Integration of QSAR models for bioconcentration suitable for REACH

Energy Technology Data Exchange (ETDEWEB)

Gissi, Andrea [Laboratory of Chemistry and Environmental Toxicology, IRCCS - Istituto di Ricerche Farmacologiche “Mario Negri”, via Giuseppe La Masa 19, 20156 Milan (Italy); Dipartimento di Farmacia — Scienze del Farmaco, Università degli Studi di Bari “Aldo Moro”, via Orabona 4, I-70125 Bari (Italy); Nicolotti, Orazio; Carotti, Angelo; Gadaleta, Domenico [Dipartimento di Farmacia — Scienze del Farmaco, Università degli Studi di Bari “Aldo Moro”, via Orabona 4, I-70125 Bari (Italy); Lombardo, Anna [Laboratory of Chemistry and Environmental Toxicology, IRCCS - Istituto di Ricerche Farmacologiche “Mario Negri”, via Giuseppe La Masa 19, 20156 Milan (Italy); Benfenati, Emilio, E-mail: benfenati@marionegri.it [Laboratory of Chemistry and Environmental Toxicology, IRCCS - Istituto di Ricerche Farmacologiche “Mario Negri”, via Giuseppe La Masa 19, 20156 Milan (Italy)

2013-07-01

QSAR (Quantitative Structure Activity Relationship) models can be a valuable alternative method to replace or reduce animal test required by REACH. In particular, some endpoints such as bioconcentration factor (BCF) are easier to predict and many useful models have been already developed. In this paper we describe how to integrate two popular BCF models to obtain more reliable predictions. In particular, the herein presented integrated model relies on the predictions of two among the most used BCF models (CAESAR and Meylan), together with the Applicability Domain Index (ADI) provided by the software VEGA. Using a set of simple rules, the integrated model selects the most reliable and conservative predictions and discards possible outliers. In this way, for the prediction of the 851 compounds included in the ANTARES BCF dataset, the integrated model discloses a R{sup 2} (coefficient of determination) of 0.80, a RMSE (Root Mean Square Error) of 0.61 log units and a sensitivity of 76%, with a considerable improvement in respect to the CAESAR (R{sup 2} = 0.63; RMSE = 0.84 log units; sensitivity 55%) and Meylan (R{sup 2} = 0.66; RMSE = 0.77 log units; sensitivity 65%) without discarding too many predictions (118 out of 851). Importantly, considering solely the compounds within the new integrated ADI, the R{sup 2} increased to 0.92, and the sensitivity to 85%, with a RMSE of 0.44 log units. Finally, the use of properly set safety thresholds applied for monitoring the so called “suspicious” compounds, which are those chemicals predicted in proximity of the border normally accepted to discern non-bioaccumulative from bioaccumulative substances, permitted to obtain an integrated model with sensitivity equal to 100%. - Highlights: • Applying two independent QSAR models for bioconcentration factor increases the prediction. • The concordance of the models is an important component of the integration. • The measurement of the applicability domain improves the

Integration of QSAR models for bioconcentration suitable for REACH

International Nuclear Information System (INIS)

Gissi, Andrea; Nicolotti, Orazio; Carotti, Angelo; Gadaleta, Domenico; Lombardo, Anna; Benfenati, Emilio

2013-01-01

QSAR (Quantitative Structure Activity Relationship) models can be a valuable alternative method to replace or reduce animal test required by REACH. In particular, some endpoints such as bioconcentration factor (BCF) are easier to predict and many useful models have been already developed. In this paper we describe how to integrate two popular BCF models to obtain more reliable predictions. In particular, the herein presented integrated model relies on the predictions of two among the most used BCF models (CAESAR and Meylan), together with the Applicability Domain Index (ADI) provided by the software VEGA. Using a set of simple rules, the integrated model selects the most reliable and conservative predictions and discards possible outliers. In this way, for the prediction of the 851 compounds included in the ANTARES BCF dataset, the integrated model discloses a R 2 (coefficient of determination) of 0.80, a RMSE (Root Mean Square Error) of 0.61 log units and a sensitivity of 76%, with a considerable improvement in respect to the CAESAR (R 2 = 0.63; RMSE = 0.84 log units; sensitivity 55%) and Meylan (R 2 = 0.66; RMSE = 0.77 log units; sensitivity 65%) without discarding too many predictions (118 out of 851). Importantly, considering solely the compounds within the new integrated ADI, the R 2 increased to 0.92, and the sensitivity to 85%, with a RMSE of 0.44 log units. Finally, the use of properly set safety thresholds applied for monitoring the so called “suspicious” compounds, which are those chemicals predicted in proximity of the border normally accepted to discern non-bioaccumulative from bioaccumulative substances, permitted to obtain an integrated model with sensitivity equal to 100%. - Highlights: • Applying two independent QSAR models for bioconcentration factor increases the prediction. • The concordance of the models is an important component of the integration. • The measurement of the applicability domain improves the prediction. • The use of a

A flow-through passive dosing system for continuously supplying aqueous solutions of hydrophobic chemicals to bioconcentration and aquatic toxicity tests

DEFF Research Database (Denmark)

Adolfsson-Erici, Margaretha; Åkerman, Gun; Jahnke, Annika

2012-01-01

A continuous supply of water with defined stable concentrations of hydrophobic chemicals is a requirement in a range of laboratory tests such as the OECD 305 protocol for determining the bioconcentration factor in fish. Satisfying this requirement continues to be a challenge, particularly for hyd...

Estimation of herbicide bioconcentration in sugarcane (Saccharum officinarum L.

Directory of Open Access Journals (Sweden)

Antonio Luiz Cerdeira

2015-04-01

Full Text Available Sugarcane is an important crop for sugar and biofuel production in Brazil. Growers depend greatly on herbicides to produce it. This experiment used herbicide physical-chemical and sugarcane plant physiological properties to simulate herbicide uptake and estimate the bioconcentration factor (BCF. The (BCF was calculated for the steady state chemical equilibrium between the plant herbicide concentration and soil solution. Plant-water partition coefficient (sugarcane bagasse-water partition coefficient, herbicide dilution rate, metabolism and dissipation in the soil-plant system, as well as total plant biomass factors were used. In addition, we added Tebuthiuron at rate of 5.0kg a.i. ha-1 to physically test the model. In conclusion, the model showed the following ranking of herbicide uptake: sulfentrazone > picloram >tebuthiuron > hexazinone > metribuzin > simazine > ametryn > diuron > clomazone > acetochlor. Furthermore, the highest BCF herbicides showed higher Groundwater Ubiquity Score (GUS index indicating high leaching potential. We did not find tebuthiuron in plants after three months of herbicide application

Growth and metal bioconcentration by conspecific freshwater macroalgae cultured in industrial waste water.

Science.gov (United States)

Ellison, Michael B; de Nys, Rocky; Paul, Nicholas A; Roberts, David A

2014-01-01

The bioremediation of industrial waste water by macroalgae is a sustainable and renewable approach to the treatment of waste water produced by multiple industries. However, few studies have tested the bioremediation of complex multi-element waste streams from coal-fired power stations by live algae. This study compares the ability of three species of green freshwater macroalgae from the genus Oedogonium, isolated from different geographic regions, to grow in waste water for the bioremediation of metals. The experiments used Ash Dam water from Tarong power station in Queensland, which is contaminated by multiple metals (Al, Cd, Ni and Zn) and metalloids (As and Se) in excess of Australian water quality guidelines. All species had consistent growth rates in Ash Dam water, despite significant differences in their growth rates in "clean" water. A species isolated from the Ash Dam water itself was not better suited to the bioremediation of that waste water. While there were differences in the temporal pattern of the bioconcentration of metals by the three species, over the course of the experiment, all three species bioconcentrated the same elements preferentially and to a similar extent. All species bioconcentrated metals (Cu, Mn, Ni, Cd and Zn) more rapidly than metalloids (As, Mo and Se). Therefore, bioremediation in situ will be most rapid and complete for metals. Overall, all three species of freshwater macroalgae had the ability to grow in waste water and bioconcentrate elements, with a consistent affinity for the key metals that are regulated by Australian and international water quality guidelines. Together, these characteristics make Oedogonium a clear target for scaled bioremediation programs across a range of geographic regions.

Growth and metal bioconcentration by conspecific freshwater macroalgae cultured in industrial waste water

Directory of Open Access Journals (Sweden)

Michael B. Ellison

2014-05-01

Full Text Available The bioremediation of industrial waste water by macroalgae is a sustainable and renewable approach to the treatment of waste water produced by multiple industries. However, few studies have tested the bioremediation of complex multi-element waste streams from coal-fired power stations by live algae. This study compares the ability of three species of green freshwater macroalgae from the genus Oedogonium, isolated from different geographic regions, to grow in waste water for the bioremediation of metals. The experiments used Ash Dam water from Tarong power station in Queensland, which is contaminated by multiple metals (Al, Cd, Ni and Zn and metalloids (As and Se in excess of Australian water quality guidelines. All species had consistent growth rates in Ash Dam water, despite significant differences in their growth rates in “clean” water. A species isolated from the Ash Dam water itself was not better suited to the bioremediation of that waste water. While there were differences in the temporal pattern of the bioconcentration of metals by the three species, over the course of the experiment, all three species bioconcentrated the same elements preferentially and to a similar extent. All species bioconcentrated metals (Cu, Mn, Ni, Cd and Zn more rapidly than metalloids (As, Mo and Se. Therefore, bioremediation in situ will be most rapid and complete for metals. Overall, all three species of freshwater macroalgae had the ability to grow in waste water and bioconcentrate elements, with a consistent affinity for the key metals that are regulated by Australian and international water quality guidelines. Together, these characteristics make Oedogonium a clear target for scaled bioremediation programs across a range of geographic regions.

The effects of dissolved organic matter and feeding on bioconcentration and oxidative stress of ethylhexyl dimethyl p-aminobenzoate (OD-PABA) to crucian carp (Carassius auratus).

Science.gov (United States)

Ma, Binni; Lu, Guanghua; Yang, Haohan; Liu, Jianchao; Yan, Zhenhua; Nkoom, Matthew

2018-03-01

Bioconcentration of UV filters in organisms is an important indicator for the assessment of environmental hazards. However, bioconcentration testing rarely accounts for the influence of natural aquatic environmental factors. In order to better assess the ecological risk of organic UV filters (OUV-Fs) in an actual water environment, this study determined the influences of dissolved organic matter (DOM) (0, 1, 10, and 20 mg/L) and feeding (0, 0.5, 1, and 2% body weight/d) on bioconcentration of ethylhexyl dimethyl p-aminobenzoate (OD-PABA) in various tissues of crucian carp (Carassius auratus). Moreover, oxidative stress in the fish liver caused by the OD-PABA was also investigated by measuring activities of superoxide dismutase (SOD), catalase (CAT) and glutathione S-transferase (GST), and levels of glutathione (GSH) and malondialdehyde (MDA). The bioconcentration of OD-PABA in the fish tissues was significantly decreased with the presence of DOM indicating a reduction of OD-PABA bioavailability caused by DOM. The bioconcentration factors (BCFs) decreased by 28.00~50.93% in the muscle, 72.67~96.74% in the gill, 37.84~87.72% in the liver, and 10.32~79.38% in the kidney at different DOM concentrations compared to those of the non-DOM treatments. Significant changes in SOD, CAT, GST, GSH, and MDA levels were found in the DOM- and OD-PABA-alone treatments. However, there were no significant differences in the SOD, CAT, GST, and MDA levels found when co-exposure to OD-PABA and DOM. Feeding led to lower OD-PABA concentrations in the fish tissues, and the concentrations were decreased with increasing feeding ratios. BCFs in various tissues reduced by 39.75~72.52% in the muscle, 56.86~79.73% in the gill, 66.41~87.50% in the liver, and 75.88~89.10% in the kidney, respectively. In the unfed treatments, the levels of SOD and MDA were significantly higher than those of the fed ones while GST and GSH levels were remarkably inhibited indicating the enhanced effect of starvation

Profile and bioconcentration of minerals by King Bolete (Boletus edulis) from the Płocka Dale in Poland.

Science.gov (United States)

Frankowska, Aneta; Ziółkowska, Joanna; Bielawski, Leszek; Falandysz, Jerzy

2010-01-01

This study aimed to provide basic data on the composition of metallic elements, including toxicologically important Cd and Hg, in popular and prized wild King Bolete mushrooms. We investigated the importance of soil substratum as a source of these metals. ICP-OES and CV-AAS were applied to determine the profile of Al, Ba, Ca, Cd, Cu, Fe, Hg, K, Mg, Mn, Na, Sr and Zn in caps and stipes of King Bolete mushroom and in the surface layer of soil (0-10 cm) from the Płocka Dale area of Poland. Hg, Cu, Cd, Zn, Mg and K exhibited bioconcentration factors (BCF) > 1. Specifically, Hg, Cu and Cd (mean BCFs for caps were 110, 19 and 16, respectively) were efficiently bioconcentrated by King Bolete, while other elements were bioexcluded (BCF < 1). Cadmium was present in the caps at mean levels of 5.5 ± 2.4 mg kg(-1) dry weight (dw) and mercury at levels of 4.9 ± 1.4 mg kg(-1) dw, both occurring at elevated concentrations in those King Bolete mushrooms surveyed.

Bioconcentration of manganese and iron in Panaeoloideae Sing

OpenAIRE

Stijve, T.; Blake, C.

1994-01-01

According to literature, the manganese content of most basidiomycetes fluctuates between 10 and 60 mg/kg, whereas the iron levels range from 100-500 mg/kg (both expressed on dry weight). The present authors report that bioconcentration of manganese is a distinguishing feature of the Panaeoloideae, as demonstrated by the analysis of 44 collections representing 15 taxons. Carpophores generally contain between 250 and 2500 mg/kg on dry weight, and, with the notable exception of Panaeolus semiova...

Solid-phase microextraction for bioconcentration studies according to OECD TG 305

Energy Technology Data Exchange (ETDEWEB)

Duering, Rolf-Alexander; Boehm, Leonard [Land Use and Nutrition (IFZ) Justus Liebig University Giessen, Institute of Soil Science and Soil Conservation, Research Centre for BioSystems, Giessen (Germany); Schlechtriem, Christian [Fraunhofer Institute for Molecular Biology and Applied Ecology (IME), Schmallenberg (Germany)

2012-12-15

An important aim of the European Community Regulation on chemicals and their safe use is the identification of (very) persistent, (very) bioaccumulative, and toxic substances. In other regulatory chemical safety assessments (pharmaceuticals, biocides, pesticides), the identification of such (very) persistent, (very) bioaccumulative, and toxic substances is of increasing importance. Solid-phase microextraction is especially capable of extracting total water concentrations as well as the freely dissolved fraction of analytes in the water phase, which is available for bioconcentration in fish. However, although already well established in environmental analyses to determine and quantify analytes mainly in aqueous matrices, solid-phase microextraction is still a rather unusual method in regulatory ecotoxicological research. Here, the potential benefits and drawbacks of solid-phase microextraction are discussed as an analytical routine approach for aquatic bioconcentration studies according to OECD TG 305, with a special focus on the testing of hydrophobic organic compounds characterized by log K{sub OW}> 5. (orig.)

Measuring coalition functioning: refining constructs through factor analysis.

Science.gov (United States)

Brown, Louis D; Feinberg, Mark E; Greenberg, Mark T

2012-08-01

Internal and external coalition functioning is an important predictor of coalition success that has been linked to perceived coalition effectiveness, coalition goal achievement, coalition ability to support evidence-based programs, and coalition sustainability. Understanding which aspects of coalition functioning best predict coalition success requires the development of valid measures of empirically unique coalition functioning constructs. The goal of the present study is to examine and refine the psychometric properties of coalition functioning constructs in the following six domains: leadership, interpersonal relationships, task focus, participation benefits/costs, sustainability planning, and community support. The authors used factor analysis to identify problematic items in our original measure and then piloted new items and scales to create a more robust, psychometrically sound, multidimensional measure of coalition functioning. Scales displayed good construct validity through correlations with other measures. Discussion considers the strengths and weaknesses of the refined instrument.

Assessment and validation of the CAESAR predictive model for bioconcentration factor (BCF in fish

Directory of Open Access Journals (Sweden)

Milan Chiara

2010-07-01

Full Text Available Abstract Background Bioconcentration factor (BCF describes the behaviour of a chemical in terms of its likelihood of concentrating in organisms in the environment. It is a fundamental property in recent regulations, such as the European Community Regulation on chemicals and their safe use or the Globally Harmonized System for classification, labelling and packaging. These new regulations consider the possibility of reducing or waiving animal tests using alternative methods, such as in silico methods. This study assessed and validated the CAESAR predictive model for BCF in fish. Results To validate the model, new experimental data were collected and used to create an external set, as a second validation set (a first validation exercise had been done just after model development. The performance of the model was compared with BCFBAF v3.00. For continuous values and for classification purposes the CAESAR BCF model gave better results than BCFBAF v3.00 for the chemicals in the applicability domain of the model. R2 and Q2 were good and accuracy in classification higher than 90%. Applying an offset of 0.5 to the compounds predicted with BCF close to the thresholds, the number of false negatives (the most dangerous errors dropped considerably (less than 0.6% of chemicals. Conclusions The CAESAR model for BCF is useful for regulatory purposes because it is robust, reliable and predictive. It is also fully transparent and documented and has a well-defined applicability domain, as required by REACH. The model is freely available on the CAESAR web site and easy to use. The reliability of the model reporting the six most similar compounds found in the CAESAR dataset, and their experimental and predicted values, can be evaluated.

The effect of pH on the bioconcentration and toxicity of weak organic electrolytes

DEFF Research Database (Denmark)

Rendal, Cecilie

to the bioconcentration of ionizing organic compounds showed that this fraction cannot safely be overlooked. The work presented in this thesis suggests that the standard test procedures used to test toxicity and bioconcentration are not sufficient to fully illuminate the ecotoxicity of ionizing organic compounds unless......Many of the compounds in use today have ionizing properties. Investigations have shown that around half of the compounds preregistered for REACH and over 70% of all pharmaceuticals are ionizing organic compounds. These compounds may pose a risk when they are released into the environment....... Ionization, however, complicates the environmental risk assessment of these compounds because the uptake processes of the neutral fraction differ from the processes of the ionized fraction. Acids are increasingly neutral at pH levels below the pKa while bases are increasingly neutral at pH levels above the p...

Toxic effects, bioconcentration and depuration of verapamil in the early life stages of common carp (Cyprinus carpio L.)

