煤中微量元素间依存关系的聚类分析

通过对四种不同类型煤中灰分、硫分和１６种微量在不同密度级中呈的Ｒ型聚类分析,研究了煤中微量元素间的依存关系。结果表明：煤中碱土 金属Ｂｅ、Ｓｒ、Ｂａ彼此间的依存关系一般较弱,与所研究的其它元素的相关性也较北：稀土元素Ｌａ、Ｃｅ、Ｙ、Ｓｅ经常相伴而生;Ｖ总与灰分显著相关;Ａｓ、Ｃｏ、Ｎｉ等元素民黄铁矿硫的存在密切相关。     

Investigation of Viscosity and Density Versus Temperature in Comparison with 1H Nmr Relaxation time Results for O,M-, P-Xylenes and α -,β-, γ - Picolines

The paper presents the results of density and viscosity measurements in liquid derivatives of benzene and pyridine, well purified, degassed or aerated, depending on temperature, in the whole liquidity range. Gaseous admixtures were found to affect the viscosity of liquids. From one to three Arrhenius regions were observed, depending on the structure and orientational freedom of the molecules. the results are discussed on the background of 1H NMR relaxation time studies with regard to the effect of dipole interactions on the structure of close packing.     

Determining the role of the underlying orbital‐dependence of PBE0‐DH and PBE‐QIDH double‐hybrid density functionals

We study the orbital‐dependence of three (parameter‐free) double‐hybrid density functionals, namely the PBE0‐DH, the PBE‐QIDH models, and the SOS1‐PBE‐QIDH spin‐opposite‐scaled variant of the latter. To do it, we feed all their energy terms with different sets of orbitals obtained previously from self‐consistent density functional theory calculations using several exchange‐correlation functionals (e.g., PBE, PBE0, PBEH&H), or directly with HF‐PBE orbitals, to see their effect on selected datasets for atomization and reaction energies, the latter proned to marked self‐interaction errors. We find that the PBE‐QIDH double‐hybrid model shows a great consistency, as the best results are always obtained for the set of orbitals corresponding to its hybrid scheme, which prompts us to recommend this model without any other fitting or reparameterization. © 2017 Wiley Periodicals, Inc.     

中国突发性地质灾害分布的统计规律

本文根据地域间突发性地质灾害发生的相似性,将全国区划为9个自然区域;然后依据统计学的大数原理,建立了概率模型分析地质灾害在9个自然区域的分布特点以及隶属于各自然区域的所有省、市和自治区的地质灾害分布特征。结果显示不同类型与不同的区域之间存在着不同程度的强相依性,分布格局明显。     

Schnell-Methode zur Umsetzung von Kohlenwasserstoffen zu Wasserstoff für die Isotopenanalyse

Es wird eine weiterentwickeltes, isotopenanalytisches Verfahren zur probenchemischen Umsetzung von Kohlenwasserstoffen mit Chromium zu Wasserstoff bei 1300 K vorgestellt. Die erzielten Testergebnisse zeigen anhand der gemessenen δD-Werte, daβ Quarzöfen bei diesen Temperaturen noch keine die Isotopenmeβwerte beeinflussende Diffusion von Wasserstoff durch die Wandung zulassen. Auβerdem erfolgte die Reaktion nahezu spontan und vollständig, was die Methode zeitlich sehr effektiv macht.

A modified isotope analytical method is presented for the chemical reaction of hydrocarbons with chromium at 1300 K to form hydrogen. The test results obtained (i.e. the measured δD-values) show that at this temperature quartz heating tubes do not allow hydrogen to diffuse through the wail, which fact would influence the isotopic composition. Furthermore the reaction proceeds nearly spontaneously and quantitatively, which yields an effective method, especially with respect to time.     

Free (open) boundary condition: some experiences with viscous flow simulations

The free (or open) boundary condition (FBC, OBC) was proposed by Papanastasiou et al. (A new outflow boundary condition, International Journal for Numerical Methods in Fluids, 1992; 14:587–608) to handle truncated domains with synthetic boundaries where the outflow conditions are unknown. In the present work, implementation of the FBC has been tested in several benchmark problems of viscous flow in fluid mechanics. The FEM is used to provide numerical results for both cases of planar and axisymmetric domains under laminar, isothermal or non‐isothermal, steady‐state conditions, for Newtonian fluids. The effects of inertia, gravity, compressibility, pressure dependence of the viscosity, slip at the wall, and surface tension are all considered individually in the extrudate‐swell benchmark problem for a wide range of the relevant parameters. The present results extend previous ones regarding the applicability of the FBC and show cases where the FBC is inappropriate, namely in the extrudate‐swell problem with gravity or surface‐tension effects. Particular emphasis has been given to the pressure at the outflow, which is the most sensitive quantity of the computations. In all cases where FBC is appropriate, excellent agreement has been found in comparisons with results from very long domains. The formulation for Picard‐type iterations is given in some detail, and the differences with the Newton–Raphson formulation are highlighted regarding some computational aspects. Copyright © 2011 John Wiley & Sons, Ltd.     

Exact controllability and continuous dependence of fractional neutral integro-differential equations with state-dependent delay

In the present paper, with the help of the resolvent operator and some analytic methods, the exact controllability and continuous dependence are investigated for a fractional neutral integro-differential equations with state-dependent delay. As an application, we also give one example to demonstrate our results.     

Barrier degradation of tunneling magnetoresistance device with MgO barrier and low resistance-area product

MgO barrier degradation is studied in a tunneling magnetoresistance head with low resistance-area product. As the stress current is increased, the resistance is significantly reduced before the barrier breakdown, while the magnetoresistance ratio remains almost unvaried. At the same time, the bias dependence of the resistance becomes less affected by the bias polarity, suggesting that slight degradation occurs at the interface between MgO and the ferromagnetic electrode. Just before the breakdown, the bias dependence shows an increasing tendency, indicating the defect accumulation inside the MgO barrier. The results are helpful for understanding the mechanisms of barrier degradation, which is critical for developing future magnetic tunneling junction devices.     

Rotational dependences of line half-widths for CO and CO2 confined in SiO2/Al2O3 xerogel

The absorption spectra of CO and CO₂ confined in nanopores of SiO₂/Al₂O₃ xerogel have been measured using a Bruker IFS-125 HR Fourier spectrometer. Dependences of the half-width values on rotational quantum numbers and the line shift mean values are studied and compared with the data available in literature. Possible causes which can affect the rotational dependences are discussed.