Characterizing pathological imperfections in macromolecular crystals: lattice disorders and modulations

Macromolecular crystal structure determination can be complicated or brought to a halt by crystal imperfections. These issues motivated us to write up what we affectionately call ‘The Definitive Hitchhiker’s Guide to Pathological Macromolecular Crystals: Lattice Disorders and Modulations’. Perhaps the most challenging imperfections are lattice order–disorder phenomena and positional modulations. Many of these types of crystals have been solved, and progress has been made on the more challenging forms. Diagnostic tools and how to solve many of these problem crystal structures are reviewed. New avenues are provided for approaching the solution of incommensurately modulated crystals. There are a good number of case studies in the literature of lattice order–disorder phenomena and crystallographic modulations that make it timely to write a review. This review concludes with a projected pathway for solving incommensurately modulated crystals, personal views of future directions and needs of the crystallographic community.     

Carbon nitride materials: impact of synthetic method on photocatalysis and immobilization for photocatalytic pollutant degradation

Different synthesis routes for carbon nitride materials (CN) and the resulting products were compared to study the photocatalytic activity (pollutant degradation) in dependence on structure and properties. The CN materials were synthesized by thermal decomposition of dicyandiamide in air and under argon as well as in sealed ampoules with or without the use of a salt melt. The as-prepared materials were characterized by IR spectroscopy, nitrogen adsorption measurement, solid-state NMR spectroscopy, diffuse reflectance UV–Vis spectroscopy, elemental analysis and powder X-ray diffraction (PXRD). The surface polarity of the CN materials was estimated by adsorption of the dicyano-bis(1,10-phenanthroline)-iron(II) complex, which allows an evaluation of the degree of condensation. The CN materials were tested with regard to the photocatalytic degradation of rhodamine B (RhB). It is shown that the photocatalytic activity increases with higher surface polarity. Promising CN materials with high RhB degradation of 85% within 25 min and high surface polarity of 0.89 were selected for an immobilization approach to obtain coatings on a silicone substrate using a high-volume low-pressure (HVLP) spray coating technique. To study the photocatalytic activity of the catalyst coatings, the degradation rates of an aqueous RhB solution and solutions of organic pollutants such as triclosan and ethinyl estradiol were examined. Pollutants are decomposed with up to 63% of the initial concentration. Xenon lamps and different LEDs were used as light sources for comparison. Particularly high degradation efficiencies were obtained using LEDs, and the degradation rates are increased by adjusting the emission spectrum of the lamp to the pollutant and absorption edge of the catalyst, which results in a 40 times higher degradation efficiencies of LEDs compared to a Xe lamp.

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Groundwater problems in surface coal mining in Scotland

The paper reviews the problems encountered with groundwater in surface mining in Scotland. The problems which occur at various stages of the mining process from initial exploration to mine planning and final restoration are referred to. Special consideration is given to mine drainage and pumping methods.     

用氮气和戊基黄药浮选时黄铁矿的低电位疏水状态

为了解释和查明N2TEC浮选法的基本原理，本文报道了在用戊基钾黄药(PAX)作捕收剂时，黄铁矿的低电位疏水状态的研究成果。新制定的N2TEC浮选法的目的是提高难处理含金硫化矿金回收率。在典型的N2TEC浮选法中，用氮气代替空气作为浮选气体，戊基钾黄药作为评选含金黄铁矿颗粒的捕收剂。l997年3月，第一个N2TEC浮选工艺在内华达州Lone Tree矿山浮选厂投产，一直操作至今。根据电化学校制接触角测量结果，研究了黄铁矿的低电位、低pH疏水状态与浮选变量(pH、气相组成、捕收剂浓度和黄铁矿电位)之间的关系。     

Minimierung der Umbauzeiten bei Stahlwerksmodernisierungen am Beispiel eines Stranggießanlagen-Umbaues

In November 2000 the Belgian stainless steel producer UGINE & ALZ Belgium nv, a company of the Arcelor Group, awarded VAI a contract for the upgrading and expansion of their steelmaking plant. The overall project included the revamping and supply of new equipment and systems for the steelmaking, continuous casting and environmental protection facilities. An essential part of this ambitious modernization program was the upgrading and expansion of the existing single-strand slab caster, with an output of 600 000 t/a, to a combined single- or twin-strand slab caster with a nominal production capacity of 1.2 million tons — the world’s largest stainless steel slab caster. All upgrading and installation activities had to be carried out within an extremely tight caster shut-down period of 21 days only in order to minimize production losses. This paper discusses the innovative project management solutions implemented in combination with extensive preassembly activities and workshop testing to assure the successful outcome of this project.     