Energy Technology Data Exchange (ETDEWEB)

Steinbach, Christoph, E-mail: steinbach@frov.jcu.cz [Research Institute of Fish Culture and Hydrobiology, South Bohemian Research Centre of Aquaculture and Biodiversity of Hydrocenoses, Faculty of Fisheries and Protection of Waters, University of South Bohemia in Ceske Budejovice, CZ-38925 Vodnany (Czech Republic); Fedorova, Ganna [Research Institute of Fish Culture and Hydrobiology, South Bohemian Research Centre of Aquaculture and Biodiversity of Hydrocenoses, Faculty of Fisheries and Protection of Waters, University of South Bohemia in Ceske Budejovice, CZ-38925 Vodnany (Czech Republic); Prokes, Miroslav [Institute of Vertebrate Biology, Academy of Sciences of the Czech Republic, v.v.i., Kvetna 8, 603 65 Brno (Czech Republic); Grabicova, Katerina; Machova, Jana; Grabic, Roman; Valentova, Olga; Kroupova, Hana Kocour [Research Institute of Fish Culture and Hydrobiology, South Bohemian Research Centre of Aquaculture and Biodiversity of Hydrocenoses, Faculty of Fisheries and Protection of Waters, University of South Bohemia in Ceske Budejovice, CZ-38925 Vodnany (Czech Republic)

2013-09-01

Verapamil is a pharmaceutical that belongs to a group of calcium channel blockers and is mainly used as a treatment of angina pectoris and arterial hypertension. Verapamil has been detected in aquatic environments in concentrations ranging from ng L{sup −1} to μg L{sup −1}. In the present study, a series of acute toxicity tests of verapamil on various developmental stages of common carp (Cyprinus carpio) were conducted. As a result, 96hLC{sub 50} values of verapamil were estimated at 16.4 ± 9.2, 7.3 ± 1.5 and 4.8 ± 0.2 mg L{sup −1} for embryos (E5–E9) and common carp larvae L2 and L5, respectively. Lethal concentrations of verapamil decreased with an increase in the age of the fish. Acute exposure to verapamil significantly reduced the heart rate in the embryos and larvae. In an embryo-larval toxicity test (sub-chronic exposure), the bioconcentration, depuration, and toxic effects of verapamil were assessed in common carp. The fish were exposed to verapamil in a concentration of 0.463 (environmentally relevant), 4.63, 46.3 and 463 μg L{sup −1}. Verapamil had no effect on the accumulated mortality, hatching, condition factor, growth or ontogeny of the fish in any of the tested concentrations. In carp exposed to 463 and 46.3 μg L{sup −1} of verapamil, significantly higher occurrences of malformations and edemas were observed compared to the control. The bioconcentration factor of verapamil in whole fish homogenates ranged between 6.6 and 16.6 and was therefore below the critical value for hazard substances (BCF > 500). The half-life and the 95% depuration time for the tested compound were estimated to be 10.2 ± 1.6 days and 44.2 ± 8.6 days, respectively. No effects of verapamil on the studied endpoints were observed at environmentally relevant concentrations. - Highlights: • Study of the acute and sub-chronic toxicity of verapamil on early-life stages of common carp. • Acute exposure to verapamil reduced the heart rate in early-life stages of

Toxic effects, bioconcentration and depuration of verapamil in the early life stages of common carp (Cyprinus carpio L.)

International Nuclear Information System (INIS)

Steinbach, Christoph; Fedorova, Ganna; Prokes, Miroslav; Grabicova, Katerina; Machova, Jana; Grabic, Roman; Valentova, Olga; Kroupova, Hana Kocour

2013-01-01

Verapamil is a pharmaceutical that belongs to a group of calcium channel blockers and is mainly used as a treatment of angina pectoris and arterial hypertension. Verapamil has been detected in aquatic environments in concentrations ranging from ng L −1 to μg L −1 . In the present study, a series of acute toxicity tests of verapamil on various developmental stages of common carp (Cyprinus carpio) were conducted. As a result, 96hLC 50 values of verapamil were estimated at 16.4 ± 9.2, 7.3 ± 1.5 and 4.8 ± 0.2 mg L −1 for embryos (E5–E9) and common carp larvae L2 and L5, respectively. Lethal concentrations of verapamil decreased with an increase in the age of the fish. Acute exposure to verapamil significantly reduced the heart rate in the embryos and larvae. In an embryo-larval toxicity test (sub-chronic exposure), the bioconcentration, depuration, and toxic effects of verapamil were assessed in common carp. The fish were exposed to verapamil in a concentration of 0.463 (environmentally relevant), 4.63, 46.3 and 463 μg L −1 . Verapamil had no effect on the accumulated mortality, hatching, condition factor, growth or ontogeny of the fish in any of the tested concentrations. In carp exposed to 463 and 46.3 μg L −1 of verapamil, significantly higher occurrences of malformations and edemas were observed compared to the control. The bioconcentration factor of verapamil in whole fish homogenates ranged between 6.6 and 16.6 and was therefore below the critical value for hazard substances (BCF > 500). The half-life and the 95% depuration time for the tested compound were estimated to be 10.2 ± 1.6 days and 44.2 ± 8.6 days, respectively. No effects of verapamil on the studied endpoints were observed at environmentally relevant concentrations. - Highlights: • Study of the acute and sub-chronic toxicity of verapamil on early-life stages of common carp. • Acute exposure to verapamil reduced the heart rate in early-life stages of common carp. • The

Mosses as an integrating tool for monitoring PAH atmospheric deposition: comparison with total deposition and evaluation of bioconcentration factors. A year-long case-study.

Science.gov (United States)

Foan, Louise; Domercq, Maria; Bermejo, Raúl; Santamaría, Jesús Miguel; Simon, Valérie

2015-01-01

Polycyclic aromatic hydrocarbon (PAH) atmospheric deposition was evaluated at a remote site in Northern Spain using moss biomonitoring with Hylocomium splendens (Hedw.) Schimp., and by measuring the total deposition fluxes of PAHs. The year-long study allowed seasonal variations of PAH content in mosses to be observed, and these followed a similar trend to those of PAH fluxes in total deposition. Generally, atmospheric deposition of PAHs is greater in winter than in summer, due to more PAH emissions from domestic heating, less photoreactivity of the compounds, and intense leaching of the atmosphere by wet deposition. However, fractionation of these molecules between the environmental compartments occurs: PAH fluxes in total deposition and PAH concentrations in mosses are correlated with their solubility (r=0.852, pPAH fluxes can be estimated with moss biomonitoring data if the bioconcentration or 'enriching' factors are known. Copyright © 2014 Elsevier Ltd. All rights reserved.

Plant Uptake of Organic Pollutants from Soil: A Critical Review ofBioconcentration Estimates Based on Modelsand Experiments

Energy Technology Data Exchange (ETDEWEB)

McKone, Thomas E.; Maddalena, Randy L.

2007-01-01

The role of terrestrial vegetation in transferring chemicals from soil and air into specific plant tissues (stems, leaves, roots, etc.) is still not well characterized. We provide here a critical review of plant-to-soil bioconcentration ratio (BCR) estimates based on models and experimental data. This review includes the conceptual and theoretical formulations of the bioconcentration ratio, constructing and calibrating empirical and mathematical algorithms to describe this ratio and the experimental data used to quantify BCRs and calibrate the model performance. We first evaluate the theoretical basis for the BCR concept and BCR models and consider how lack of knowledge and data limits reliability and consistency of BCR estimates. We next consider alternate modeling strategies for BCR. A key focus of this evaluation is the relative contributions to overall uncertainty from model uncertainty versus variability in the experimental data used to develop and test the models. As a case study, we consider a single chemical, hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX), and focus on variability of bioconcentration measurements obtained from 81 experiments with different plant species, different plant tissues, different experimental conditions, and different methods for reporting concentrations in the soil and plant tissues. We use these observations to evaluate both the magnitude of experimental variability in plant bioconcentration and compare this to model uncertainty. Among these 81 measurements, the variation of the plant/soil BCR has a geometric standard deviation (GSD) of 3.5 and a coefficient of variability (CV-ratio of arithmetic standard deviation to mean) of 1.7. These variations are significant but low relative to model uncertainties--which have an estimated GSD of 10 with a corresponding CV of 14.

Refined toric branes, surface operators and factorization of generalized Macdonald polynomials

Science.gov (United States)

Zenkevich, Yegor

2017-09-01

We find new universal factorization identities for generalized Macdonald polynomials on the topological locus. We prove the identities (which include all previously known forumlas of this kind) using factorization identities for matrix model averages, which are themselves consequences of Ding-Iohara-Miki constraints. Factorized expressions for generalized Macdonald polynomials are identified with refined topological string amplitudes containing a toric brane on an intermediate preferred leg, surface operators in gauge theory and certain degenerate CFT vertex operators.

Frequency-restrained structure-factor refinement. Pt. 1

International Nuclear Information System (INIS)

Lunin, V.Yu.; Skovoroda, T.P.

1991-01-01

An analysis of the frequencies of different values encountered in protein electron-density syntheses reveals characteristic shapes for their distributions (histograms). This property can be used to refine ill-defined phases (and, perhaps, some of the moduli) of structure factors, and thus to obtain more-interpretable electron-density maps. A simple empirical model is designed which can predict the histogram for a protein with an undetermined structure provided its unit-cell volume and charge are known. The parameters of the histogram model are derived from a set of proteins with known spatial structures. The application of the simulated histogram is illustrated by an improved electron-density map for the 'dry' form of the protein γ-crystallin IIIb. (orig.)

Dermasence refining gel modulates pathogenetic factors of rosacea in vitro.

Science.gov (United States)

Borelli, C; Becker, B; Thude, S; Fehrenbacher, B; Isermann, D

2017-12-01

Over the counter cosmetics sold for local treatment of slight to moderate rosacea often state the claim of actively modulating rosacea pathogenesis. Factors involved in the pathogenesis of this common yet complex skin disorder include kallikrein-related peptidase 5 (KLK5), LL-37, as well as protease-activated receptor 2 (PAR2) and vascular endothelial growth factor (VEGF). The objective was to prove the modulating effect of the cosmetic skin care agent Dermasence Refining Gel (DRG) on factors involved in rosacea pathogenesis. We analyzed the effect of DRG on the expression of KLK5, LL-37, PAR2, and VEGF in an in vitro skin model of human reconstituted epidermis. The expression of CAMP (LL-37 gene, fold change -4.19 [±0.11]), VEGFA (fold change -2.55 [±0.12]) and PAR2 (-1.33 [±0.12]) was reduced, KLK5 expression increased (fold change 2.06 (±0.08)) after 18 h of treatment with DRG in comparison to treatment with the matrix gel only. The reduction in CAMP expression was significant (P<.01). The protein expression of all four inflammatory markers was markedly reduced after 18 hours of DRG treatment in comparison to baseline (0 hour), by measure of fluorescence intensity. We show evidence explaining the anti-inflammatory effect of Dermasence Refining Gel in rosacea pathogenesis in vitro. The adjunctive use of DRG in mild to moderate rosacea as a topical cosmetic seems medically reasonable. © 2017 Wiley Periodicals, Inc.

Piperonyl butoxide enhances the bioconcentration and photoinduced toxicity of fluoranthene and benzo[a]pyrene to larvae of the grass shrimp (Palaemonetes pugio).

Science.gov (United States)

Weinstein, John E; Garner, Thomas R

2008-04-08

Piperonyl butoxide (PBO) is a commonly used synergist in many pyrethroid formulations due to its ability to interfere with cytochrome P450 (CYP) monooxygenases. Because PBO can co-occur in the estuarine environment with polycyclic aromatic hydrocarbons (PAHs), a class of compounds metabolized by CYP isozymes, the overall objective of this study was to investigate the influence of PBO on the bioconcentration and photoinduced toxicity of two common PAH contaminants, fluoranthene (FLU) and benzo[a]pyrene (BaP), on the larvae of the grass shrimp (Palaemonetes pugio). PBO alone was not particularly toxic to grass shrimp larvae. In dark exposures and under simulated sunlight (UV-A=211.0+/-7.0 microW/cm(2), UV-B=9.8+/-2.4microW/cm(2)), 96-h LC(50) values were similar (814.4 and 888.6 microg/L, respectively), suggesting that PBO toxicity is not enhanced in the presence of sunlight. The presence of sublethal concentrations of PBO in single PAH toxicity tests increased the bioconcentration of the two tested PAHs, and these increases were greatest at the lowest tested PAH concentrations. Mean bioconcentration factors (BCF) at the three lowest FLU and BaP treatments increased 14.3- and 7.1-fold, respectively, in the low PBO (127 microg/L) exposure compared to that of the no PBO exposure. Under simulated sunlight, PBO exposure also increased the photoinduced toxicity of the two tested PAHs, and this increase occurred in a PBO concentration-dependent fashion. For FLU, 96-h LC(50) values decreased from 2.35 microg/L in the absence of PBO to 0.76 microg/L in the high PBO (256 microg/L) exposure. For BaP, 96-h LC(50) values similarly decreased from 1.02 microg/L in the absence of PBO to 0.30microg/L in the high PBO exposure. The presence of PBO also influenced the PAH tissue residue-response relationship, but in different ways for FLU and BaP. For FLU, slopes of the tissue residue-response relationship decreased in the presence of PBO, and for BaP, there was a trend towards

A Bayesian approach to assessing the uncertainty in estimating bioconcentration factors in earthworms--the example of quinoxyfen.

Science.gov (United States)

Fragoulis, George; Merli, Annalisa; Reeves, Graham; Meregalli, Giovanna; Stenberg, Kristofer; Tanaka, Taku; Capri, Ettore

2011-06-01

Quinoxyfen is a fungicide of the phenoxyquinoline class used to control powdery mildew, Uncinula necator (Schw.) Burr. Owing to its high persistence and strong sorption in soil, it could represent a risk for soil organisms if they are exposed at ecologically relevant concentrations. The objective of this paper is to predict the bioconcentration factors (BCFs) of quinoxyfen in earthworms, selected as a representative soil organism, and to assess the uncertainty in the estimation of this parameter. Three fields in each of four vineyards in southern and northern Italy were sampled over two successive years. The measured BCFs varied over time, possibly owing to seasonal changes and the consequent changes in behaviour and ecology of earthworms. Quinoxyfen did not accumulate in soil, as the mean soil concentrations at the end of the 2 year monitoring period ranged from 9.16 to 16.0 µg kg⁻¹ dw for the Verona province and from 23.9 to 37.5 µg kg⁻¹ dw for the Taranto province, with up to eight applications per season. To assess the uncertainty of the BCF in earthworms, a probabilistic approach was used, firstly by building with weighted bootstrapping techniques a generic probabilistic density function (PDF) accounting for variability and incompleteness of knowledge. The generic PDF was then used to derive prior distribution functions, which, by application of Bayes' theorem, were updated with the new measurements and a posterior distribution was finally created. The study is a good example of probabilistic risk assessment. The means of mean and SD posterior estimates of log BCFworm (2.06, 0.91) are the 'best estimate values'. Further risk assessment of quinoxyfen and other phenoxyquinoline fungicides and realistic representative scenarios for modelling exercises required for future authorization and post-authorization requirements can now use this value as input. Copyright © 2011 Society of Chemical Industry.

Effect of pH on the toxicity and bioconcentration of sulfadiazine on Daphnia magna

DEFF Research Database (Denmark)

Anskjær, Gitte Gotholdt; Rendal, Cecilie; Kusk, Kresten Ole

2013-01-01

The antimicrobial sulfonamide sulfadiazine has in the last decades been detected in environmental water bodies, both surface and ground water. Since pH in the environment may vary considerably, this study examined the toxicity of the amphoter sulfadiazine towards Daphnia magna at pH levels of 6.......0, 7.5 and 8.5, thus taking the impact of speciation into consideration, contrary to earlier eco-toxicity studies conducted at standard conditions. Toxicity tests were performed using the standard ISO 6341 test procedure modified to accommodate the three pH levels and the toxicity was expressed as EC50....... After 48h the EC50 was determined to be 27.2, 188 and 310mgL−1 at pH 6.0, 7.5 and 8.5, respectively, thus demonstrating a significant effect of pH on the toxicity of sulfadiazine. Furthermore, the bioconcentration factor (dry weight) was determined to be 50 and 36 at pH 6.0 and 8.5, respectively...

Bioconcentration and acute toxicity of polycyclic musks in two benthic organisms (Chironomus riparius and Lumbriculus variegatus)

NARCIS (Netherlands)

Artola-Garicano, E.; Sinnige, T.L.; Holsteijn, I. van; Vaes, W.H.J.; Hermens, J.L.M.

2003-01-01

In the current study, the bioconcentration behavior and acute toxicity of two polycyclic musks, Tonalide® 7-acetyl-1,1,3,4,4,6,-hexamethyl-1,2,3,4,-tetrahydronaphthalene (AHTN) and Galaxolide® 1,3,4,6,7,8-hexahydro-4,6,6,7,8,8-hexa-methyl-cyclopenta[γ]-2- benzopyran (HHCB), were studied in two

Bioconcentration of atrazine and chlorophenols into roots and shoots of rice seedlings

International Nuclear Information System (INIS)

Su Yuhong; Zhu Yongguan

2006-01-01

Accumulation of o-chlorophenol (CP), 2,4-dichlorophenol (DCP), and atrazine (ATR), as single and mixed contaminants, from hydroponic solutions into roots and shoots of rice seedlings was studied following 48-h exposure of the plant roots. As single contaminants at low levels, the observed bioconcentration factors (BCFs) of CP and DCP with roots approximated the equilibrium values according to the partition-limited model. The BCF of atrazine with roots was about half the partition limit for unknown reasons. The BCFs of CP and ATR with shoots also approximated the partition limits, while the BCF for more lipophilic DCP with shoots was about half the estimated limit, due to insufficient water transport into plants for DCP. As mixed contaminants at low levels, the BCFs with both roots and shoots were comparable with those for the single contaminants; at high levels, the BCFs generally decreased because of the enhanced mixed-contaminant phytotoxicity, as manifested by the greatly reduced plant transpiration rate. - Uptakes of o-chlorophenol, 2,4-dichlorophenol, and atrazine at various levels from nutrient solution by roots and shoots of rice seedlings were investigated using a partition-limited model

Refining dermatology journal impact factors using PageRank.

Science.gov (United States)

Dellavalle, Robert P; Schilling, Lisa M; Rodriguez, Marko A; Van de Sompel, Herbert; Bollen, Johan

2007-07-01

Thomson Institute for Scientific Information's journal impact factor, the most common measure of journal status, is based on crude citation counts that do not account for the quality of the journals where the citations originate. This study examines how accounting for citation origin affects the impact factor ranking of dermatology journals. The 2003 impact factors of dermatology journals were adjusted by a weighted PageRank algorithm that assigned greater weight to citations originating in more frequently cited journals. Adjusting for citation origin moved the rank of the Journal of the American Academy of Dermatology higher than that of the Archives of Dermatology (third to second) but did not affect the ranking of the highest impact dermatology journal, the Journal of Investigative Dermatology. The dermatology journals most positively affected by adjusting for citation origin were Contact Dermatitis (moving from 22nd to 7th in rankings) and Burns (21st to 10th). Dermatology journals most negatively affected were Seminars in Cutaneous Medicine and Surgery (5th to 14th), the Journal of Cutaneous Medicine and Surgery (19th to 27th), and the Journal of Investigative Dermatology Symposium Proceedings (26th to 34th). Current measures of dermatology journal status do not incorporate survey data from dermatologists regarding which journals dermatologists esteem most. Adjusting for citation origin provides a more refined measure of journal status and changes relative dermatology journal rankings.

Bioconcentration of the antidepressant fluoxetine and its effects on the physiological and biochemical status in Daphnia magna.

