressure

The compressed hydrogen-rich compounds have received extensive attention as promising candidates for room temperature superconductivity, however, the high pressure required to stabilize such materials hinders their wide practical application. In order to search for potential superconducting hydrides that are stable at low pressures, we have investigated the crystal structures and properties of quaternary hydrides, XM3Be4H32 (X, M = Ca, Sr, Ba, Y, La, Ac, Th) based on the first-principles calculations. We identified nine dynamically stable compounds at moderate pressure of 20 GPa. Strikingly, their superconducting transition temperatures are much higher than that of liquid nitrogen, especially CaTh3Be4H32 (124 K at 5 GPa), ThLa3Be4H32(134 K at 10 GPa), LaAc3Be4H32 (135 K at 20 GPa) and AcLa3Be4H32 (153 K at 20 GPa) exhibit outstanding superconductivity at mild pressures. Metal atoms acting as pre-compressors donate abundant electrons to hydrogen, weakening the H-H covalent bond and thus facilitating the metallization of the hydrogen sublattice. At the same time, the appropriate combination of metal elements with different ionic radius and electronegativity can effectively tune the electronic structure near the Fermi level and improve the superconductivity. These findings fully reveal the great promise of hosting high-temperature superconductivity of quaternary hydrides at moderate pressures and will further promote related exploration.Comment: 14 pages, 6 figure

MECHANISMS UNDERLYING ACTION OF XINMAILONG INJECTION, A TRADITIONAL CHINESE MEDICINE IN CARDIAC FUNCTION IMPROVEMENT

Background: As a bioactive composite extracted from American cockroach, Xinmailong injection (XML) is used for the treatment of congestive heart failure (CHF) in China. Clinical data has provided evidence that XML has positive inotropic properties. The objective of this study was to assess the mechanisms involved in the therapeutical effect of XML on CHF. Materials and Methods: The effects of XML on the cardiac function in isolated rat heart were measured. A Ca2+ imaging technology was used in rat cardiomyocytes (H9c2 cells) to reveal the role of XML on Ca2+ channels. Meanwhile, the effects of XML on the activities of Na+/K+ ATPase and sodium/calcium exchanger were measured. In addition, the level of reactive oxygen species and the protein expressions for the superoxide dismutase and hemeoxygenase were determined in the cardiomyocytes. Results: The results showed that XML increased the electrical impulse-induced [Ca2+]i in H9c2 cells, which was dependant on extracellular Ca2+ and was abolished by ML218-HCl (a T-type Ca2+channels antagonist) but not nimodipine (a L-type Ca2+channels antagonist). Ouabain, a Na+/K+-ATPase inhibitor, increased the electrical impulse-induced [Ca2+]i, which was significantly inhibited by XML. Moreover, XML markedly inhibited the Na+/K+ ATPase activity in H9c2 cells. In addition, XML notably reduced the production of reactive oxygen species and enhanced the protein expressions of antioxidant enzymes including superoxide dismutase 1, superoxide dismutase 2 and hemeoxygenase 1 in H9c2 cell. Conclusion: Our findings pave the ways to the better understandings of the therapeutic effects of XML on cardiovascular system

A Grey Box Modeling Method for Fast Predicting Buoyancy-Driven Natural Ventilation Rates through Multi-Opening Atriums

The utilization of buoyancy-driven natural ventilation in atrium buildings during transitional seasons helps create a healthy and comfortable indoor environment by bringing fresh air indoors. Among other factors, the air flow rate is a key parameter determining the ventilation performance of an atrium. In this study, a grey box modeling method is proposed and a prediction model is built for calculating the buoyancy-driven ventilation rate using three openings. This model developed from Bruce’s neutral height-based formulation and conservation laws is supported with a theoretical structure and determined with 7 independent variables and 4 integrated parameters. The integrated parameters could be estimated from a set of simulated data and in the results, the error of the semi-empirical predictive equation derived from CFD (computational fluid dynamics) simulated data is controlled within 10%, which indicates that a reliable predictive equation could be established with a rather small dataset. This modeling method has been validated with CFD simulated data, and it can be applied extensively to similar buildings for designing an expected ventilation rate. The simplicity of this grey box modeling should save the evaluation time for new cases and help designers to estimate the ventilation performance and choose building optimal opening designs

