Synthesis and properties of cinnamic acid series organic UV ray absorbents–interleaved layered double hydroxides

Organic ultraviolet (UV) ray absorbents, cinnamic acid (CA) and p-methoxycinnamic acid (PMOCA) were intercalated into Zn₂Al layered double hydroxides (Zn₂Al-LDHs) by co-precipitation reaction. The organic–inorganic nanocomposites, Zn₂Al-LDH/CA and Zn₂Al-LDH/PMOCA were obtained. The samples showed excellent UV ray absorption ability and their catalytic activity for the air oxidation of castor oil greatly decreased when the organic UV ray absorbents were intercalated in the layers of the Zn₂Al-LDHs. The studies suggested that Zn₂Al-LDH/organic UV absorbent nanocomposites might be used as safe sunscreen materials.     

Solid–liquid phase equilibria of binary indole mixtures with some aromatic compounds using a solid–liquid–vapor equation-of-state

The separation of useful chemicals, such as indole from coal tar, is an important subject of research in the field of fossil energy, renewable energy, and utilization of byproducts and waste materials. High-pressure crystallization is one of the proposed separation methods. To understand the process requires detailed knowledge of solid–liquid phase behaviors. Solid–liquid phase equilibrium data of various binary mixtures of indole have been reported in the literature. In the present report, we analyze some of the experimental data with our unified solid–liquid–vapor equation-of-state to see whether our model can be useful for the calculation of solid–liquid equilibria in these organic systems. Good correlations of the data and predictions of phase behavior, at very high pressures, are demonstrated.     

面向对象的黑河下游河岸林植被覆盖信息分类!

地表植被覆盖是描述区域生态系统的基础数据,也是全球及区域陆面过程、生态与水文众多模型中所需的重要地表参数。对于黑河下游额济纳绿洲,以Landsat 30m分辨率为主的遥感影像难以真实提取下游绿洲河岸林植被覆盖信息,而高分辨率影像目标地物轮廓清晰、空间细节信息丰富,有利于干旱背景下景观破碎、异质性强的植被覆盖信息分类。基于黑河下游额济纳绿洲QuickBird影像,通过面向对象的分类方法提取耕地、胡杨、柽柳、草地和裸地等主要植被覆盖类型,分类总体精度和Kappa系数分别为84.71%和0.7986。结果表明:利用面向对象分类方法对高分辨率影像进行植被覆盖信息分类,分类结果较好,能够满足精度要求。     

A detection problem: Sensitivity and uncertainty analysis of a land surface temperature approach to detecting dynamics of water use by groundwater-dependent vegetation

Sustainable management of groundwater-dependent vegetation (GDV) requires the accurate identification of GDVs, characterisation of their water use dynamics and an understanding of associated errors. This paper presents sensitivity and uncertainty analyses of one GDV mapping method which uses temperature differences between time-series of modelled and observed land surface temperature (LST) to detect groundwater use by vegetation in a subtropical woodland. Uncertainty in modelled LST was quantified using the Jacobian method with error variances obtained from literature. Groundwater use was inferred where modelled and observed LST were significantly different using a Student's t-test. Modelled LST was most sensitive to low-range wind speeds (<1.5 m s⁻¹), low-range vegetation height (<=0.5 m), and low-range leaf area index (<=0.5 m² m⁻²), limiting the detectability of groundwater use by vegetation under such conditions. The model-data approach was well-suited to detection of GDV because model-data errors were lowest for climatic conditions conducive to groundwater use.     

Uncertainty quantification and apportionment in air quality models using the polynomial chaos method

Current air quality models generate deterministic forecasts by assuming perfect model, perfectly known parameters, and exact input data. However, our knowledge of the physics is imperfect. It is of interest to extend the deterministic simulation results with “error bars” that quantify the degree of uncertainty, and analyze the impact of the uncertainty input on the simulation results. This added information provides a confidence level for the forecast results. Monte Carlo (MC) method is a popular approach for air quality model uncertainty analysis, but it converges slowly. This work discusses the polynomial chaos (PC) method that is more suitable for uncertainty quantification (UQ) in large-scale models. We propose a new approach for uncertainty apportionment (UA), i.e., we develop a PC approach to attribute the uncertainties in model results to different uncertainty inputs. The UQ and UA techniques are implemented in the Sulfur Transport Eulerian Model (STEM-III). A typical scenario of air pollution in the northeast region of the USA is considered. The UQ and UA results allow us to assess the combined effects of different input uncertainties on the forecast uncertainty. They also enable to quantify the contribution of input uncertainties to the uncertainty in the predicted ozone and PAN concentrations.     

Carbon Black-Supported Single-Atom Co?N?C as an Efficient Oxygen Reduction Electrocatalyst for H2O2 Production in Acidic Media and Microbial Fuel Cell in Neutral Media

Single metal atom isolated in nitrogen-doped carbon materials (M N C) are effective electrocatalysts for oxygen reduction reaction (ORR), which produces H₂O₂ or H₂O via 2-electron or 4-electron process. However, most of M N C catalysts can only present high selectivity for one product, and the selectivity is usually regulated by complicated structure design. Herein, a carbon black-supported Co N C catalyst (CB@Co N C) is synthesized. Tunable 2-electron/4-electron behavior is realized on CB@Co-N-C by utilizing its H₂O₂ yield dependence on electrolyte pH and catalyst loading. In acidic media with low catalyst loading, CB@Co N C presents excellent mass activity and high selectivity for H₂O₂ production. In flow cell with gas diffusion electrode, a H₂O₂ production rate of 5.04 mol h⁻¹ g⁻¹ is achieved by CB@Co N C on electrolyte circulation mode, and a long-term H₂O₂ production of 200 h is demonstrated on electrolyte non-circulation mode. Meanwhile, CB@Co N C exhibits a dominant 4-electron ORR pathway with high activity and durability in pH neutral media with high catalyst loading. The microbial fuel cell using CB@Co N C as the cathode catalyst shows a peak power density close to that of benchmark Pt/C catalyst.     