Science.gov (United States)

Ding, Jiannan; Zou, Hua; Liu, Qingqing; Zhang, Shanshan; Mamitiana Razanajatovo, Roger

2017-08-01

The aim of this study was to evaluate the bioconcentration potential of fluoxetine and its biological effects in Daphnia magna. After 48h of waterborne exposure, the bioconcentration of fluoxetine in D. magna was determined to be 460.61 and 174.41Lkg -1 for nominal exposure concentrations of 0.5 and 5µgL -1 , respectively. Moreover, various biological endpoints, including physiological responses (filtration and ingestion rates), enzymatic biomarkers related to neurotoxicity [acetylcholinesterase (AChE)] and antioxidant defense [superoxide dismutase (SOD)], and an oxidative stress damage marker [malondialdehyde (MDA)], were assessed. Fluoxetine exposure increased the filtration rate of daphnia, while the ingestion rate was not obviously modified. AChE activity was significantly inhibited, highlighting the neurotoxicity of fluoxetine on D. magna. However, with some alterations in the SOD activity and MDA content, no obvious oxidative damage was observed in D. magna exposed to fluoxetine at the tested concentrations. These results indicate that fluoxetine can be accumulated and consequently induce physiological and biochemical perturbations in D. magna. Copyright © 2017. Published by Elsevier Inc.

Bioconcentration of TNT and RDX in coastal marine biota.

Science.gov (United States)

Ballentine, Mark; Tobias, Craig; Vlahos, Penny; Smith, Richard; Cooper, Christopher

2015-05-01

The bioconcentration factor (BCF) was measured for 2,4,6-trinitrotoluene (TNT) and hexahydro-1,3,5-trinitro-1,3,5-triazine (RDX) in seven different marine species of varying trophic levels. Time series and concentration gradient treatments were used for water column and tissue concentrations of TNT, RDX, and their environmentally important derivatives 2-amino-4,6-dintrotoluene (2-ADNT) and 4-amino-2,6-dinitrotoluene (4-ADNT). BCF values ranged from 0.0031 to 484.5 mL g(-1) for TNT and 0.023 to 54.83 mL g(-1) for RDX. The use of log K ow value as an indicator was evaluated by adding marine data from this study to previously published data. For the munitions in this study, log K ow value was a good indicator in the marine environment. The initial uptake and elimination rates of TNT and RDX for Fucus vesiculosus were 1.79 and 0.24 h(-1) for TNT and 0.50 and 0.0035 h(-1) for RDX respectively. Biotransformation was observed in all biota for both TNT and RDX. Biotransformation of TNT favored 4-ADNT over 2-ADNT at ratios of 2:1 for F. vesiculosus and 3:1 for Mytilus edulis. Although RDX derivatives were measureable, the ratios of RDX derivatives were variable with no detectable trend. Previous approaches for measuring BCF in freshwater systems compare favorably with these experiments with marine biota, yet significant gaps on the ultimate fate of munitions within the biota exist that may be overcome with the use stable isotope-labeled munitions substrates.

Ensemble refinement shows conformational flexibility in crystal structures of human complement factor D

International Nuclear Information System (INIS)

Forneris, Federico; Burnley, B. Tom; Gros, Piet

2014-01-01

Ensemble-refinement analysis of native and mutant factor D (FD) crystal structures indicates a dynamical transition in FD from a self-inhibited inactive conformation to a substrate-bound active conformation that is reminiscent of the allostery in thrombin. Comparison with previously observed dynamics in thrombin using NMR data supports the crystallographic ensembles. Human factor D (FD) is a self-inhibited thrombin-like serine proteinase that is critical for amplification of the complement immune response. FD is activated by its substrate through interactions outside the active site. The substrate-binding, or ‘exosite’, region displays a well defined and rigid conformation in FD. In contrast, remarkable flexibility is observed in thrombin and related proteinases, in which Na + and ligand binding is implied in allosteric regulation of enzymatic activity through protein dynamics. Here, ensemble refinement (ER) of FD and thrombin crystal structures is used to evaluate structure and dynamics simultaneously. A comparison with previously published NMR data for thrombin supports the ER analysis. The R202A FD variant has enhanced activity towards artificial peptides and simultaneously displays active and inactive conformations of the active site. ER revealed pronounced disorder in the exosite loops for this FD variant, reminiscent of thrombin in the absence of the stabilizing Na + ion. These data indicate that FD exhibits conformational dynamics like thrombin, but unlike in thrombin a mechanism has evolved in FD that locks the unbound native state into an ordered inactive conformation via the self-inhibitory loop. Thus, ensemble refinement of X-ray crystal structures may represent an approach alternative to spectroscopy to explore protein dynamics in atomic detail

Comparison of cadmium and chromium bioconcentration factors between scaled and scale less fish species: common carp and sutchi (striped catfish

Directory of Open Access Journals (Sweden)

Sideh Zainab Abedi

2014-10-01

Full Text Available Background: Water-borne, indissoluble heavy metals are bioaccumulated in fish (human food source. In this research, chromium (Cr and cadmium (Cd bioconcentration factors (BCFs in the skin, gills, scales, livers and muscles of two widely-consumed fish species, scaled common carp Cyprinus carpio and scaleless catfish Pangasius hypophthalmus were compared. Material and Methods: Lethal concentrations of Cd and Cr (64.89 & 7.46, and 84.8 & 17.05 mg/L for the catfish and carp, respectively were determined during 96 hrs (96 h LC50, and the fishes were exposed for 15 days. Then the tissue samples were chemically digested and the contents of Cd and Cr were determined using atomic absorption. Results: Total contents of Cr and Cd in the catfish's tissues were 2286.11 & 360.73, and those of Cr & Cd in carp were 734.71 & 725.67 μg/g.dw (excluding the scales, respectively. Metal concentrations in the water residues (day 15 revealed lower Cr and Cd (0.059 & 0.0036 mg/L in the catfish than those in the carp media (0.1 & 0.0412 mg/L, respectively. In common carp, BCF of Cd was as liver > skin > gills > muscle > scales, and those in the catfish marked as liver>muscle >gills >skin. The BCF of Cr in common carp ranked as gills>liver>skin>scales>muscle, and the catfish showing a BCF pattern of Cr as liver> muscle>skin>gills. Conclusion: This study signifies that small amounts of cadmium and chromium with high BCFs especially in the muscles of scale less fish (catfish threat consumers’ health.

[Current status of hearing loss and related influencing factors in workers with noise exposure in refining and chemical industry].

Science.gov (United States)

Wu, S S; Yu, J N; He, C H; Mu, H X; Wang, C; Zhang, Y; Zhang, C Y; Yu, S F; Li, X L

2016-12-20

Objective: To investigate the current status of hearing loss and related influencing factors in workers with noise exposure in refining and chemical industry. Methods: From August 2015 to March 2016, the investigation method of collecting the data of past occupational health examinations and measuring noise in working environment was used to enroll 8 672 male workers. Results: Of all workers, 11.6% were diagnosed with hearing loss. There were significant differences in the distribution of hearing impairment among workers exposed to noise at different ages, device types and types of work (χ(2)=17.80, 77.80 and 30.53, all P hearing loss in workers with noise exposure in refining and chemical industry. Conclusion: The level of noise exposure and working years with noise exposure are main influencing factors for hearing loss in workers with noise exposure in refining and chemical industry.

Evaluation and comparison of benchmark QSAR models to predict a relevant REACH endpoint: The bioconcentration factor (BCF).

Science.gov (United States)

Gissi, Andrea; Lombardo, Anna; Roncaglioni, Alessandra; Gadaleta, Domenico; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio; Benfenati, Emilio

2015-02-01

The bioconcentration factor (BCF) is an important bioaccumulation hazard assessment metric in many regulatory contexts. Its assessment is required by the REACH regulation (Registration, Evaluation, Authorization and Restriction of Chemicals) and by CLP (Classification, Labeling and Packaging). We challenged nine well-known and widely used BCF QSAR models against 851 compounds stored in an ad-hoc created database. The goodness of the regression analysis was assessed by considering the determination coefficient (R(2)) and the Root Mean Square Error (RMSE); Cooper's statistics and Matthew's Correlation Coefficient (MCC) were calculated for all the thresholds relevant for regulatory purposes (i.e. 100L/kg for Chemical Safety Assessment; 500L/kg for Classification and Labeling; 2000 and 5000L/kg for Persistent, Bioaccumulative and Toxic (PBT) and very Persistent, very Bioaccumulative (vPvB) assessment) to assess the classification, with particular attention to the models' ability to control the occurrence of false negatives. As a first step, statistical analysis was performed for the predictions of the entire dataset; R(2)>0.70 was obtained using CORAL, T.E.S.T. and EPISuite Arnot-Gobas models. As classifiers, ACD and logP-based equations were the best in terms of sensitivity, ranging from 0.75 to 0.94. External compound predictions were carried out for the models that had their own training sets. CORAL model returned the best performance (R(2)ext=0.59), followed by the EPISuite Meylan model (R(2)ext=0.58). The latter gave also the highest sensitivity on external compounds with values from 0.55 to 0.85, depending on the thresholds. Statistics were also compiled for compounds falling into the models Applicability Domain (AD), giving better performances. In this respect, VEGA CAESAR was the best model in terms of regression (R(2)=0.94) and classification (average sensitivity>0.80). This model also showed the best regression (R(2)=0.85) and sensitivity (average>0.70) for

Crystal structure refinement with SHELXL

Energy Technology Data Exchange (ETDEWEB)

Sheldrick, George M., E-mail: gsheldr@shelx.uni-ac.gwdg.de [Department of Structural Chemistry, Georg-August Universität Göttingen, Tammannstraße 4, Göttingen 37077 (Germany)

2015-01-01

New features added to the refinement program SHELXL since 2008 are described and explained. The improvements in the crystal structure refinement program SHELXL have been closely coupled with the development and increasing importance of the CIF (Crystallographic Information Framework) format for validating and archiving crystal structures. An important simplification is that now only one file in CIF format (for convenience, referred to simply as ‘a CIF’) containing embedded reflection data and SHELXL instructions is needed for a complete structure archive; the program SHREDCIF can be used to extract the .hkl and .ins files required for further refinement with SHELXL. Recent developments in SHELXL facilitate refinement against neutron diffraction data, the treatment of H atoms, the determination of absolute structure, the input of partial structure factors and the refinement of twinned and disordered structures. SHELXL is available free to academics for the Windows, Linux and Mac OS X operating systems, and is particularly suitable for multiple-core processors.

Towards automated crystallographic structure refinement with phenix.refine

Energy Technology Data Exchange (ETDEWEB)

Afonine, Pavel V., E-mail: pafonine@lbl.gov; Grosse-Kunstleve, Ralf W.; Echols, Nathaniel; Headd, Jeffrey J.; Moriarty, Nigel W. [Lawrence Berkeley National Laboratory, One Cyclotron Road, MS64R0121, Berkeley, CA 94720 (United States); Mustyakimov, Marat; Terwilliger, Thomas C. [Los Alamos National Laboratory, M888, Los Alamos, NM 87545 (United States); Urzhumtsev, Alexandre [CNRS–INSERM–UdS, 1 Rue Laurent Fries, BP 10142, 67404 Illkirch (France); Université Henri Poincaré, Nancy 1, BP 239, 54506 Vandoeuvre-lès-Nancy (France); Zwart, Peter H. [Lawrence Berkeley National Laboratory, One Cyclotron Road, MS64R0121, Berkeley, CA 94720 (United States); Adams, Paul D. [Lawrence Berkeley National Laboratory, One Cyclotron Road, MS64R0121, Berkeley, CA 94720 (United States); University of California Berkeley, Berkeley, CA 94720 (United States)

2012-04-01

phenix.refine is a program within the PHENIX package that supports crystallographic structure refinement against experimental data with a wide range of upper resolution limits using a large repertoire of model parameterizations. This paper presents an overview of the major phenix.refine features, with extensive literature references for readers interested in more detailed discussions of the methods. phenix.refine is a program within the PHENIX package that supports crystallographic structure refinement against experimental data with a wide range of upper resolution limits using a large repertoire of model parameterizations. It has several automation features and is also highly flexible. Several hundred parameters enable extensive customizations for complex use cases. Multiple user-defined refinement strategies can be applied to specific parts of the model in a single refinement run. An intuitive graphical user interface is available to guide novice users and to assist advanced users in managing refinement projects. X-ray or neutron diffraction data can be used separately or jointly in refinement. phenix.refine is tightly integrated into the PHENIX suite, where it serves as a critical component in automated model building, final structure refinement, structure validation and deposition to the wwPDB. This paper presents an overview of the major phenix.refine features, with extensive literature references for readers interested in more detailed discussions of the methods.

Adaptive Mesh Refinement in CTH

International Nuclear Information System (INIS)

Crawford, David

1999-01-01

This paper reports progress on implementing a new capability of adaptive mesh refinement into the Eulerian multimaterial shock- physics code CTH. The adaptivity is block-based with refinement and unrefinement occurring in an isotropic 2:1 manner. The code is designed to run on serial, multiprocessor and massive parallel platforms. An approximate factor of three in memory and performance improvements over comparable resolution non-adaptive calculations has-been demonstrated for a number of problems

Using DTPA-extractable soil fraction to assess the bioconcentration factor of plants in phytoremediation of urban soils

Science.gov (United States)

Rodríguez-Bocanegra, Javier; Roca, Núria; Tume, Pedro; Bech, Jaume

2017-04-01

Urban soils may be highly contaminated with potentially toxic metals, as a result of intensive anthropogenic activities. Developing cities are increasing the number of lands where is practiced the urban agriculture. In this way, it is necessary to assess the part of heavy metals that is transferred to plants in order to a) know the potential health risk that represent soils and b) know the relation soil-plant to assess the ability of these plants to remove heavy metals from soil. Nowadays, to assess the bioconcentration factor (BF) of plants in phytoremediation, the pseudototal o total concentration has been used by many authors. Two different urban soils with similar pH and carbonates content but with different pollution degree were phytoremediated with different plant species. Urban soil from one Barcelona district (Spain), the most contaminated soil, showed an extractability of Cu, Pb and Zn of 9.6, 6.7 and 5.8% of the total fraction respectively. The soil from Talcahuano city (Chile), with contents of heavy metals slightly above the background upper limit, present values of 15.5, 13.5 and 12% of the total fraction of studied heavy metals. Furthermore, a peri-urban analysed soil from Azul (Argentina) also showed an elevated extractability with values of 24, 13.5 and 14% of the Cu, Pb and Zn contents respectively. These soils presented more extractability than other disturbed soils, like for example, soils from mine areas. The urban soils present more developed soil with an interaction between solution and solid phase in polluted systems. The most important soil surface functional groups include the basal plane of phyllosilicates and metal hydroxyls at edge sites of clay minerals, iron oxyhydroxides, manganese oxyhydroxides and organic matter. The interaction between solution and solid phase in polluted urban systems tends to form labile associations and pollutants are more readily mobilized because their bonds with soil particles are weaker. Clay and organic

Factors affecting the grain-refinement of aluminum using titanium and boron additives

International Nuclear Information System (INIS)

Jones, G.P.; Pearson, J.

1976-01-01

The development of grain-refining techniques for the casting of aluminum, and the results achieved using additions of ternary Al--Ti--B master-alloys, are briefly described. A test procedure is given for assessing the relative effectiveness of these master-alloys, and the results are related to the various kinds of alloy treated, including those with constituents which poison the grain-refining agent. The equilibrium conditions which affect the behavior of the constituents of the grain-refined alloys are examined quantitatively from a thermodynamic viewpoint. One theory about the mechanism of nucleation of aluminum on titanium diboride is examined and found inapplicable. New data on the solubility of TiB 2 , ZrB 2 , TiC, ZrC, Cr 3 C 2 , and CrB 2 in liquid aluminum are presented graphically. Practical aspects of alloy behavior in grain-refining practice are analyzed and discussed on the basis of the quantitative data

Towards automated crystallographic structure refinement with phenix.refine

OpenAIRE

Afonine, Pavel V.; Grosse-Kunstleve, Ralf W.; Echols, Nathaniel; Headd, Jeffrey J.; Moriarty, Nigel W.; Mustyakimov, Marat; Terwilliger, Thomas C.; Urzhumtsev, Alexandre; Zwart, Peter H.; Adams, Paul D.

2012-01-01

phenix.refine is a program within the PHENIX package that supports crystallographic structure refinement against experimental data with a wide range of upper resolution limits using a large repertoire of model parameterizations. It has several automation features and is also highly flexible. Several hundred parameters enable extensive customizations for complex use cases. Multiple user-defined refinement strategies can be applied to specific parts of the model in a single refinement run. An i...

Heavy metal sensitivity and bioconcentration in oribatid mites (Acari, Oribatida)

Energy Technology Data Exchange (ETDEWEB)

Skubala, Piotr, E-mail: piotr.skubala@us.edu.pl [Department of Ecology, University of Silesia, Bankowa 9, 40-007 Katowice (Poland); Zaleski, Tomasz [Department of Soil Science and Soil Protection, Agricultural University in Krakow, Mickiewicza 21, 31-120 Cracow (Poland)

2012-01-01

In this study we aimed to identify different reactions of oribatid species to heavy metal pollution and to measure concentrations of cadmium, zinc and copper in oribatid species sampled along a gradient. Oribatid mites were sampled seasonally during two years in five meadows located at different distances from the zinc smelter in the Olkusz District, southern Poland. Oribatids were shown to withstand critical metal concentration and established comparatively abundant and diverse communities. The highest abundance and species richness of oribatids were recorded in soils with moderate concentrations of heavy metals. Four different responses of oribatid species to heavy metal pollution were recognized. Heavy metals (Zn, Pb, Cd, Ni) and various physical (bulk density, field capacity, total porosity) and chemical (K{sub av}, P{sub av}, N, C, pH) factors were recognized as the structuring forces that influence the distribution of oribatid species. Analysis by atomic absorption spectrophotometry revealed large differences in metal body burdens among species. None of the species can be categorized as accumulators or non-accumulators of the heavy metals - the pattern depends on the metal. The process of bioconcentration of the toxic metal (regulated) and essential elements (accumulated) was generally different in the five oribatid species studied. - Highlights: Black-Right-Pointing-Pointer Responses of oribatid mites to metal contamination along a gradient in meadow soils were studied. Black-Right-Pointing-Pointer Small concentrations of heavy metals positively influenced the abundance of oribatid mites. Black-Right-Pointing-Pointer Four different responses of oribatid species to heavy metal pollution were recognised. Black-Right-Pointing-Pointer Bioaccumulation of the toxic metal and essential elements proceeded differently in oribatid species. Black-Right-Pointing-Pointer Five studied oribatid species were deconcentrators of cadmium.

Monitoring and assessment of mercury pollution in the vicinity of a chloralkali plant. IV. Bioconcentration of mercury in in situ aquatic and terrestrial plants at Ganjam, India.