Image Processing Techniques in Shockwave Detection and Modeling

Shockwave detection is critical in analyzing shockwave structure and location. High speed video imaging systems are commonly used to obtain image frames during shockwave control experiments. Image edge detection algorithms become natural choices in detecting shockwaves. In this paper, a computer software system designed for shockwave detection is introduced. Different image edge detection algorithms, including Roberts, Prewitt, Sobel, Canny, and Laplacian of Gaussian, are implemented and can be chosen by the users to easily and accurately detect the shockwaves. Experimental results show that the system meets the design requirements and can accurately detect shockwave for further analysis and applications

DataSheet_1_Associations between serum urate and telomere length and inflammation markers: Evidence from UK Biobank cohort.docx

ObjectiveHyperuricemia and gout have become gradually more common. The effect of serum urate on organism aging and systematic inflammation is not determined. This study aims to evaluate whether serum urate is causally associated with cellular aging markers and serum inflammation markers.MethodsA Mendelian randomization study was performed on summary-level data from the largest published genome-wide association studies. Single nucleotide polymorphisms with a genome-wide significance level were selected as instrumental variables for leukocyte telomere length (LTL), and serum soluble makers of inflammation (CRP, IL-6, TNF-α, and IGF-1). Standard inverse variance weighted (IVW) method was used as the primary statistical method. The weighted median, MR-Egger regression, and MR-PRESSO methods were used for sensitivity analysis.ResultsAn inverse causal association of genetically predicted serum urate levels and LTL was found using IVW method (OR: 0.96, 95%CI 0.95, 0.97; β=-0.040; SE=0.0072; P=4.37×10-8). The association was also supported by MR results using MR-Egger method and weighted median method. The MR-PRESSO analysis and leave-one-out sensitivity analysis supported the robustness of the combined results. In terms of other aging-related serum biomarkers, there was no evidence supporting a causal effect of serum urate on CRP, IL-6, TNF-α, or IGF-1 levels.ConclusionsSerum urate levels are negatively associated with telomere length but are not associated with serum soluble indicators of inflammation. Telomere length may be a critical marker that reflects urate-related organismal aging and may be a mechanism in the age-related pathologies and mortality caused by hyperuricemia.</p

The influence of envelope features on interunit dispersion around a naturally ventilated multi-story building

This study examines the influence of building envelope features on interunit dispersion around multi-story buildings, when the presence of an upstream interfering building is also considered. Validated CFD methods in the steady-state RANS framework are employed. In general, the reentry ratios of pollutant from a source unit to adjacent units are mostly in the order of 0.1%, but there are still many cases being in the order of 1%. The influence of envelope features is dependent strongly on the interaction between local wind direction and envelope feature. In a downward dominated near-facade flow field, the presence of vertical envelope features forms dispersion channels to intensify the unidirectional spread. Horizontal envelope features help induce the dilution of pollutant to the main stream and weakens largely the vertical interunit dispersion. The large influences caused by the presence of envelope features extend the existing understanding of interunit dispersion based on flat-facade buildings. © 2018, Tsinghua University Press and Springer-Verlag GmbH Germany, part of Springer Nature

CFD simulation of the effect of an upstream building on the inter-unit dispersion in a multi-story building in two wind directions

Previous studies on inter-unit dispersion are limited to isolated buildings. The influence of an upstream interfering building may significantly modify the indoor airflow characteristics of the wind-induced natural ventilated downstream interfered building. Motivated by the findings in previous studies, namely that infectious respiratory aerosols exhausted from a unit can re-enter into another unit in the same building through building envelope openings, this study investigates the inter-unit pollutant dispersion around a multi-story building in two wind directions by employing the computational fluid dynamics (CFD) method. The CFD model employed in this study has been validated against previous experimental data. The results show that the presence of an upstream building greatly changes the path lines around the downstream target building and the pollutant transportation routes around it. The presence of a low upstream building also greatly increases the average air exchange rate (ACH)values and the pollutant re-entry ratios (Rk) below the source unit on the windward side of the downstream target building for normal wind incidence. However, the presence of a high upstream building greatly increases the average ACH values on the windward side and increases the Rk on the leeward side of the downstream building for oblique wind incidence