'EUROPART'. Airborne particles in the indoor environment. A European interdisciplinary review of scientific evidence on associations between exposure to particles in buildings and health effects

The relevance of particle mass, surface area or number concentration as risk indicators for health effects in non-industrial buildings has been assessed by a European interdisciplinary group of researchers (called EUROPART) by reviewing papers identified in Medline, Toxline, and OSH. Studies dealing with dermal effects or cancer or specifically addressing environmental tobacco smoke, house dust-mite, cockroach or animal allergens, microorganisms and pesticides were excluded. A total of 70 papers were reviewed, and eight were identified for the final review: Five experimental studies involving mainly healthy subjects, two cross-sectional office studies and one longitudinal study among elderly on cardiovascular effects. From most studies, no definite conclusions could be drawn. Overall, the group concluded that there is inadequate scientific evidence that airborne, indoor particulate mass or number concentrations can be used as generally applicable risk indicators of health effects in non-industrial buildings and consequently that there is inadequate scientific evidence for establishing limit values or guidelines for particulate mass or number concentrations.     

Treatment of gas-phase methanol in conventional biofilters packed with lava rock

The performance of laboratory scale methanol-degrading biofilters packed with lava rock was checked during almost 1 yr under different conditions. The biomass concentration and biomass adaptation of the inoculum dramatically affected the start-up and the performance of the systems during the first stages of operation. A fast start-up was obtained when using concentrated and adapted inocula, while diluted or non-adapted inocula proved to be much less efficient. The performance of the reactor during long-term operation was significantly affected by the toxic load and moisture content of the gas. Critical loads between 120 and 280 g/m(3)h were reached during different phases of the study. The reactor had a high stability to EBRT changes when working at values between 48.0 and 91.1s, showing little or no negative effect when decreasing the EBRT. Hardly any difference was observed regarding performance when using either a downflow or upflow feed, although slightly better results were obtained when working in a downflow mode.     

An extension of ASM2d including pH calculation

This paper presents an extension of the Activated Sludge Model No. 2d (ASM2d) including a chemical model able to calculate the pH value in biological processes. The developed chemical model incorporates the complete set of chemical species affecting the pH value to ASM2d describing non-equilibrium biochemical processes. It considers the system formed by one aqueous phase, in which biochemical processes take place, and one gaseous phase, and is based on the assumptions of instantaneous chemical equilibrium under liquid phase and kinetically governed mass transport between the liquid and gas phase. The ASM2d enlargement comprises the addition of every component affecting the pH value and an ion-balance for the calculation of the pH value and the dissociation species. The significant pH variations observed in a sequencing batch reactor operated for enhanced biological phosphorus removal were used to verify the capability of the extended model for predicting the dynamics of pH jointly with concentrations of acetic acid and phosphate. A pH inhibition function for polyphosphate accumulating bacteria has also been included in the model to simulate the behaviour observed. Experimental data obtained in four different experiments (with different sludge retention time and influent phosphorus concentrations) were accurately reproduced.     

Effect of agitation, turbidity, aluminium foil reflectors and container volume on the inactivation efficiency of batch-process solar disinfectors

We report the results of experiments designed to improve the efficacy of the solar disinfection of drinking water, inactivation process. The effects of periodic agitation, covering the rear surface of the container with aluminium foil, container volume and turbidity on the solar inactivation kinetics of Escherichia coli (starting population = 10(6) CFU ml(-1)) were investigated. It was shown that agitation promoted the release of dissolved oxygen from water with subsequent decrease in the inactivation rates of E. coli. In contrast, covering the rear surface of the solar disinfection container with aluminium foil improved the inactivation efficiency of the system. The mean decay constant for bacterial populations in foil-backed bottles was found to be a factor of 1.85 (std. dev. = 0.43) higher than that of non-foil-backed bottles. Inactivation rates decrease as turbidity increases. However, total inactivation was achievable in 300 NTU samples within 8 h exposure to strong sunshine. Inactivation kinetics was not dependent on the volume of the water container for volumes in the range 500-1500 ml.     

Environmental Implications of Treatment of Coastal Sewage Discharges

The environmental implications of implementing the requirement for treatment of coastal sewage prior to discharge, which were put forward in an EC draft Directive on municipal waste-water treatment, are examined. In order to establish the current situation, the results of a national survey of coastal and estuarine sewage discharges are presented. A review of the impact of sewage discharges on the marine environment is presented in conjunction with an assessment of the impact of sewage-treatment processes on the land and in the air. These aspects are integrated into overall conclusions about net environmental impact. Finally, a decision-tree approach to the assignment of priority to additional action required at individual locations is developed.