Science.gov (United States)

Lenka, M; Panda, K K; Panda, B B

1992-02-01

In situ aquatic and terrestrial plants including a few vegetable and crop plants growing in and around a chloralkali plant at Ganjam, India were analyzed for concentrations of root and shoot mercury. The aquatic plants found to bioconcentrate mercury to different degrees included Marsilea spp., Spirodela polyrhiza, Jussiea repens, Paspalum scrobiculatam, Pistia stratiotes, Eichhornia crassipes, Hygrophila schulli, Monochoria hastata and Bacopa monniera. Among wild terrestrial plants Chloris barbata, Cynodon dactylon, Cyperus rotundus and Croton bonplandianum were found growing on heavily contaminated soil containing mercury as high as 557 mg/kg. Analysis of mercury in root and shoot of these plants in relation to the mercury levels in soil indicated a significant correlation between soil and plant mercury with the exception of C. bonplandianum. Furthermore, the tolerance to mercury toxicity was highest with C. barbata followed by C. dactylon and C. rotundus, in that order. The rice plants analyzed from the surrounding agricultural fields did not show any significant levels of bioconcentrated mercury. Of the different vegetables grown in a contaminated kitchen garden with mercury level at 8.91 mg/kg, the two leafy vegetables, namely cabbage (Brassica oleracea) and amaranthus (Amaranthus oleraceous), were found to bioconcentrate mercury at statistically significant levels. The overall study indicates that the mercury pollution is very much localized to the specific sites in the vicinity of the chloralkali plant.

Bioconcentration of zinc and cadmium in ectomycorrhizal fungi and associated aspen trees as affected by level of pollution

International Nuclear Information System (INIS)

Krpata, Doris; Fitz, Walter; Peintner, Ursula; Langer, Ingrid; Schweiger, Peter

2009-01-01

Concentrations of Zn and Cd were measured in fruitbodies of ectomycorrhizal (ECM) fungi and leaves of co-occurring accumulator aspen. Samples were taken on three metal-polluted sites and one control site. Fungal bioconcentration factors (BCF = fruitbody concentration: soil concentration) were calculated on the basis of total metal concentrations in surface soil horizons (BCF tot ) and NH 4 NO 3 -extractable metal concentrations in mineral soil (BCF lab ). When plotted on log-log scale, values of BCF decreased linearly with increasing soil metal concentrations. BCF lab for both Zn and Cd described the data more closely than BCF tot . Fungal genera differed in ZnBCF but not in CdBCF. The information on differences between fungi with respect to their predominant occurrence in different soil horizons did not improve relations of BCF with soil metal concentrations. Aspen trees accumulated Zn and Cd to similar concentrations as the ECM fungi. Apparently, the fungi did not act as an effective barrier against aspen metal uptake by retaining the metals. - Populus tremula and associated ectomycorrhizal fungi accumulate zinc and cadmium to similar concentrations

Acute toxicity and bioconcentration of 14C-fenvalerate in tilapianilotica, the Bioavilability and biological activity of its residues in rats

International Nuclear Information System (INIS)

Aly, M.A.S.

2003-01-01

Fresh water fish tilapia treated with 300 MU/L of 1 4C-fenvalerate died at 24 h post treatment with (Ld50, 12 h). however, when sand sediments were pure in the glass aquaria (250 g/L), 50% of fish survived with (Lc50 extended to 72-96 h) a bioconcentration factor (BCF) of 800 for fenvalerate was observed at 24 h in tilapia. Maximum accumulation of 1 4C-fenvalerate in fish was at 24 h (15.6 Mg/g) and 50% eliminated in 96 h. At the end of depuration period of 8 days 36% of radioactivity (3.0 Mg/g) could be recovered in fish (40% in head, the rest in different parts of body). In believability study, when rats were fed on dried fish the majority of radioactivity was eliminated at 48 h (19.0% in urine and 68.6% in faeces) with majority of radioactivity eliminated as fenvalerate equivalent in 5 days

Effects of artificial sweeteners on metal bioconcentration and toxicity on a green algae Scenedesmus obliquus.

Science.gov (United States)

Hu, Hongwei; Deng, Yuanyuan; Fan, Yunfei; Zhang, Pengfei; Sun, Hongwen; Gan, Zhiwei; Zhu, Hongkai; Yao, Yiming

2016-05-01

The ecotoxicity of heavy metals depends much on their speciation, which is influenced by other co-existing substances having chelating capacity. In the present study, the toxic effects of Cd(2+) and Cu(2+) on a green algae Scenedesmus obliquus were examined in the presence of two artificial sweeteners (ASs), acesulfame (ACE) and sucralose (SUC) by comparing the cell specific growth rate μ and pulse-amplitude-modulated (PAM) parameters (maximal photosystem II photochemical efficiency Fv/Fm, actual photochemical efficiency Yield, and non-photochemical quenching NPQ) of the algae over a 96-h period. Simultaneously, the bioconcentration of the metals by the algal cells in the presence of the ASs was measured. The presence of ACE enhanced the growth of S. obliquus and promoted the bioconcentration of Cd(2+) in S. obliquus, while the impacts of SUC were not significant. Meanwhile, EC50 values of Cd(2+) on the growth of S. obliquus increased from 0.42 mg/L to 0.54 mg/L and 0.48 mg/L with the addition of 1.0 mg/L ACE and SUC, respectively. As for Cu(2+), EC50 values increased from 0.13 mg/L to 0.17 mg/L and 0.15 mg/L with the addition of 1.0 mg/L ACE and SUC, respectively. In summary, the two ASs reduced the toxicity of the metals on the algae, with ACE showing greater effect than SUC. Although not as sensitive as the cell specific growth rate, PAM parameters could disclose the mechanisms involved in metal toxicity at subcellular levels. This study provides the first evidence for the possible impact of ASs on the ecotoxicity of heavy metals. Copyright © 2016 Elsevier Ltd. All rights reserved.

Applicability of concentration factors for the heavy metals hazard identification

International Nuclear Information System (INIS)

Guzzi, Luigi

2006-01-01

The bioconcentration factor (BCF) and bioaccumulation factor (BAF) used as criteria for heavy metals hazards identification are inadequate. These considerations is based on the argument that the BCF-BAF model was developed and validated for xenobiotic synthetic organic substances and that does not recognize the complex internal metal dynamic of uptake, the internal sequestration, and the essentially of some heavy metals [it

Refining revolution

Energy Technology Data Exchange (ETDEWEB)

Fesharaki, F.; Isaak, D.

1984-01-01

A review of changes in the oil refining industry since 1973 examines the drop in capacity use and its effect on profits of the Organization of Economic Cooperation and Development (OECD) countries compared to world refining. OPEC countries used their new oil revenues to expand Gulf refineries, which put additional pressure on OECD refiners. OPEC involvement in global marketing, however, could help to secure supplies. Scrapping some older OECD refineries could improve the percentage of capacity in use if new construction is kept to a minimum. Other issues facing refiners are the changes in oil demand patterns and government responses to the market. 2 tables.

Evaluation and comparison of benchmark QSAR models to predict a relevant REACH endpoint: The bioconcentration factor (BCF)

Energy Technology Data Exchange (ETDEWEB)

Gissi, Andrea [Laboratory of Environmental Chemistry and Toxicology, IRCCS – Istituto di Ricerche Farmacologiche Mario Negri, Via La Masa 19, 20156 Milano (Italy); Dipartimento di Farmacia – Scienze del Farmaco, Università degli Studi di Bari “Aldo Moro”, Via E. Orabona 4, 70125 Bari (Italy); Lombardo, Anna; Roncaglioni, Alessandra [Laboratory of Environmental Chemistry and Toxicology, IRCCS – Istituto di Ricerche Farmacologiche Mario Negri, Via La Masa 19, 20156 Milano (Italy); Gadaleta, Domenico [Laboratory of Environmental Chemistry and Toxicology, IRCCS – Istituto di Ricerche Farmacologiche Mario Negri, Via La Masa 19, 20156 Milano (Italy); Dipartimento di Farmacia – Scienze del Farmaco, Università degli Studi di Bari “Aldo Moro”, Via E. Orabona 4, 70125 Bari (Italy); Mangiatordi, Giuseppe Felice; Nicolotti, Orazio [Dipartimento di Farmacia – Scienze del Farmaco, Università degli Studi di Bari “Aldo Moro”, Via E. Orabona 4, 70125 Bari (Italy); Benfenati, Emilio, E-mail: emilio.benfenati@marionegri.it [Laboratory of Environmental Chemistry and Toxicology, IRCCS – Istituto di Ricerche Farmacologiche Mario Negri, Via La Masa 19, 20156 Milano (Italy)

2015-02-15

The bioconcentration factor (BCF) is an important bioaccumulation hazard assessment metric in many regulatory contexts. Its assessment is required by the REACH regulation (Registration, Evaluation, Authorization and Restriction of Chemicals) and by CLP (Classification, Labeling and Packaging). We challenged nine well-known and widely used BCF QSAR models against 851 compounds stored in an ad-hoc created database. The goodness of the regression analysis was assessed by considering the determination coefficient (R{sup 2}) and the Root Mean Square Error (RMSE); Cooper's statistics and Matthew's Correlation Coefficient (MCC) were calculated for all the thresholds relevant for regulatory purposes (i.e. 100 L/kg for Chemical Safety Assessment; 500 L/kg for Classification and Labeling; 2000 and 5000 L/kg for Persistent, Bioaccumulative and Toxic (PBT) and very Persistent, very Bioaccumulative (vPvB) assessment) to assess the classification, with particular attention to the models' ability to control the occurrence of false negatives. As a first step, statistical analysis was performed for the predictions of the entire dataset; R{sup 2}>0.70 was obtained using CORAL, T.E.S.T. and EPISuite Arnot–Gobas models. As classifiers, ACD and log P-based equations were the best in terms of sensitivity, ranging from 0.75 to 0.94. External compound predictions were carried out for the models that had their own training sets. CORAL model returned the best performance (R{sup 2}{sub ext}=0.59), followed by the EPISuite Meylan model (R{sup 2}{sub ext}=0.58). The latter gave also the highest sensitivity on external compounds with values from 0.55 to 0.85, depending on the thresholds. Statistics were also compiled for compounds falling into the models Applicability Domain (AD), giving better performances. In this respect, VEGA CAESAR was the best model in terms of regression (R{sup 2}=0.94) and classification (average sensitivity>0.80). This model also showed the best

Evaluation and comparison of benchmark QSAR models to predict a relevant REACH endpoint: The bioconcentration factor (BCF)

International Nuclear Information System (INIS)

Gissi, Andrea; Lombardo, Anna; Roncaglioni, Alessandra; Gadaleta, Domenico; Mangiatordi, Giuseppe Felice; Nicolotti, Orazio; Benfenati, Emilio

2015-01-01

The bioconcentration factor (BCF) is an important bioaccumulation hazard assessment metric in many regulatory contexts. Its assessment is required by the REACH regulation (Registration, Evaluation, Authorization and Restriction of Chemicals) and by CLP (Classification, Labeling and Packaging). We challenged nine well-known and widely used BCF QSAR models against 851 compounds stored in an ad-hoc created database. The goodness of the regression analysis was assessed by considering the determination coefficient (R 2 ) and the Root Mean Square Error (RMSE); Cooper's statistics and Matthew's Correlation Coefficient (MCC) were calculated for all the thresholds relevant for regulatory purposes (i.e. 100 L/kg for Chemical Safety Assessment; 500 L/kg for Classification and Labeling; 2000 and 5000 L/kg for Persistent, Bioaccumulative and Toxic (PBT) and very Persistent, very Bioaccumulative (vPvB) assessment) to assess the classification, with particular attention to the models' ability to control the occurrence of false negatives. As a first step, statistical analysis was performed for the predictions of the entire dataset; R 2 >0.70 was obtained using CORAL, T.E.S.T. and EPISuite Arnot–Gobas models. As classifiers, ACD and log P-based equations were the best in terms of sensitivity, ranging from 0.75 to 0.94. External compound predictions were carried out for the models that had their own training sets. CORAL model returned the best performance (R 2 ext =0.59), followed by the EPISuite Meylan model (R 2 ext =0.58). The latter gave also the highest sensitivity on external compounds with values from 0.55 to 0.85, depending on the thresholds. Statistics were also compiled for compounds falling into the models Applicability Domain (AD), giving better performances. In this respect, VEGA CAESAR was the best model in terms of regression (R 2 =0.94) and classification (average sensitivity>0.80). This model also showed the best regression (R 2 =0.85) and

The European refining and distribution industry at the 2010 vista

International Nuclear Information System (INIS)

Lacour, J.J.; Tessmer, G.; Ward, I.

1998-01-01

Oil company chairmen belonging to the AFTP, DGMK and IP associations met together to debate about the future of the European refining industry. The following topics were discussed: is it the end of the refining crisis? Which uncertainties will have to be met? What is the situation of petroleum products supply and demand? What are the consumers' expectations? How to face the environmental constraints? Which future for the refining activities in Europe? Seven round-tables took place with the following themes: the factors of uncertainty in the future of refining activities, the petroleum products supply and demand (automotive fuels, fuel oils, lubricants), the refining activities and the supply of consumers (service stations and supermarkets), the situation of the European petroleum policy, the European refining industry and the public regulations (development of more efficient environmental approaches), the impact of environmental constraints and the technical solutions, and the future of the refining industry. (J.S.)

Effects of titanium dioxide nanoparticles on lead bioconcentration and toxicity on thyroid endocrine system and neuronal development in zebrafish larvae.

Science.gov (United States)

Miao, Wei; Zhu, Biran; Xiao, Xiaohong; Li, Ying; Dirbaba, Niguse Bekele; Zhou, Bingsheng; Wu, Hongjuan

2015-04-01

Nanoparticles (NPs) have attracted considerable attention because of their wide range of applications. Interactions between heavy metals (e.g., Pb) and NPs in aquatic environments may modify the bioavailability and toxicity of heavy metals. Therefore, this study investigated the influence of NPs (e.g., nano-TiO2) on the bioavailability and toxicity of Pb and its effects in the thyroid endocrine and nervous systems of zebrafish (Danio rerio) larvae. Zebrafish embryos (2-h post-fertilization) were exposed to five concentrations of Pb alone (0, 5, 10, 20, and 30μg/L) or in combination with nano-TiO2 (0.1mg/L) until 6 days post-fertilization. Results showed that the bioconcentration of Pb was significantly enhanced when combined with nano-TiO2 than when used alone. Zebrafish exposure to Pb alone at 30μg/L significantly decreased the thyroid hormone levels (T4 and T3), whereas nano-TiO2 treatment alone did not produce detectable changes. The levels of T4 and T3 were further decreased when Pb was combined with nano-TiO2 than when used alone. The transcription of the thyroid hormone-related factor tg gene was remarkably down-regulated by Pb treatment alone but up-regulated when Pb was combined with nano-TiO2. The significant up-regulation of tshβ gene and the down-regulation of TTR gene expression in the hypothalamic-pituitary-thyroid were observed in Pb with or without nano-TiO2 treatment groups. In addition, the transcription of genes involved in central nervous system (CNS) development (α-tubulin, mbp, gfap and shha) were significantly down-regulated by Pb and nano-TiO2 co-exposure as compared with Pb exposure alone. The locomotion activity analyzes confirmed that nano-TiO2 might enhance the toxicity of Pb to CNS development. These results suggest that nano-TiO2 increase bioconcentration of lead, which lead to the disruption of thyroid endocrine and neuronal system in zebrafish larvae. Copyright © 2015 Elsevier B.V. All rights reserved.

Macromolecular refinement by model morphing using non-atomic parameterizations.

Science.gov (United States)

Cowtan, Kevin; Agirre, Jon

2018-02-01

Refinement is a critical step in the determination of a model which explains the crystallographic observations and thus best accounts for the missing phase components. The scattering density is usually described in terms of atomic parameters; however, in macromolecular crystallography the resolution of the data is generally insufficient to determine the values of these parameters for individual atoms. Stereochemical and geometric restraints are used to provide additional information, but produce interrelationships between parameters which slow convergence, resulting in longer refinement times. An alternative approach is proposed in which parameters are not attached to atoms, but to regions of the electron-density map. These parameters can move the density or change the local temperature factor to better explain the structure factors. Varying the size of the region which determines the parameters at a particular position in the map allows the method to be applied at different resolutions without the use of restraints. Potential applications include initial refinement of molecular-replacement models with domain motions, and potentially the use of electron density from other sources such as electron cryo-microscopy (cryo-EM) as the refinement model.

Lossless, Near-Lossless, and Refinement Coding of Bi-level Images

DEFF Research Database (Denmark)

Martins, Bo; Forchhammer, Søren Otto

1999-01-01

We present general and unified algorithms for lossy/lossless coding of bi-level images. The compression is realized by applying arithmetic coding to conditional probabilities. As in the current JBIG standard the conditioning may be specified by a template.For better compression, the more general...... to the specialized soft pattern matching techniques which work better for text. Template based refinement coding is applied for lossy-to-lossless refinement. Introducing only a small amount of loss in halftoned test images, compression is increased by up to a factor of four compared with JBIG. Lossy, lossless......, and refinement decoding speed and lossless encoding speed are less than a factor of two slower than JBIG. The (de)coding method is proposed as part of JBIG2, an emerging international standard for lossless/lossy compression of bi-level images....

Bio-concentration of Polycyclic Aromatic Hydrocarbons in the grey Mangrove (Avicennia marina along eastern coast of the Red Sea

Directory of Open Access Journals (Sweden)

El-Amin Bashir M.

2017-12-01

Full Text Available There are numerous sources of chemical pollutants which can impact the mangrove ecosystem through adjacent waters, industrial and sewage discharges and air depositions. Polycyclic aromatic hydrocarbons (PAHs are semi volatile ubiquitous anthropogenic pollutants detected in all environmental compartments. In the monitoring framework for the mangrove ecosystem along the Red Sea coast of Saudi Arabia, nine mangrove stands were examined for the accumulation of PAHs. Polycyclic aromatic hydrocarbons were measured using Gas Chromatography-Mass Spectrometry (GC-MS. The mean values detected for total PAHs in sediments, roots and leaf were 2.98, 8.57 and 23.43 ng/g respectively. The trend of the total PAHs concentration in all sites showed the descending order: leaf > roots > sediments. Beside the sandy nature of the sediments, the presences of all stands in remote areas fare from the direct anthropogenic effects lead to these relative low values. PAH bio-concentration factors for leaf are two to three magnitudes higher than that in roots, suggesting atmosphere deposition /leaf uptake mechanism in addition to the sediment/root mechanism. The diagnostic ratios revealed that the sources of PAHs are mainly pyrogenic.

Apple snails and their endosymbionts bioconcentrate heavy metals and uranium from contaminated drinking water.