Modelling water dynamics with DNDC and DAISY in a soil of the North China Plain: A comparative study

The performance of the DNDC and Daisy model to simulate the water dynamics in a floodplain soil of the North China Plain was tested and compared. While the DNDC model uses a simple cascade approach, the Daisy model applies the physically based Richard's equation for simulating water movement in soil. For model testing a three years record of the soil water content from the Dong Bei Wang experimental station near Beijing was used. There, the effect of nitrogen fertilization, irrigation and straw removal on soil water and nitrogen dynamics was investigated in a three factorial field experiment applying a split-split-plot design with 4 replications. The dataset of one treatment was used for model testing and calibration. Two other independent datasets from further treatments were employed for validating the models. For both models, the simulation results were not satisfying using default parameters. After parameter optimisation and the use of site-specific van Genuchten parameters, however, the Daisy model performed well. But, for the DNDC model, parameter optimisation failed to improve the simulation result. Owing to the fact that many biological processes such as plant growth, nitrification or denitrification depend strongly on the soil water content, our findings bring us to the conclusion that the site-specific suitability of the DNDC model for simulating the soil water dynamics should be tested before further simulation of other processes.     

Uncertainty propagation in puff-based dispersion models using polynomial chaos

Atmospheric dispersion is a complex nonlinear physical process with numerous uncertainties in model parameters, inputs, source parameters, initial and boundary conditions. Accurate propagation of these uncertainties through the dispersion models is crucial for a reliable prediction of the probability distribution of the states and assessment of risk. A simple three-dimensional Gaussian puff-based dispersion model is used as a test case to study the effect of uncertainties in the model parameters and initial conditions on the output concentration. A polynomial chaos based approach is used to numerically investigate the evolution of the model output uncertainties due to initial condition and parametric uncertainties. The polynomial chaos solution is found to be an accurate approximation to ground truth, established by Monte Carlo simulation, while offering an efficient computational approach for large nonlinear systems with a relatively small number of uncertainties.     

Sensitivity analysis of the rice model WARM in Europe: Exploring the effects of different locations,climates and methods of analysis on model sensitivity to crop parameters

Sensitivity analysis studies how the variation in model outputs can be due to different sources of variation. This issue is addressed, in this study, as an application of sensitivity analysis techniques to a crop model in the Mediterranean region. In particular, an application of Morris and Sobol' sensitivity analysis methods to the rice model WARM is presented. The output considered is aboveground biomass at maturity, simulated at five rice districts of different countries (France, Greece, Italy, Portugal, and Spain) for years characterized by low, intermediate, and high continentality. The total effect index of Sobol' (that accounts for the total contribution to the output variation due a given parameter) and two Morris indices (mean μ and standard deviation σ of the ratios output changes/parameter variations) were used as sensitivity metrics. Radiation use efficiency (RUE), optimum temperature (T_opt), and leaf area index at emergence (LAI_ini) ranked in most of the combinations site × year as first, second and third most relevant parameters. Exceptions were observed, depending on the sensitivity method (e.g. LAI_ini resulted not relevant by the Morris method), or site-continentality pattern (e.g. with intermediate continentality in Spain, LAI_ini and T_opt were second and third ranked; with low continentality in Portugal, RUE was outranked by T_opt). Low σ values associated with the most relevant parameters indicated limited parameter interactions. The importance of sensitivity analyses by exploring site × climate combinations is discussed as pre-requisite to evaluate either novel crop-modelling approaches or the application of known modelling solutions to conditions not explored previously. The need of developing tools for sensitivity analysis within the modelling environment is also emphasized.     

Identification of relationship between sunspots and natural runoff in the Yellow River based on discrete wavelet analysis

Annual natural runoff is an important index of a river, which may be affected by solar activities. In this study, 304 years of annual natural runoff at the Sanmenxia station located in the Yellow River and the sunspot relative number are decomposed with the application of a Complex Morlet. According to the results of real part, modulus and second power of modulus, the annual runoff series at the Sanmenxia station has an obvious periodic oscillation on 90–100, 50–80, 35–50, 15–35, about 10, and less than 10-year scales. Also, there are obvious periodic variability with 60–90 years, 30–50 years and about 10 years. There are two centers of energy: one is about 1840–1850 on 7–11-year scale and the other is about 1825–1925 on 60–70-year scale. From the wavelet variance, 3, 26, 46, 68 year periods are detected within a 100-year scale, and the 68-year period is the most significant. Similar analyses are conducted for the sunspot relative number within the same period 1700–2003. The sunspot series shows 11- and 60-year period variation, as well as eight energy centers. Then, the correlation analyses for 11- and 60-year serial scales are computed. From a long-term period (1700–2003) view, there is no notable correlation between the natural runoff and the sunspot relative number; however, it is evident that the correlations exist within a short-term period. The results also indicate that the relationships between solar activities and the natural runoff in the Yellow River are complicated.