Science.gov (United States)

Vega, Israel A; Arribére, María A; Almonacid, Andrea V; Ribeiro Guevara, Sergio; Castro-Vazquez, Alfredo

2012-09-01

The differential ability of apple snail tissues, endosymbionts, and eggs to bioaccumulate several metals (Sb, As, Ba, Br, Zn, Cr, Fe, Hg, Se, and U) was investigated. Metal concentrations were determined by neutron activation analysis in several tissues, endosymbionts, and eggs from mature apple snails cultured in either drinking water or reconstituted water (prepared with American Society for Testing and Materials type I water). The highest bioconcentration factors (BCFs) in the midgut gland were found for Ba, Zn, Se, As, U, Br, and Hg (in decreasing order), while the highest in the kidney were for Ba, Br, and Hg. The foot showed the highest BCFs for Ba, Hg, Br, and Se (in decreasing order). Calcified tissues (uterus, shell) and eggs showed low BCFs, except for Ba. Both C corpuscles and gland tissue showed statistically higher BCFs than K corpuscles for Ba, Fe, U, Br, and Sb. The concentration of most of the studied elements was significantly lower in tissues and endosymbionts obtained from snails cultured in reconstituted water instead of drinking water. Snails cultured in reconstituted water and then exposed or not to Hg, As, and U (at the maximum contaminant level allowed by the US Environmental Protection Agency) also resulted in high levels accumulated in midgut gland, endosymbionts and kidney. Our findings suggest that the midgut gland (and the symbionts contained therein), the kidney, and the foot of Pomacea canaliculata may be useful bioindicators of Hg, As and U pollution in freshwater bodies and that the unrestricted use of ampullariid snails as human and animal food must be considered with caution.

Survey on composition and bioconcentration potential of 12 metallic elements in King Bolete (Boletus edulis) mushroom that emerged at 11 spatially distant sites.

Science.gov (United States)

Falandysz, Jerzy; Frankowska, Aneta; Jarzynska, Grazyna; Dryzałowska, Anna; Kojta, Anna K; Zhang, Dan

2011-01-01

This paper provides data on baseline concentrations, interrelationships and bioconcentration potential of 12 metallic elements by King Bolete collected from 11 spatially distant sites across Poland. There are significant differences in concentrations of metals (Al, Ba, Ca, Cd, Cu, Fe, K, Mg, Mn, Na, Sr, Zn) and their bioconcentration potential in King Bolete Boletus edulis at 11 spatially distant sites surveyed across Poland. These have resulted from significant geographical differences in trace metal concentrations in a layer (0-10 cm) of organic and mineral soil underneath to fruiting bodies and possible local bioavailabilities of macro- (Ca, K, Mg, Na) and trace metals (Al, Ba, Cd, Cu, Fe, Mn, Sr, Zn) to King Bolete. The use of highly appreciated wild-grown edible King Bolete mushroom has established a baseline measure of regional minerals status, heavy metals pollution and assessment of intake rates for wild mushroom dish fanciers against which future changes can be compared. Data on Cd, Cu and Zn from this study and from literature search can be useful to set the maximum limit of these metals in King Bolete collected from uncontaminated (background) areas. In this report also reviewed are data on Al, Ba, Ca, Cd, Cu, Fe, K, Mg, Mn, Na, Sr and Zn accumulation in King Bolete.

Review of Grain Refinement of Cast Metals Through Inoculation: Theories and Developments

Science.gov (United States)

Liu, Zhilin

2017-10-01

The inoculation method of grain refinement is widely used in research and industry. Because of its commercial and engineering importance, extensive research on the mechanisms/theories of grain refinement and development of effective grain refiners for diverse cast metals/alloys has been conducted. In 1999, Easton and St. John reviewed the mechanisms of grain refinement of cast Al alloys. Since then, grain refinement in alloys of Al, Mg, Fe, Ti, Cu, and Zn has evolved a lot. However, there is still no full consensus on the mechanisms/theories of grain refinement. Moreover, some new grain refiners developed based on the theories do not ensure efficient grain refinement. Thus, the factors that contribute to grain refinement are still not fully understood. Clarification of the prerequisite issues that occur in grain refinement is required using recent theories. This review covers multiple metals/alloys and developments in grain refinement from the last twenty years. The characteristics of effective grain refiners are considered from four perspectives: effective particle/matrix wetting configuration, sufficiently powerful segregating elements, preferential crystallographic matching, and geometrical features of effective nucleants. Then, recent mechanisms/theories on the grain refinement of cast metals/alloys are reviewed, including the peritectic-related, hypernucleation, inert nucleant, and constitutional supercooling-driven theories. Further, developments of deterministic and probabilistic modeling and nucleation crystallography in the grain refinement of cast metals are reviewed. Finally, the latest progress in the grain refinement of cast Zn and its alloys is described, and future work on grain refinement is summarized.

Microstructures and Grain Refinement of Additive-Manufactured Ti- xW Alloys

Science.gov (United States)

Mendoza, Michael Y.; Samimi, Peyman; Brice, David A.; Martin, Brian W.; Rolchigo, Matt R.; LeSar, Richard; Collins, Peter C.

2017-07-01

It is necessary to better understand the composition-processing-microstructure relationships that exist for materials produced by additive manufacturing. To this end, Laser Engineered Net Shaping (LENS™), a type of additive manufacturing, was used to produce a compositionally graded titanium binary model alloy system (Ti- xW specimen (0 ≤ x ≤ 30 wt pct), so that relationships could be made between composition, processing, and the prior beta grain size. Importantly, the thermophysical properties of the Ti- xW, specifically its supercooling parameter ( P) and growth restriction factor ( Q), are such that grain refinement is expected and was observed. The systematic, combinatorial study of this binary system provides an opportunity to assess the mechanisms by which grain refinement occurs in Ti-based alloys in general, and for additive manufacturing in particular. The operating mechanisms that govern the relationship between composition and grain size are interpreted using a model originally developed for aluminum and magnesium alloys and subsequently applied for titanium alloys. The prior beta grain factor observed and the interpretations of their correlations indicate that tungsten is a good grain refiner and such models are valid to explain the grain-refinement process. By extension, other binary elements or higher order alloy systems with similar thermophysical properties should exhibit similar grain refinement.

78 FR 20176 - Credit for Renewable Electricity Production, Refined Coal Production, and Indian Coal Production...

Science.gov (United States)

2013-04-03

..., Refined Coal Production, and Indian Coal Production, and Publication of Inflation Adjustment Factors and... renewable electricity production, refined coal production, and Indian coal production under section 45... resources, and to 2013 sales of refined coal and Indian coal produced in the United States or a possession...

77 FR 21835 - Credit for Renewable Electricity Production, Refined Coal Production, and Indian Coal Production...

Science.gov (United States)

2012-04-11

..., Refined Coal Production, and Indian Coal Production, and Publication of Inflation Adjustment Factors and... electricity production, refined coal production, and Indian coal production under section 45. DATES: The 2012... sales of refined coal and Indian coal produced in the United States or a possession thereof. Inflation...

Iterative model-building, structure refinement, and density modification with the PHENIX AutoBuild Wizard

Energy Technology Data Exchange (ETDEWEB)

Los Alamos National Laboratory, Mailstop M888, Los Alamos, NM 87545, USA; Lawrence Berkeley National Laboratory, One Cyclotron Road, Building 64R0121, Berkeley, CA 94720, USA; Department of Haematology, University of Cambridge, Cambridge CB2 0XY, England; Terwilliger, Thomas; Terwilliger, T.C.; Grosse-Kunstleve, Ralf Wilhelm; Afonine, P.V.; Moriarty, N.W.; Zwart, P.H.; Hung, L.-W.; Read, R.J.; Adams, P.D.

2007-04-29

The PHENIX AutoBuild Wizard is a highly automated tool for iterative model-building, structure refinement and density modification using RESOLVE or TEXTAL model-building, RESOLVE statistical density modification, and phenix.refine structure refinement. Recent advances in the AutoBuild Wizard and phenix.refine include automated detection and application of NCS from models as they are built, extensive model completion algorithms, and automated solvent molecule picking. Model completion algorithms in the AutoBuild Wizard include loop-building, crossovers between chains in different models of a structure, and side-chain optimization. The AutoBuild Wizard has been applied to a set of 48 structures at resolutions ranging from 1.1 {angstrom} to 3.2 {angstrom}, resulting in a mean R-factor of 0.24 and a mean free R factor of 0.29. The R-factor of the final model is dependent on the quality of the starting electron density, and relatively independent of resolution.

Petroleum refining industry in China

International Nuclear Information System (INIS)

Walls, W.D.

2010-01-01

The oil refining industry in China has faced rapid growth in oil imports of increasingly sour grades of crude with which to satisfy growing domestic demand for a slate of lighter and cleaner finished products sold at subsidized prices. At the same time, the world petroleum refining industry has been moving from one that serves primarily local and regional markets to one that serves global markets for finished products, as world refining capacity utilization has increased. Globally, refined product markets are likely to experience continued globalization until refining investments significantly expand capacity in key demand regions. We survey the oil refining industry in China in the context of the world market for heterogeneous crude oils and growing world trade in refined petroleum products. (author)

Element composition of biota, water and sediment in the Forsmark area, Baltic Sea. Concentrations, bioconcentration factors and partitioning coefficients (Kd) of 48 elements

International Nuclear Information System (INIS)

Kumblad, Linda; Bradshaw, Clare

2008-08-01

In this study the elemental composition of biota, water and sediment from a shallow bay in the Forsmark region have been determined. The report presents data for 48 different elements (Al, As, Ba, Br, C, Ca, Cd, Ce, Cl, Co, Cr, Cs, Cu, Dy, Er, Eu, F, Fe, Gd, Hg, Ho, I, K, Li, Lu, Mg, Mn, N, Na, Nd, Ni, P, Pb, Pr, Ra, Rb, S, Se, Si, Sm, Tb, Th, Ti, Tm, V, Yb, Zn, Zr) in all major functional groups of the coastal ecosystem (phytoplankton, zooplankton, benthic microalgae, macroalgae, macrophytes, benthic herbivores, benthic filter feeders, benthic detrivores, planktivorous fish, benthic omnivorous fish, carnivorous fish, dissolved and particulate matter in the water and the sediment) during spring 2005. The overall aim of the study is to contribute to a better understanding of ecological properties and processes that govern uptake and transfer of trace elements, heavy-metals, radionuclides and other non-essential elements/contaminants in coastal environments of the Baltic Sea. In addition, the data was collected to provide site-specific Bioconcentration Factors (BCF), Biomagnification Factors (BMF), partitioning coefficients (K d ) and element ratios (relative to carbon) for use in ongoing SKB safety assessments. All these values, as well as the element concentration data from which they are derived, are presented here. As such, this is mainly a data report, although initial interpretations of the data also are presented and discussed. Reported data include element concentrations, CNP-stoichiometry, and multivariate data analysis. Elemental concentrations varied greatly between organisms and environmental components, depending on the function of the elements, and the habitat, ecosystem function, trophic level and morphology (taxonomy) of the organisms. The results show for instance that food intake and metabolism strongly influence the elemental composition of organisms. The three macrophytes had quite similar elemental composition (despite their taxonomic differences

On the refinement calculus

CERN Document Server

Vickers, Trevor

1992-01-01

On the Refinement Calculus gives one view of the development of the refinement calculus and its attempt to bring together - among other things - Z specifications and Dijkstra's programming language. It is an excellent source of reference material for all those seeking the background and mathematical underpinnings of the refinement calculus.

Hirshfeld atom refinement.

Science.gov (United States)

Capelli, Silvia C; Bürgi, Hans-Beat; Dittrich, Birger; Grabowsky, Simon; Jayatilaka, Dylan

2014-09-01

Hirshfeld atom refinement (HAR) is a method which determines structural parameters from single-crystal X-ray diffraction data by using an aspherical atom partitioning of tailor-made ab initio quantum mechanical molecular electron densities without any further approximation. Here the original HAR method is extended by implementing an iterative procedure of successive cycles of electron density calculations, Hirshfeld atom scattering factor calculations and structural least-squares refinements, repeated until convergence. The importance of this iterative procedure is illustrated via the example of crystalline ammonia. The new HAR method is then applied to X-ray diffraction data of the dipeptide Gly-l-Ala measured at 12, 50, 100, 150, 220 and 295 K, using Hartree-Fock and BLYP density functional theory electron densities and three different basis sets. All positions and anisotropic displacement parameters (ADPs) are freely refined without constraints or restraints - even those for hydrogen atoms. The results are systematically compared with those from neutron diffraction experiments at the temperatures 12, 50, 150 and 295 K. Although non-hydrogen-atom ADPs differ by up to three combined standard uncertainties (csu's), all other structural parameters agree within less than 2 csu's. Using our best calculations (BLYP/cc-pVTZ, recommended for organic molecules), the accuracy of determining bond lengths involving hydrogen atoms from HAR is better than 0.009 Å for temperatures of 150 K or below; for hydrogen-atom ADPs it is better than 0.006 Å(2) as judged from the mean absolute X-ray minus neutron differences. These results are among the best ever obtained. Remarkably, the precision of determining bond lengths and ADPs for the hydrogen atoms from the HAR procedure is comparable with that from the neutron measurements - an outcome which is obtained with a routinely achievable resolution of the X-ray data of 0.65 Å.

North American refining

International Nuclear Information System (INIS)

Osten, James; Haltmaier, Susan

2000-01-01

This article examines the current status of the North American refining industry, and considers the North American economy and the growth in demand in the petroleum industry, petroleum product demand and quality, crude oil upgrading to meet product standards, and changes in crude oil feedstocks such as the use of heavier crudes and bitumens. Refining expansion, the declining profits in refining, and changes due to environmental standards are discussed. The Gross Domestic Product and oil demand for the USA, Canada, Mexico, and Venezuela for the years 1995-2020 are tabulated

Iterative model building, structure refinement and density modification with the PHENIX AutoBuild wizard

International Nuclear Information System (INIS)

Terwilliger, Thomas C.; Grosse-Kunstleve, Ralf W.; Afonine, Pavel V.; Moriarty, Nigel W.; Zwart, Peter H.; Hung, Li-Wei; Read, Randy J.; Adams, Paul D.

2008-01-01

The highly automated PHENIX AutoBuild wizard is described. The procedure can be applied equally well to phases derived from isomorphous/anomalous and molecular-replacement methods. The PHENIX AutoBuild wizard is a highly automated tool for iterative model building, structure refinement and density modification using RESOLVE model building, RESOLVE statistical density modification and phenix.refine structure refinement. Recent advances in the AutoBuild wizard and phenix.refine include automated detection and application of NCS from models as they are built, extensive model-completion algorithms and automated solvent-molecule picking. Model-completion algorithms in the AutoBuild wizard include loop building, crossovers between chains in different models of a structure and side-chain optimization. The AutoBuild wizard has been applied to a set of 48 structures at resolutions ranging from 1.1 to 3.2 Å, resulting in a mean R factor of 0.24 and a mean free R factor of 0.29. The R factor of the final model is dependent on the quality of the starting electron density and is relatively independent of resolution

Refinement of Parallel and Reactive Programs

OpenAIRE

Back, R. J. R.

1992-01-01

We show how to apply the refinement calculus to stepwise refinement of parallel and reactive programs. We use action systems as our basic program model. Action systems are sequential programs which can be implemented in a parallel fashion. Hence refinement calculus methods, originally developed for sequential programs, carry over to the derivation of parallel programs. Refinement of reactive programs is handled by data refinement techniques originally developed for the sequential refinement c...

Creating value in refining

International Nuclear Information System (INIS)

Cobb, C.B.

2001-01-01

This article focuses on recent developments in the US refining industry and presents a model for improving the performance of refineries based on the analysis of the refining industry by Cap Gemini Ernst and Young. The identification of refineries in risk of failing, the construction of pipelines for refinery products from Gulf State refineries, mergers and acquisitions, and poor financial performance are discussed. Current challenges concerning the stagnant demand for refinery products, environmental regulations, and shareholder value are highlighted. The structure of the industry, the creation of value in refining, and the search for business models are examined. The top 25 US companies and US refining business groups are listed

Fate, toxicity and bioconcentration of cadmium on Pseudokirchneriella subcapitata and Lemna minor in mid-term single tests.

Science.gov (United States)

Clément, Bernard; Lamonica, Dominique

2018-03-01

In the frame of a project which consists in modeling a laboratory microcosm under cadmium pressure, we initiated this study on the fate and effects of cadmium in the presence of either the microalga Pseudokirchneriella subcapitata or the duckweed Lemna minor, two organisms of the microcosm. For each organism, growth inhibition tests on a duration of 2-3 weeks were carried out with the objective of linking effects with total dissolved, ionic and internalized forms of cadmium. Numbers of organisms (algal cells or duckweed fronds) in 2-L beakers filled with synthetic nutritive medium containing EDTA were counted during the course of assays, while cadmium concentrations in the water and in the organisms were measured. Free cadmium fraction was calculated using PHREEQC, a computer program for chemical speciation. Results showed that cadmium toxicity to microalgae could be correlated to the free divalent fraction of this metal, limited by the presence of EDTA, and to its concentration in the organisms. Bioconcentration factors for our medium were suggested for P. subcapitata (111,000 on the basis of free cadmium concentration) and L. minor (17,812 on the basis of total dissolved concentration). No effect concentrations were roughly estimated around 400 µg/g for Pseudokirchneriella subcapitata and 200-300 µg/g for Lemna minor. This study is a first step towards a fate model based on chemical speciation for a better understanding of microcosm results.

Refined isogeometric analysis for a preconditioned conjugate gradient solver

KAUST Repository

Garcia, Daniel; Pardo, D.; Dalcin, Lisandro; Calo, Victor M.

2018-01-01

Starting from a highly continuous Isogeometric Analysis (IGA) discretization, refined Isogeometric Analysis (rIGA) introduces C0 hyperplanes that act as separators for the direct LU factorization solver. As a result, the total computational cost

Southeast Asian oil markets and refining

Energy Technology Data Exchange (ETDEWEB)

Yamaguchi, N.D. [FACTS, Inc., Honolulu, Hawaii (United States)

1999-09-01

An overview of the Southeast Asian oil markets and refining is presented concentrating on Brunei, Malaysia, the Philippines, Singapore and Thailand refiners. Key statistics of the refiners in this region are tabulated. The demand and the quality of Indonesian, Malaysian, Philippine, Singapore and Thai petroleum products are analysed. Crude distillation unit capacity trends in the Southeastern Asian refining industry are discussed along with cracking to distillation ratios, refining in these countries, and the impact of changes in demand and refining on the product trade.

Southeast Asian oil markets and refining

International Nuclear Information System (INIS)

Yamaguchi, N.D.

1999-01-01

An overview of the Southeast Asian oil markets and refining is presented concentrating on Brunei, Malaysia, the Philippines, Singapore and Thailand refiners. Key statistics of the refiners in this region are tabulated. The demand and the quality of Indonesian, Malaysian, Philippine, Singapore and Thai petroleum products are analysed. Crude distillation unit capacity trends in the Southeastern Asian refining industry are discussed along with cracking to distillation ratios, refining in these countries, and the impact of changes in demand and refining on the product trade

Red refinements of simplices into congruent subsimplices

Czech Academy of Sciences Publication Activity Database

Korotov, S.; Křížek, Michal

2014-01-01

Roč. 67, č. 12 (2014), s. 2199-2204 ISSN 0898-1221 R&D Projects: GA ČR GA14-02067S Institutional support: RVO:67985840 Keywords : sommerville tetrahedron * red refinement * higher-dimensional simplex Subject RIV: BA - General Mathematics Impact factor: 1.697, year: 2014 http://www.sciencedirect.com/science/article/pii/S0898122114000662

Effect of strontium on the grain refining efficiency of Mg-3Al alloy refined by carbon inoculation

International Nuclear Information System (INIS)

Du Jun; Yang Jian; Kuwabara, Mamoru; Li Wenfang; Peng Jihua

2009-01-01

The effect of Sr on the grain refining efficiency of the Mg-3Al alloy refined by carbon inoculation has been investigated in the present study. A significant grain refinement was obtained for the Mg-3Al alloy treated with either 0.2% C or 0.2% Sr. The Al-C-O particles were found in the sample refined by 0.2% C, and the element O should come from reaction between Al 4 C 3 nuclei of Mg grains and water during the process of sample preparation. The grain size of the sample refined by carbon inoculation was further decreased after the combined addition of Sr. The grain size decreased with increasing Sr content. Much higher refining efficiency was obtained when the Sr addition was increased to 0.5%. Sr is an effective element to improve the grain refining efficiency for the Mg-Al alloys refined by carbon inoculation. The number of Al 4 C 3 particles in the sample refined by the combination of carbon and Sr was more than that in the sample refined by only carbon. No Al-C-O-Sr-rich particles were obviously found in the sample refined by the combination of carbon and a little (<0.5%) Sr addition

Linearly Refined Session Types

Directory of Open Access Journals (Sweden)

Pedro Baltazar

2012-11-01

Full Text Available Session types capture precise protocol structure in concurrent programming, but do not specify properties of the exchanged values beyond their basic type. Refinement types are a form of dependent types that can address this limitation, combining types with logical formulae that may refer to program values and can constrain types using arbitrary predicates. We present a pi calculus with assume and assert operations, typed using a session discipline that incorporates refinement formulae written in a fragment of Multiplicative Linear Logic. Our original combination of session and refinement types, together with the well established benefits of linearity, allows very fine-grained specifications of communication protocols in which refinement formulae are treated as logical resources rather than persistent truths.

Discovery and refinement of loci associated with lipid levels

NARCIS (Netherlands)

Willer, Cristen J.; Schmidt, Ellen M.; Sengupta, Sebanti; Peloso, Gina M.; Gustafsson, Stefan; Kanoni, Stavroula; Ganna, Andrea; Chen, Jin; Buchkovich, Martin L.; Mora, Samia; Beckmann, Jacques S.; Bragg-Gresham, Jennifer L.; Chang, Hsing-Yi; Demirkan, Ayşe; den Hertog, Heleen M.; Do, Ron; Donnelly, Louise A.; Ehret, Georg B.; Esko, Tõnu; Feitosa, Mary F.; Ferreira, Teresa; Fischer, Krista; Fontanillas, Pierre; Fraser, Ross M.; Freitag, Daniel F.; Gurdasani, Deepti; Heikkilä, Kauko; Hyppönen, Elina; Isaacs, Aaron; Jackson, Anne U.; Johansson, Asa; Johnson, Toby; Kaakinen, Marika; Kettunen, Johannes; Kleber, Marcus E.; Li, Xiaohui; Luan, Jian'an; Lyytikäinen, Leo-Pekka; Magnusson, Patrik K. E.; Mangino, Massimo; Mihailov, Evelin; Montasser, May E.; Müller-Nurasyid, Martina; Nolte, Ilja M.; O'Connell, Jeffrey R.; Palmer, Cameron D.; Perola, Markus; Petersen, Ann-Kristin; Sanna, Serena; Saxena, Richa; Service, Susan K.; Shah, Sonia; Shungin, Dmitry; Sidore, Carlo; Song, Ci; Strawbridge, Rona J.; Surakka, Ida; Tanaka, Toshiko; Teslovich, Tanya M.; Thorleifsson, Gudmar; van den Herik, Evita G.; Voight, Benjamin F.; Volcik, Kelly A.; Waite, Lindsay L.; Wong, Andrew; Wu, Ying; Zhang, Weihua; Absher, Devin; Asiki, Gershim; Barroso, Inês; Been, Latonya F.; Bolton, Jennifer L.; Bonnycastle, Lori L.; Brambilla, Paolo; Burnett, Mary S.; Cesana, Giancarlo; Dimitriou, Maria; Doney, Alex S. F.; Döring, Angela; Elliott, Paul; Epstein, Stephen E.; Eyjolfsson, Gudmundur Ingi; Gigante, Bruna; Goodarzi, Mark O.; Grallert, Harald; Gravito, Martha L.; Groves, Christopher J.; Hallmans, Göran; Hartikainen, Anna-Liisa; Hayward, Caroline; Hernandez, Dena; Hicks, Andrew A.; Holm, Hilma; Hung, Yi-Jen; Illig, Thomas; Jones, Michelle R.; Kaleebu, Pontiano; Kastelein, John J. P.; Khaw, Kay-Tee; Kim, Eric; Klopp, Norman; Komulainen, Pirjo; Kumari, Meena; Langenberg, Claudia; Lehtimäki, Terho; Lin, Shih-Yi; Lindström, Jaana; Loos, Ruth J. F.; Mach, François; McArdle, Wendy L.; Meisinger, Christa; Mitchell, Braxton D.; Müller, Gabrielle; Nagaraja, Ramaiah; Narisu, Narisu; Nieminen, Tuomo V. M.; Nsubuga, Rebecca N.; Olafsson, Isleifur; Ong, Ken K.; Palotie, Aarno; Papamarkou, Theodore; Pomilla, Cristina; Pouta, Anneli; Rader, Daniel J.; Reilly, Muredach P.; Ridker, Paul M.; Rivadeneira, Fernando; Rudan, Igor; Ruokonen, Aimo; Samani, Nilesh; Scharnagl, Hubert; Seeley, Janet; Silander, Kaisa; Stancáková, Alena; Stirrups, Kathleen; Swift, Amy J.; Tiret, Laurence; Uitterlinden, Andre G.; van Pelt, L. Joost; Vedantam, Sailaja; Wainwright, Nicholas; Wijmenga, Cisca; Wild, Sarah H.; Willemsen, Gonneke; Wilsgaard, Tom; Wilson, James F.; Young, Elizabeth H.; Zhao, Jing Hua; Adair, Linda S.; Arveiler, Dominique; Assimes, Themistocles L.; Bandinelli, Stefania; Bennett, Franklyn; Bochud, Murielle; Boehm, Bernhard O.; Boomsma, Dorret I.; Borecki, Ingrid B.; Bornstein, Stefan R.; Bovet, Pascal; Burnier, Michel; Campbell, Harry; Chakravarti, Aravinda; Chambers, John C.; Chen, Yii-Der Ida; Collins, Francis S.; Cooper, Richard S.; Danesh, John; Dedoussis, George; de Faire, Ulf; Feranil, Alan B.; Ferrières, Jean; Ferrucci, Luigi; Freimer, Nelson B.; Gieger, Christian; Groop, Leif C.; Gudnason, Vilmundur; Gyllensten, Ulf; Hamsten, Anders; Harris, Tamara B.; Hingorani, Aroon; Hirschhorn, Joel N.; Hofman, Albert; Hovingh, G. Kees; Hsiung, Chao Agnes; Humphries, Steve E.; Hunt, Steven C.; Hveem, Kristian; Iribarren, Carlos; Järvelin, Marjo-Riitta; Jula, Antti; Kähönen, Mika; Kaprio, Jaakko; Kesäniemi, Antero; Kivimaki, Mika; Kooner, Jaspal S.; Koudstaal, Peter J.; Krauss, Ronald M.; Kuh, Diana; Kuusisto, Johanna; Kyvik, Kirsten O.; Laakso, Markku; Lakka, Timo A.; Lind, Lars; Lindgren, Cecilia M.; Martin, Nicholas G.; März, Winfried; McCarthy, Mark I.; McKenzie, Colin A.; Meneton, Pierre; Metspalu, Andres; Moilanen, Leena; Morris, Andrew D.; Munroe, Patricia B.; Njølstad, Inger; Pedersen, Nancy L.; Power, Chris; Pramstaller, Peter P.; Price, Jackie F.; Psaty, Bruce M.; Quertermous, Thomas; Rauramaa, Rainer; Saleheen, Danish; Salomaa, Veikko; Sanghera, Dharambir K.; Saramies, Jouko; Schwarz, Peter E. H.; Sheu, Wayne H.-H.; Shuldiner, Alan R.; Siegbahn, Agneta; Spector, Tim D.; Stefansson, Kari; Strachan, David P.; Tayo, Bamidele O.; Tremoli, Elena; Tuomilehto, Jaakko; Uusitupa, Matti; van Duijn, Cornelia M.; Vollenweider, Peter; Wallentin, Lars; Wareham, Nicholas J.; Whitfield, John B.; Wolffenbuttel, Bruce H. R.; Ordovas, Jose M.; Boerwinkle, Eric; Palmer, Colin N. A.; Thorsteinsdottir, Unnur; Chasman, Daniel I.; Rotter, Jerome I.; Franks, Paul W.; Ripatti, Samuli; Cupples, L. Adrienne; Sandhu, Manjinder S.; Rich, Stephen S.; Boehnke, Michael; Deloukas, Panos; Kathiresan, Sekar; Mohlke, Karen L.; Ingelsson, Erik; Abecasis, Gonçalo R.

2013-01-01

Levels of low-density lipoprotein (LDL) cholesterol, high-density lipoprotein (HDL) cholesterol, triglycerides and total cholesterol are heritable, modifiable risk factors for coronary artery disease. To identify new loci and refine known loci influencing these lipids, we examined 188,577

The US petroleum refining industry in the 1980's

Energy Technology Data Exchange (ETDEWEB)

1990-10-11

As part of the EIA program on petroleum, The US Petroleum Refining Industry in the 1980's, presents a historical analysis of the changes that took place in the US petroleum refining industry during the 1980's. It is intended to be of interest to analysts in the petroleum industry, state and federal government officials, Congress, and the general public. The report consists of six chapters and four appendices. Included is a detailed description of the major events and factors that affected the domestic refining industry during this period. Some of the changes that took place in the 1980's are the result of events that started in the 1970's. The impact of these events on US refinery configuration, operations, economics, and company ownership are examined. 23 figs., 11 tabs.

Commercial refining in the Mediterranean

International Nuclear Information System (INIS)

Packer, P.

1999-01-01

About 9% of the world's oil refining capacity is on the Mediterranean: some of the world's biggest and most advanced refineries are on Sicily and Sardinia. The Mediterranean refineries are important suppliers to southern Europe and N. Africa. The article discusses commercial refining in the Mediterranean under the headings of (i) historic development, (ii) product demand, (iii) refinery configurations, (iv) refined product trade, (v) financial performance and (vi) future outlook. Although some difficulties are foreseen, refining in the Mediterranean is likely to continue to be important well into the 21st century. (UK)

Refining Nodes and Edges of State Machines

DEFF Research Database (Denmark)

Hallerstede, Stefan; Snook, Colin

2011-01-01

State machines are hierarchical automata that are widely used to structure complex behavioural specifications. We develop two notions of refinement of state machines, node refinement and edge refinement. We compare the two notions by means of examples and argue that, by adopting simple conventions...... refinement theory and UML-B state machine refinement influences the style of node refinement. Hence we propose a method with direct proof of state machine refinement avoiding the detour via Event-B that is needed by UML-B....

Anomalies in the refinement of isoleucine

International Nuclear Information System (INIS)

Berntsen, Karen R. M.; Vriend, Gert

2014-01-01

The side-chain torsion angles of isoleucines in X-ray protein structures are a function of resolution, secondary structure and refinement software. Detailing the standard torsion angles used in refinement software can improve protein structure refinement. A study of isoleucines in protein structures solved using X-ray crystallography revealed a series of systematic trends for the two side-chain torsion angles χ 1 and χ 2 dependent on the resolution, secondary structure and refinement software used. The average torsion angles for the nine rotamers were similar in high-resolution structures solved using either the REFMAC, CNS or PHENIX software. However, at low resolution these programs often refine towards somewhat different χ 1 and χ 2 values. Small systematic differences can be observed between refinement software that uses molecular dynamics-type energy terms (for example CNS) and software that does not use these terms (for example REFMAC). Detailing the standard torsion angles used in refinement software can improve the refinement of protein structures. The target values in the molecular dynamics-type energy functions can also be improved

Anomalies in the refinement of isoleucine

Energy Technology Data Exchange (ETDEWEB)

Berntsen, Karen R. M.; Vriend, Gert, E-mail: gerrit.vriend@radboudumc.nl [Radboud University Medical Center, Geert Grooteplein 26-28, 6525 GA Nijmegen (Netherlands)

2014-04-01

The side-chain torsion angles of isoleucines in X-ray protein structures are a function of resolution, secondary structure and refinement software. Detailing the standard torsion angles used in refinement software can improve protein structure refinement. A study of isoleucines in protein structures solved using X-ray crystallography revealed a series of systematic trends for the two side-chain torsion angles χ{sub 1} and χ{sub 2} dependent on the resolution, secondary structure and refinement software used. The average torsion angles for the nine rotamers were similar in high-resolution structures solved using either the REFMAC, CNS or PHENIX software. However, at low resolution these programs often refine towards somewhat different χ{sub 1} and χ{sub 2} values. Small systematic differences can be observed between refinement software that uses molecular dynamics-type energy terms (for example CNS) and software that does not use these terms (for example REFMAC). Detailing the standard torsion angles used in refinement software can improve the refinement of protein structures. The target values in the molecular dynamics-type energy functions can also be improved.

Grain refinement of zinc-aluminium alloys

International Nuclear Information System (INIS)

Zaid, A.I.O.

2006-01-01

It is now well-established that the structure of the zinc-aluminum die casting alloys can be modified by the binary Al-Ti or the ternary Al-Ti-B master alloys. in this paper, grain refinement of zinc-aluminum alloys by rare earth materials is reviewed and discussed. The importance of grain refining of these alloys and parameters affecting it are presented and discussed. These include parameters related to the Zn-Al alloys cast, parameters related to the grain refining elements or alloys and parameters related to the process. The effect of addition of other alloying elements e.g. Zr either alone or in the presence of the main grain refiners Ti or Ti + B on the grain refining efficiency is also reviewed and discussed. Furthermore, based on the grain refinement and the parameters affecting it, a criterion for selection of the optimum grain refiner is suggested. Finally, the recent research work on the effect of grain refiners on the mechanical behaviour, impact strength, wear resistance, and fatigue life of these alloys are presented and discussed. (author)

Refining and petrochemicals

Energy Technology Data Exchange (ETDEWEB)

Constancio, Silva

2006-07-01

In 2004, refining margins showed a clear improvement that persisted throughout the first three quarters of 2005. This enabled oil companies to post significantly higher earnings for their refining activity in 2004 compared to 2003, with the results of the first half of 2005 confirming this trend. As for petrochemicals, despite a steady rise in the naphtha price, higher cash margins enabled a turnaround in 2004 as well as a clear improvement in oil company financial performance that should continue in 2005, judging by the net income figures reported for the first half-year. Despite this favorable business environment, capital expenditure in refining and petrochemicals remained at a low level, especially investment in new capacity, but a number of projects are being planned for the next five years. (author)

Refining and petrochemicals

International Nuclear Information System (INIS)

Constancio, Silva

2006-01-01

In 2004, refining margins showed a clear improvement that persisted throughout the first three quarters of 2005. This enabled oil companies to post significantly higher earnings for their refining activity in 2004 compared to 2003, with the results of the first half of 2005 confirming this trend. As for petrochemicals, despite a steady rise in the naphtha price, higher cash margins enabled a turnaround in 2004 as well as a clear improvement in oil company financial performance that should continue in 2005, judging by the net income figures reported for the first half-year. Despite this favorable business environment, capital expenditure in refining and petrochemicals remained at a low level, especially investment in new capacity, but a number of projects are being planned for the next five years. (author)

Joint refinement model for the spin resolved one-electron reduced density matrix of YTiO3 using magnetic structure factors and magnetic Compton profiles data.

Science.gov (United States)

Gueddida, Saber; Yan, Zeyin; Kibalin, Iurii; Voufack, Ariste Bolivard; Claiser, Nicolas; Souhassou, Mohamed; Lecomte, Claude; Gillon, Béatrice; Gillet, Jean-Michel

2018-04-28

In this paper, we propose a simple cluster model with limited basis sets to reproduce the unpaired electron distributions in a YTiO 3 ferromagnetic crystal. The spin-resolved one-electron-reduced density matrix is reconstructed simultaneously from theoretical magnetic structure factors and directional magnetic Compton profiles using our joint refinement algorithm. This algorithm is guided by the rescaling of basis functions and the adjustment of the spin population matrix. The resulting spin electron density in both position and momentum spaces from the joint refinement model is in agreement with theoretical and experimental results. Benefits brought from magnetic Compton profiles to the entire spin density matrix are illustrated. We studied the magnetic properties of the YTiO 3 crystal along the Ti-O 1 -Ti bonding. We found that the basis functions are mostly rescaled by means of magnetic Compton profiles, while the molecular occupation numbers are mainly modified by the magnetic structure factors.

Discovery and refinement of loci associated with lipid levels

DEFF Research Database (Denmark)

Willer, C. J.; Schmidt, E. M.; Sengupta, S.

2013-01-01

Levels of low-density lipoprotein (LDL) cholesterol, high-density lipoprotein (HDL) cholesterol, triglycerides and total cholesterol are heritable, modifiable risk factors for coronary artery disease. To identify new loci and refine known loci influencing these lipids, we examined 188,577 individ...... of using genetic data from individuals of diverse ancestry and provide insights into the biological mechanisms regulating blood lipids to guide future genetic, biological and therapeutic research.......Levels of low-density lipoprotein (LDL) cholesterol, high-density lipoprotein (HDL) cholesterol, triglycerides and total cholesterol are heritable, modifiable risk factors for coronary artery disease. To identify new loci and refine known loci influencing these lipids, we examined 188......,577 individuals using genome-wide and custom genotyping arrays. We identify and annotate 157 loci associated with lipid levels at P lipid levels in humans. Using dense genotyping in individuals of European, East Asian, South Asian and African ancestry...

Element composition of biota, water and sediment in the Forsmark area, Baltic Sea. Concentrations, bioconcentration factors and partitioning coefficients (K{sub d}) of 48 elements

Energy Technology Data Exchange (ETDEWEB)

Kumblad, Linda; Bradshaw, Clare (Dept. of Systems Ecology, Stockholm Univ. (Sweden))

2008-08-15

In this study the elemental composition of biota, water and sediment from a shallow bay in the Forsmark region have been determined. The report presents data for 48 different elements (Al, As, Ba, Br, C, Ca, Cd, Ce, Cl, Co, Cr, Cs, Cu, Dy, Er, Eu, F, Fe, Gd, Hg, Ho, I, K, Li, Lu, Mg, Mn, N, Na, Nd, Ni, P, Pb, Pr, Ra, Rb, S, Se, Si, Sm, Tb, Th, Ti, Tm, V, Yb, Zn, Zr) in all major functional groups of the coastal ecosystem (phytoplankton, zooplankton, benthic microalgae, macroalgae, macrophytes, benthic herbivores, benthic filter feeders, benthic detrivores, planktivorous fish, benthic omnivorous fish, carnivorous fish, dissolved and particulate matter in the water and the sediment) during spring 2005. The overall aim of the study is to contribute to a better understanding of ecological properties and processes that govern uptake and transfer of trace elements, heavy-metals, radionuclides and other non-essential elements/contaminants in coastal environments of the Baltic Sea. In addition, the data was collected to provide site-specific Bioconcentration Factors (BCF), Biomagnification Factors (BMF), partitioning coefficients (K{sub d}) and element ratios (relative to carbon) for use in ongoing SKB safety assessments. All these values, as well as the element concentration data from which they are derived, are presented here. As such, this is mainly a data report, although initial interpretations of the data also are presented and discussed. Reported data include element concentrations, CNP-stoichiometry, and multivariate data analysis. Elemental concentrations varied greatly between organisms and environmental components, depending on the function of the elements, and the habitat, ecosystem function, trophic level and morphology (taxonomy) of the organisms. The results show for instance that food intake and metabolism strongly influence the elemental composition of organisms. The three macrophytes had quite similar elemental composition (despite their taxonomic

Grain refinement of aluminum and its alloys

International Nuclear Information System (INIS)

Zaid, A.I.O.

2001-01-01

Grain refinement of aluminum and its alloys by the binary Al-Ti and Ternary Al-Ti-B master alloys is reviewed and discussed. The importance of grain refining to the cast industry and the parameters affecting it are presented and discussed. These include parameters related to the cast, parameters related to the grain refining alloy and parameters related to the process. The different mechanisms, suggested in the literature for the process of grain refining are presented and discussed, from which it is found that although the mechanism of refining by the binary Al-Ti is well established the mechanism of grain refining by the ternary Al-Ti-B is still a controversial matter and some research work is still needed in this area. The effect of the addition of other alloying elements in the presence of the grain refiner on the grain refining efficiency is also reviewed and discussed. It is found that some elements e.g. V, Mo, C improves the grain refining efficiency, whereas other elements e.g. Cr, Zr, Ta poisons the grain refinement. Based on the parameters affecting the grain refinement and its mechanism, a criterion for selection of the optimum grain refiner is forwarded and discussed. (author)

Preparation of Al-Ti-B grain refiner by SHS technology

International Nuclear Information System (INIS)

Nikitin, V.I.; Wanqi, J.I.E.; Kandalova, E.G.; Makarenko, A.G.; Yong, L.

2000-01-01

Since the discovery of the grain refinement effect of aluminum by titanium, especially with the existence of B or C in 1950, grain refiners are widely accepted in industry for microstructure control of aluminum alloys. Research on this topic is to obtain the highest grain refinement efficiency with the lowest possible addition of master alloy. It is widely accepted that the morphology and size of TiAl 3 particles, which are known as heterogeneous nucleation centers, are important factors deterring the grain refinement efficiency. Fine TiAl 3 particles are favorable. The grain refinement process shows a heredity phenomenon, which means that structural information from initial materials transfers through a melt to the final product. It is important to find the connection between microstructural parameters of the master alloy and the final product. To improve the quality of Al-Ti-B master alloys for the use as a grain refiner, a new method based on SHS (self-propagating high-temperature synthesis) technology has been developed in Samara State Technical University to produce the master alloys. SHS, as a new method for preparation of materials, was first utilized by Merzhanov in 1967. This method uses the energy from highly exothermic reactions to sustain the chemical reaction in a combustion wave. The advantages of SHS include simplicity, low energy requirement, and higher product purity. Because SHS reactions can take place between elemental reactants, it is easy to control product composition. The purposes of this investigation were to fabricate an SHS Al-5%Ti-1%B master alloy, to analyze its structure and to test its grain refining performance

Niobium-base grain refiner for aluminium

International Nuclear Information System (INIS)

Silva Pontes, P. da; Robert, M.H.; Cupini, N.L.

1980-01-01

A new chemical grain refiner for aluminium has been developed, using inoculation of a niobium-base compound. When a bath of molten aluminium is inoculated whith this refiner, an intermetallic aluminium-niobium compound is formed which acts as a powerful nucleant, producing extremely fine structure comparable to those obtained by means of the traditional grain refiner based on titanium and boron. It was found that the refinement of the structure depends upon the weight percentage of the new refiner inoculated as well as the time of holding the bath after inoculation and before pouring, but mainly on the inoculating temperature. (Author) [pt

Indian refining industry

International Nuclear Information System (INIS)

Singh, I.J.

2002-01-01

The author discusses the history of the Indian refining industry and ongoing developments under the headings: the present state; refinery configuration; Indian capabilities for refinery projects; and reforms in the refining industry. Tables lists India's petroleum refineries giving location and capacity; new refinery projects together with location and capacity; and expansion projects of Indian petroleum refineries. The Indian refinery industry has undergone substantial expansion as well as technological changes over the past years. There has been progressive technology upgrading, energy efficiency, better environmental control and improved capacity utilisation. Major reform processes have been set in motion by the government of India: converting the refining industry from a centrally controlled public sector dominated industry to a delicensed regime in a competitive market economy with the introduction of a liberal exploration policy; dismantling the administered price mechanism; and a 25 year hydrocarbon vision. (UK)

Spanish Refining

International Nuclear Information System (INIS)

Lores, F.R.

2001-01-01

An overview of petroleum refining in Spain is presented (by Repsol YPF) and some views on future trends are discussed. Spain depends heavily on imports. Sub-headings in the article cover: sources of crude imports, investments and logistics and marketing, -detailed data for each are shown diagrammatically. Tables show: (1) economic indicators (e.g. total GDP, vehicle numbers and inflation) for 1998-200; (2) crude oil imports for 1995-2000; (3) oil products balance for 1995-2000; (4) commodities demand, by product; (5) refining in Spain in terms of capacity per region; (6) outlets in Spain and other European countries in 2002 and (7) sales distribution channel by product

A Canadian refiner's perspective of synthetic crudes

International Nuclear Information System (INIS)

Halford, T.L.; McIntosh, A.P.; Rasmussen

1997-01-01

Some of the factors affecting a refiner's choice of crude oil include refinery hardware, particularly gas oil crackers, products slate and product specifications, crude availability, relative crude price and crude quality. An overview of synthetic crude, the use of synthetic crude combined with other crudes and a comparison of synthetic crude with conventional crude oil was given. The two main users of synthetic crude are basically two groups of refiners, those large groups who use synthetic crude combined with other crudes, and a smaller group who run synthetic crude on specially designed units as a sole feed. The effects of changes in fuel legislation were reviewed. It was predicted that the changes will have a mixed impact on the value of synthetic crude, but low sulphur diesel regulations and gasoline sulphur regulations will make current synthetic crudes attractive. The big future change with a negative impact will be diesel cetane increases to reduce engine emissions. This will reduce synthetic crude attractiveness due to distillate yields and quality and high gas oil yields. Similarly, any legislation limiting aromatics in diesel fuel will also make synthetic crudes less attractive. Problems experienced by refiners with hardware dedicated to synthetic crude (salt, naphthenic acid, fouling, quality variations) were also reviewed. 3 tabs

Modelling of glass refining kinetics-Part 1. Single bubbles

Czech Academy of Sciences Publication Activity Database

Němec, Lubomír; Kloužek, Jaroslav

2003-01-01

Roč. 47, č. 3 (2003), s. 81-87 ISSN 0862-5468 R&D Projects: GA AV ČR IBS4032103 Institutional research plan: CEZ:AV0Z4032918 Keywords : glass melt * refining * single bubble Subject RIV: CA - Inorganic Chemistry Impact factor: 0.449, year: 2003

Comparing Refinements for Failure and Bisimulation Semantics

NARCIS (Netherlands)

Eshuis, H.; Fokkinga, M.M.

2002-01-01

Refinement in bisimulation semantics is defined differently from refinement in failure semantics: in bisimulation semantics refinement is based on simulations between labelled transition systems, whereas in failure semantics refinement is based on inclusions between failure systems. There exist

Latin American oil markets and refining

International Nuclear Information System (INIS)

Yamaguchi, N.D.; Obadia, C.

1999-01-01

This paper provides an overview of the oil markets and refining in Argentina, Brazil, Chile, Colombia, Ecuador, Mexico, Peru and Venezuela, and examines the production of crude oil in these countries. Details are given of Latin American refiners highlighting trends in crude distillation unit capacity, cracking to distillation ratios, and refining in the different countries. Latin American oil trade is discussed, and charts are presented illustrating crude production, oil consumption, crude refining capacity, cracking to distillation ratios, and oil imports and exports

Relational Demonic Fuzzy Refinement

Directory of Open Access Journals (Sweden)

Fairouz Tchier

2014-01-01

Full Text Available We use relational algebra to define a refinement fuzzy order called demonic fuzzy refinement and also the associated fuzzy operators which are fuzzy demonic join (⊔fuz, fuzzy demonic meet (⊓fuz, and fuzzy demonic composition (□fuz. Our definitions and properties are illustrated by some examples using mathematica software (fuzzy logic.

Panorama 2012 - Refining 2030

International Nuclear Information System (INIS)

Marion, Pierre; Saint-Antonin, Valerie

2011-11-01

The major uncertainty characterizing the global energy landscape impacts particularly on transport, which remains the virtually-exclusive bastion of the oil industry. The industry must therefore respond to increasing demand for mobility against a background marked by the emergence of alternatives to oil-based fuels and the need to reduce emissions of pollutants and greenhouse gases (GHG). It is in this context that the 'Refining 2030' study conducted by IFP Energies Nouvelles (IFPEN) forecasts what the global supply and demand balance for oil products could be, and highlights the type and geographical location of the refinery investment required. Our study shows that the bulk of the refining investment will be concentrated in the emerging countries (mainly those in Asia), whilst the areas historically strong in refining (Europe and North America) face reductions in capacity. In this context, the drastic reduction in the sulphur specification of bunker oil emerges as a structural issue for European refining, in the same way as increasingly restrictive regulation of refinery CO 2 emissions (quotas/taxation) and the persistent imbalance between gasoline and diesel fuels. (authors)

Refining margins and prospects

International Nuclear Information System (INIS)

Baudouin, C.; Favennec, J.P.

1997-01-01

Refining margins throughout the world have remained low in 1996. In Europe, in spite of an improvement, particularly during the last few weeks, they are still not high enough to finance new investments. Although the demand for petroleum products is increasing, experts are still sceptical about any rapid recovery due to prevailing overcapacity and to continuing capacity growth. After a historical review of margins and an analysis of margins by regions, we analyse refining over-capacities in Europe and the unbalances between production and demand. Then we discuss the current situation concerning barriers to the rationalization, agreements between oil companies, and the consequences on the future of refining capacities and margins. (author)

The Factors Affecting the Adoption of Enviromental Management Accounting in the Oil Refining and Petrochemical Companies with Structural Equation Modeling Aprpoach

Directory of Open Access Journals (Sweden)

Zohre Karimi

2017-07-01

Full Text Available Introduction: Today, businesses must focus on profits on the one hand and social and environmental issues on the other hand to make balance between them. Conservation and sustainability are increasingly dependent on observance of corporate social responsibilities. For this reason, business units report on their sustainability and environmental accounting. The aim of this study was to examine and model the factors influencing the use of environmental management accounting tools from the points of view of financial managers and assistants who are in the oil refining and petrochemical companies. Method: The method used in this study was based on a descriptive survey and its design was quasi-experimental. For the field of study, a questionnaire including 5 general and 31 specific questions was used. The population consisted of financial administrators and assistants in oil refining and petrochemical companies, a subsidiary of the national oil company. There was no sampling method used and we tested the whole society including 182 people. To evaluate the reliability of the questionnaire, Cronbach’s Alpha and spilit-half were used. The measurement tools used in the study were reliable and none of the questions was removed. One sample t-test, Pearson correlation, confirmatory factor analysis, path analysis, structural equation modeling, two sample T-test and analysis of variance were performed by using LISREL and SPSS software. Results: The result of this test by using confirmatory factor analysis and structural equation test showed that the significance level of all the factors were larger than 1/96 and all the routes specified in the model were significant. Culture of the society in dealing with environmental issues, with a significance level of 5/54, had the greatest impact among the factors influencing the use of environmental management accounting tools. Conclusion: According to the results of the study, it is recommended that, by using

Refinement Types for TypeScript

OpenAIRE

Vekris, Panagiotis; Cosman, Benjamin; Jhala, Ranjit

2016-01-01

We present Refined TypeScript (RSC), a lightweight refinement type system for TypeScript, that enables static verification of higher-order, imperative programs. We develop a formal core of RSC that delineates the interaction between refinement types and mutability. Next, we extend the core to account for the imperative and dynamic features of TypeScript. Finally, we evaluate RSC on a set of real world benchmarks, including parts of the Octane benchmarks, D3, Transducers, and the TypeScript co...

Investigation of the influence of Ceratophyllum demersum to refine ...

African Journals Online (AJOL)

Water pollution has always been a major problem in the environment. Polluted water is harming for human health and need to clean water from pollution factors. One of the economic and rapid methods for elements removal is displacement metals by biosorption. The purpose of this study was refining diluted compost latex ...

Neutron Powder Diffraction and Constrained Refinement

DEFF Research Database (Denmark)

Pawley, G. S.; Mackenzie, Gordon A.; Dietrich, O. W.

1977-01-01

The first use of a new program, EDINP, is reported. This program allows the constrained refinement of molecules in a crystal structure with neutron diffraction powder data. The structures of p-C6F4Br2 and p-C6F4I2 are determined by packing considerations and then refined with EDINP. Refinement is...

Refined geometric transition and qq-characters

Science.gov (United States)

Kimura, Taro; Mori, Hironori; Sugimoto, Yuji

2018-01-01

We show the refinement of the prescription for the geometric transition in the refined topological string theory and, as its application, discuss a possibility to describe qq-characters from the string theory point of view. Though the suggested way to operate the refined geometric transition has passed through several checks, it is additionally found in this paper that the presence of the preferred direction brings a nontrivial effect. We provide the modified formula involving this point. We then apply our prescription of the refined geometric transition to proposing the stringy description of doubly quantized Seiberg-Witten curves called qq-characters in certain cases.

An analytical approach to elucidate the mechanism of grain refinement in calcium added Mg-Al alloys

International Nuclear Information System (INIS)

Nagasivamuni, B.; Ravi, K.R.

2015-01-01

Highlights: • Minor additions of Ca (<0.2%) refines the grain structure in Mg-(3, 6 and 9)Al alloys. • Analytical model elucidate that nucleation potency is enhanced after Ca addition. • Ternary Mg-Al-xCa growth restriction values (Q t ) are computed using Scheil equations. • Grain size predictions elucidate that nucleation events dominate grain refinement. • Growth restriction due to the higher Ca addition on grain refinement is not significant. - Abstract: The present study investigates the grain refinement of Mg-3Al, Mg-6Al and Mg-9Al alloys by calcium addition. The maximum reduction in grain size has been observed at 0.2% Ca addition in Mg-Al alloys, in which any further addition (up to 0.4%) has marginal improvement in grain refinement. The mechanism associated with the grain refinement of Mg-Al alloys by Ca addition is discussed in terms of growth restriction factor (Q) and constitutional undercooling (ΔT CS ) using analytical model. The influence of growth restriction factor (Q) on the final grain size of Ca-added Mg-Al alloys are calculated with the help analytical model by assuming that the number of nucleant particles is not altered through Ca addition. For accurate grain size calculations, the value of Q has been estimated with reliable thermodynamic database using Scheil solidification simulation. The comparison of predicted and experimental grain size results indicate that constitutional undercooling activation of nucleation events plays dominant role in grain refinement in Mg-Al alloys by calcium addition, whereas the increase in growth restriction value has negligible effect

Refinement of grain structure in 20 MnNiMo (SA508C) steel

International Nuclear Information System (INIS)

Sheng Zhongqi; Xiao Hong; Peng Feng; Zou Min

1997-04-01

The size of prior austenite grains and bainitic colonies of 20 MnNiMo (SA508C) steel (a reactor pressure vessel steel) after normal heat treatment is measured and its controlling factors are discussed. Results show that low aluminium content can induce serious mixed structure with fine and coarse grains in prior austenite. Fast cooling rate can promote refinement of bainitic colonies. Further refinement of grains can be obtained by inter-critical quenching. (5 figs., 1 tab.)

On Modal Refinement and Consistency

DEFF Research Database (Denmark)

Nyman, Ulrik; Larsen, Kim Guldstrand; Wasowski, Andrzej

2007-01-01

Almost 20 years after the original conception, we revisit several fundamental question about modal transition systems. First, we demonstrate the incompleteness of the standard modal refinement using a counterexample due to Hüttel. Deciding any refinement, complete with respect to the standard...

Refining - Panorama 2008

International Nuclear Information System (INIS)

2008-01-01

Investment rallied in 2007, and many distillation and conversion projects likely to reach the industrial stage were announced. With economic growth sustained in 2006 and still pronounced in 2007, oil demand remained strong - especially in emerging countries - and refining margins stayed high. Despite these favorable business conditions, tensions persisted in the refining sector, which has fallen far behind in terms of investing in refinery capacity. It will take renewed efforts over a long period to catch up. Looking at recent events that have affected the economy in many countries (e.g. the sub-prime crisis), prudence remains advisable

Refinement by interface instantiation

DEFF Research Database (Denmark)

Hallerstede, Stefan; Hoang, Thai Son

2012-01-01

be easily refined. Our first contribution hence is a proposal for a new construct called interface that encapsulates the external variables, along with a mechanism for interface instantiation. Using the new construct and mechanism, external variables can be refined consistently. Our second contribution...... is an approach for verifying the correctness of Event-B extensions using the supporting Rodin tool. We illustrate our approach by proving the correctness of interface instantiation....

Bioconcentration of 14 C-Carbofuran and 14 C- Lindane in fresh water Tilapia Nilitica and the bioavailability of their residues to rats

International Nuclear Information System (INIS)

Aly, M.A.S.; Afifi, L.M.

1997-01-01

Tilapia Nilotica were exposed to 14 C- carbofuran (125 MUg/1) and 14 C - lindane (80 MUg/1) for 96 h. Uptake period followed by 8 days depuration period. The bioconcentration factor (BCF) for carbofuran reached 32.4 at 12 h and 82 for lindane at 48 h. The amount of 14 C-activity found in fish treated with 14 C - carbofuran after the uptake period showed the following descending order: viscera > remaining parts > gills > muscles. In case of 14 C - lindane treated fish the recovered amount followed the order; remaining parts> viscera > gills muscles. During the depuration period, carbofuran residues taken up by fish were eliminated in 2 phases, an initial rapid phase followed by a slower gradual one. However, the rate of elimination in case of lindane was much slower especially during the first 2 days. At the end of the depuration period (8 days), the muscles (edible portion) contained 10% and 58% of 14 C -activity in case of carbofuran and lindane treated groups, respectively. Both insecticides proved to be bioavailable when rats were fed treated fish. Of the administered dose, 44.1% and 53.0% were excreted in urine and feces case of 14 C-carbofuran while in case of 14 C - lindane it was 30.9% and 41.7% for urine and feces, respectively. 2 figs., 2 tabs

The relationship between viscosity and refinement efficiency of pure aluminum by Al-Ti-B refiner

Energy Technology Data Exchange (ETDEWEB)

Yu Lina [Key Laboratory of Liquid Structure and Heredity of Materials, Ministry of Education, Shandong University, 73 Jingshi Road, Jinan 250061 (China); Liu Xiangfa [Key Laboratory of Liquid Structure and Heredity of Materials, Ministry of Education, Shandong University, 73 Jingshi Road, Jinan 250061 (China)]. E-mail: xfliu@sdu.edu.cn

2006-11-30

The relationship between viscosity and refinement efficiency of pure aluminum with the addition of Al-Ti-B master alloy was studied in this paper. The experimental results show that when the grain size of solidified sample is finer the viscosity of the melt is higher after the addition of different Al-Ti-B master alloys. This indicates that viscosity can be used to approximately estimate the refinement efficiency of Al-Ti-B refiners in production to a certain extent. The main reason was also discussed in this paper by using transmission electron microscopy (TEM) analysis and differential scanning calorimetry (DSC) experiment.

Relational Demonic Fuzzy Refinement

OpenAIRE

Tchier, Fairouz

2014-01-01

We use relational algebra to define a refinement fuzzy order called demonic fuzzy refinement and also the associated fuzzy operators which are fuzzy demonic join $({\\bigsqcup }_{\\mathrm{\\text{f}}\\mathrm{\\text{u}}\\mathrm{\\text{z}}})$ , fuzzy demonic meet $({\\sqcap }_{\\mathrm{\\text{f}}\\mathrm{\\text{u}}\\mathrm{\\text{z}}})$ , and fuzzy demonic composition $({\\square }_{\\mathrm{\\text{f}}\\mathrm{\\text{u}}\\mathrm{\\text{z}}})$ . Our definitions and properties are illustrated by some examples using ma...

Modelling of grain refinement driven by negative grain boundary energy

Czech Academy of Sciences Publication Activity Database

Fischer, F. D.; Zickler, G. A.; Svoboda, Jiří

2017-01-01

Roč. 97, č. 23 (2017), s. 1963-1977 ISSN 1478-6435 R&D Projects: GA ČR(CZ) GA15-06390S Institutional support: RVO:68081723 Keywords : grain refinement * grain nucleation * distribution concept * jump on distribution function Subject RIV: BJ - Thermodynamics OBOR OECD: Thermodynamics Impact factor: 1.505, year: 2016

Panorama 2007: Refining and Petrochemicals

International Nuclear Information System (INIS)

Silva, C.

2007-01-01

The year 2005 saw a new improvement in refining margins that continued during the first three quarters of 2006. The restoration of margins in the last three years has allowed the refining sector to regain its profitability. In this context, the oil companies reported earnings for fiscal year 2005 that were up significantly compared to 2004, and the figures for the first half-year 2006 confirm this trend. Despite this favorable business environment, investments only saw a minimal increase in 2005 and the improvement expected for 2006 should remain fairly limited. Looking to 2010-2015, it would appear that the planned investment projects with the highest probability of reaching completion will be barely adequate to cover the increase in demand. Refining sector should continue to find itself under pressure. As for petrochemicals, despite a steady up-trend in the naphtha price, the restoration of margins consolidated a comeback that started in 2005. All in all, capital expenditure remained fairly low in both the refining and petrochemicals sectors, but many projects are planned for the next ten years. (author)

Bioaccumulation of short chain chlorinated paraffins in a typical freshwater food web contaminated by e-waste in south china: Bioaccumulation factors, tissue distribution, and trophic transfer.

Science.gov (United States)

Sun, Runxia; Luo, Xiaojun; Tang, Bin; Chen, Laiguo; Liu, Yu; Mai, Bixian

2017-03-01

Short chain chlorinated paraffins (SCCPs) are under review for inclusion into the Stockholm Convention on Persistent Organic Pollutants. However, limited information is available on their bioaccumulation and biomagnification in ecosystems, which is hindering evaluation of their ecological and health risks. In the present study, wild aquatic organisms (fish and invertebrates), water, and sediment collected from an enclosed freshwater pond contaminated by electronic waste (e-waste) were analyzed to investigate the bioaccumulation, distribution, and trophic transfer of SCCPs in the aquatic ecosystem. SCCPs were detected in all of the investigated aquatic species at concentrations of 1700-95,000 ng/g lipid weight. The calculated bioaccumulation factors (BAFs) varied from 2.46 to 3.49. The relationship between log BAF and the octanol/water partition coefficient (log K OW ) for benthopelagic omnivorous fish species followed the empirical model of bioconcentration, indicating that bioconcentration plays an important role in accumulation of SCCPs. In contrast, the relationship for the benthic carnivorous fish and invertebrates was not consistent with the empirical model of bioconcentration, implying that the bioaccumulation of SCCPs in these species could be more influenced by other complex factors (e.g., habitat and feeding habit). Preferential distribution in the liver rather than in other tissues (e.g., muscle, gills, skin, and kidneys) was noted for the SCCP congeners with higher log K OW , and bioaccumulation pathway (i.e. water or sediment) can affect the tissue distribution of SCCP congeners. SCCPs underwent trophic dilution in the aquatic food web, and the trophic magnification factor (TMF) values of SCCP congener groups significantly correlated with their corresponding log K OW values (p < 0.0001). The present study results improved our understanding on the environmental behavior and fate of SCCPs in aquatic ecosystem. Copyright © 2016 Elsevier Ltd. All rights

The Development of Petroleum Refining in the World Market Dimensions of Sustainable Development

Directory of Open Access Journals (Sweden)

Alexey S. Shapran

2015-11-01

Full Text Available The development of petroleum refining in the world market dimensions of sustainable development investigated by the author's interpretation of the OECD model "pressure – state – response", where the pressure parameters proposed use – CO2 emissions, the state parameters – indicators of output and foreign trade refining sector; indicators to community response – (GDP eco-intensity. On the basis of economic and mathematical modeling performed of the adaptation and their value for use in the model parameters, performed a quantitative assessment of the relationship between the key requirements for sustainable development and development of the world petroleum refining market. This approach gave to perform a quantitative assessment of the level and impact of individual factors on the development of world petroleum market in countries with different technological structures.

Refining margins: recent trends

International Nuclear Information System (INIS)

Baudoin, C.; Favennec, J.P.

1999-01-01

Despite a business environment that was globally mediocre due primarily to the Asian crisis and to a mild winter in the northern hemisphere, the signs of improvement noted in the refining activity in 1996 were borne out in 1997. But the situation is not yet satisfactory in this sector: the low return on invested capital and the financing of environmental protection expenditure are giving cause for concern. In 1998, the drop in crude oil prices and the concomitant fall in petroleum product prices was ultimately rather favorable to margins. Two elements tended to put a damper on this relative optimism. First of all, margins continue to be extremely volatile and, secondly, the worsening of the economic and financial crisis observed during the summer made for a sharp decline in margins in all geographic regions, especially Asia. Since the beginning of 1999, refining margins are weak and utilization rates of refining capacities have decreased. (authors)

Panorama 2009 - refining

International Nuclear Information System (INIS)

2008-01-01

For oil companies to invest in new refining and conversion capacity, favorable conditions over time are required. In other words, refining margins must remain high and demand sustained over a long period. That was the situation prevailing before the onset of the financial crisis in the second half of 2008. The economic conjuncture has taken a substantial turn for the worse since then and the forecasts for 2009 do not look bright. Oil demand is expected to decrease in the OECD countries and to grow much more slowly in the emerging countries. It is anticipated that refining margins will fall in 2009 - in 2008, they slipped significantly in the United States - as a result of increasingly sluggish demand, especially for light products. The next few months will probably be unfavorable to investment. In addition to a gloomy business outlook, there may also be a problem of access to sources of financing. As for investment projects, a mainstream trend has emerged in the last few years: a shift away from the regions that have historically been most active (the OECD countries) towards certain emerging countries, mostly in Asia or the Middle East. The new conjuncture will probably not change this trend

Nonobtuse local tetrahedral refinements towards a polygonal face/interface

Czech Academy of Sciences Publication Activity Database

Korotov, S.; Křížek, Michal

2011-01-01

Roč. 24, č. 6 (2011), s. 817-821 ISSN 0893-9659 R&D Projects: GA AV ČR(CZ) IAA100190803 Institutional research plan: CEZ:AV0Z10190503 Keywords : finite element method * nonobtuse tetrahedron * local refinement * discrete maximum principle * boundary and interior layers * interface problem Subject RIV: BA - General Mathematics Impact factor: 1.371, year: 2011 http://www.sciencedirect.com/science/article/pii/S0893965910004726

Romanian refining industry assesses restructuring

International Nuclear Information System (INIS)

Tanasescu, D.G.

1991-01-01

The Romanian crude oil refining industry, as all the other economic sectors, faces the problems accompanying the transition from a centrally planned economy to a market economy. At present, all refineries have registered as joint-stock companies and all are coordinated and assisted by Rafirom S.A., from both a legal and a production point of view. Rafirom S.A. is a joint-stock company that holds shares in refineries and other stock companies with activities related to oil refining. Such activities include technological research, development, design, transportation, storage, and domestic and foreign marketing. This article outlines the market forces that are expected to: drive rationalization and restructuring of refining operations and define the targets toward which the reconfigured refineries should strive

Crystal structure refinement of α-Si3N4 using synchrotron radiation powder diffraction data: unbiased refinement strategy

International Nuclear Information System (INIS)

Toraya, H.

2000-01-01

The crystal structure of α-silicon nitride (Si 3 N 4 ) was refined by the Rietveld method using synchrotron radiation powder diffraction data (wavelength = 1.2 A) collected at station BL-4B2 in the photon factory. A refinement procedure that adopted a new weight function, w = 1/Y o e (Y o is the observed profile intensity and e ≅ 2), for the least-squares fitting [Toraya (1998). J. Appl. Cryst. 31, 333-343] was studied. The most reasonable structural parameters were obtained with e = 1.7. Crystal data of α-Si 3 N 4 : trigonal, P31c, a = 7.75193 (3), c = 5.61949 (4) A, V = 292.447 (3) A 3 , Z = 4; R p = 5.08, R wp = 6.50, R B = 3.36, R F = 2.26%. The following five factors are considered equally important for deriving accurate structural parameters from powder diffraction data: (i) sufficiently large sin θ/λ range of >0.8 A -1 ; (ii) adequate counting statistics; (iii) correct profile model; (iv) proper weighting on observations to give a uniform distribution of the mean weighted squared residuals; (v) high-angular-resolution powder diffraction data. (orig.)

Action Refinement

NARCIS (Netherlands)

Gorrieri, R.; Rensink, Arend; Bergstra, J.A.; Ponse, A.; Smolka, S.A.

2001-01-01

In this chapter, we give a comprehensive overview of the research results in the field of action refinement during the past 12 years. The different approaches that have been followed are outlined in detail and contrasted to each other in a uniform framework. We use two running examples to discuss

Optimization of Refining Craft for Vegetable Insulating Oil

Science.gov (United States)

Zhou, Zhu-Jun; Hu, Ting; Cheng, Lin; Tian, Kai; Wang, Xuan; Yang, Jun; Kong, Hai-Yang; Fang, Fu-Xin; Qian, Hang; Fu, Guang-Pan

2016-05-01

Vegetable insulating oil because of its environmental friendliness are considered as ideal material instead of mineral oil used for the insulation and the cooling of the transformer. The main steps of traditional refining process included alkali refining, bleaching and distillation. This kind of refining process used in small doses of insulating oil refining can get satisfactory effect, but can't be applied to the large capacity reaction kettle. This paper using rapeseed oil as crude oil, and the refining process has been optimized for large capacity reaction kettle. The optimized refining process increases the acid degumming process. The alkali compound adds the sodium silicate composition in the alkali refining process, and the ratio of each component is optimized. Add the amount of activated clay and activated carbon according to 10:1 proportion in the de-colorization process, which can effectively reduce the oil acid value and dielectric loss. Using vacuum pumping gas instead of distillation process can further reduce the acid value. Compared some part of the performance parameters of refined oil products with mineral insulating oil, the dielectric loss of vegetable insulating oil is still high and some measures are needed to take to further optimize in the future.

Grain refining efficiency of Al-Ti-C alloys

International Nuclear Information System (INIS)

Birol, Yuecel

2006-01-01

The problems associated with boride agglomeration and the poisoning effect of Zr in Zr-bearing alloys have created a big demand for boron-free grain refiners. The potential benefits of TiC as a direct nucleant for aluminium grains have thus generated a great deal of interest in TiC-bearing alloys in recent years. In Al-Ti-C grain refiners commercially available today, Al 3 Ti particles are introduced into the melt along with the TiC particles. Since the latter are claimed to nucleate α-Al directly, it is of great technological interest to see if reducing the Ti:C ratio further, i.e., increasing the C content of the grain refiner, will produce an increase in the grain refining efficiency of these alloys. A series of grain refiner samples with the Ti concentration fixed at 3% and a range of C contents between 0 and 0.75 were obtained by appropriately mixing an experimental Al-3Ti-0.75C alloy with Al-10Ti alloy and commercial purity aluminium. The grain refining efficiency of these grain refiners was assessed to investigate the role of the insoluble TiC and the soluble Al 3 Ti particles. The optimum chemistry for the Al-Ti-C grain refiners was also identified

Grain refining efficiency of Al-Ti-C alloys

Energy Technology Data Exchange (ETDEWEB)

Birol, Yuecel [Materials Institute, Marmara Research Center, TUBITAK, 41470 Gebze, Kocaeli (Turkey)]. E-mail: yucel.birol@mam.gov.tr

2006-09-28

The problems associated with boride agglomeration and the poisoning effect of Zr in Zr-bearing alloys have created a big demand for boron-free grain refiners. The potential benefits of TiC as a direct nucleant for aluminium grains have thus generated a great deal of interest in TiC-bearing alloys in recent years. In Al-Ti-C grain refiners commercially available today, Al{sub 3}Ti particles are introduced into the melt along with the TiC particles. Since the latter are claimed to nucleate {alpha}-Al directly, it is of great technological interest to see if reducing the Ti:C ratio further, i.e., increasing the C content of the grain refiner, will produce an increase in the grain refining efficiency of these alloys. A series of grain refiner samples with the Ti concentration fixed at 3% and a range of C contents between 0 and 0.75 were obtained by appropriately mixing an experimental Al-3Ti-0.75C alloy with Al-10Ti alloy and commercial purity aluminium. The grain refining efficiency of these grain refiners was assessed to investigate the role of the insoluble TiC and the soluble Al{sub 3}Ti particles. The optimum chemistry for the Al-Ti-C grain refiners was also identified.

The use of Fourier reverse transforms in crystallographic phase refinement

Energy Technology Data Exchange (ETDEWEB)

Ringrose, Sharon [Iowa State Univ., Ames, IA (United States)

1997-10-08

Often a crystallographer obtains an electron density map which shows only part of the structure. In such cases, the phasing of the trial model is poor enough that the electron density map may show peaks in some of the atomic positions, but other atomic positions are not visible. There may also be extraneous peaks present which are not due to atomic positions. A method for determination of crystal structures that have resisted solution through normal crystallographic methods has been developed. PHASER is a series of FORTRAN programs which aids in the structure solution of poorly phased electron density maps by refining the crystallographic phases. It facilitates the refinement of such poorly phased electron density maps for difficult structures which might otherwise not be solvable. The trial model, which serves as the starting point for the phase refinement, may be acquired by several routes such as direct methods or Patterson methods. Modifications are made to the reverse transform process based on several assumptions. First, the starting electron density map is modified based on the fact that physically the electron density map must be non-negative at all points. In practice a small positive cutoff is used. A reverse Fourier transform is computed based on the modified electron density map. Secondly, the authors assume that a better electron density map will result by using the observed magnitudes of the structure factors combined with the phases calculated in the reverse transform. After convergence has been reached, more atomic positions and less extraneous peaks are observed in the refined electron density map. The starting model need not be very large to achieve success with PHASER; successful phase refinement has been achieved with a starting model that consists of only 5% of the total scattering power of the full molecule. The second part of the thesis discusses three crystal structure determinations.

Nucleation mechanisms of refined alpha microstructure in beta titanium alloys

Science.gov (United States)

Zheng, Yufeng

Due to a great combination of physical and mechanical properties, beta titanium alloys have become promising candidates in the field of chemical industry, aerospace and biomedical materials. The microstructure of beta titanium alloys is the governing factor that determines their properties and performances, especially the size scale, distribution and volume fraction of precipitate phase in parent phase matrix. Therefore in order to enhance the performance of beta titanium alloys, it is critical to obtain a thorough understanding of microstructural evolution in beta titanium alloys upon various thermal and/or mechanical processes. The present work is focusing on the study of nucleation mechanisms of refined alpha microstructure and super-refined alpha microstructure in beta titanium alloys in order to study the influence of instabilities within parent phase matrix on precipitates nucleation, including compositional instabilities and/or structural instabilities. The current study is primarily conducted in Ti-5Al-5Mo-5V-3Cr (wt%, Ti-5553), a commercial material for aerospace application. Refined and super-refined precipitates microstructure in Ti-5553 are obtained under specific accurate temperature controlled heat treatments. The characteristics of either microstructure are investigated in details using various characterization techniques, such as SEM, TEM, STEM, HRSTEM and 3D atom probe to describe the features of microstructure in the aspect of morphology, distribution, structure and composition. Nucleation mechanisms of refined and super-refined precipitates are proposed in order to fully explain the features of different precipitates microstructure in Ti-5553. The necessary thermodynamic conditions and detailed process of phase transformations are introduced. In order to verify the reliability of proposed nucleation mechanisms, thermodynamic calculation and phase field modeling simulation are accomplished using the database of simple binary Ti-Mo system

Data refinement for true concurrency

Directory of Open Access Journals (Sweden)

Brijesh Dongol

2013-05-01

Full Text Available The majority of modern systems exhibit sophisticated concurrent behaviour, where several system components modify and observe the system state with fine-grained atomicity. Many systems (e.g., multi-core processors, real-time controllers also exhibit truly concurrent behaviour, where multiple events can occur simultaneously. This paper presents data refinement defined in terms of an interval-based framework, which includes high-level operators that capture non-deterministic expression evaluation. By modifying the type of an interval, our theory may be specialised to cover data refinement of both discrete and continuous systems. We present an interval-based encoding of forward simulation, then prove that our forward simulation rule is sound with respect to our data refinement definition. A number of rules for decomposing forward simulation proofs over both sequential and parallel composition are developed.

Grain Refinement of Permanent Mold Cast Copper Base Alloys

Energy Technology Data Exchange (ETDEWEB)

M.Sadayappan; J.P.Thomson; M.Elboujdaini; G.Ping Gu; M. Sahoo

2005-04-01

Grain refinement is a well established process for many cast and wrought alloys. The mechanical properties of various alloys could be enhanced by reducing the grain size. Refinement is also known to improve casting characteristics such as fluidity and hot tearing. Grain refinement of copper-base alloys is not widely used, especially in sand casting process. However, in permanent mold casting of copper alloys it is now common to use grain refinement to counteract the problem of severe hot tearing which also improves the pressure tightness of plumbing components. The mechanism of grain refinement in copper-base alloys is not well understood. The issues to be studied include the effect of minor alloy additions on the microstructure, their interaction with the grain refiner, effect of cooling rate, and loss of grain refinement (fading). In this investigation, efforts were made to explore and understand grain refinement of copper alloys, especially in permanent mold casting conditions.

Comparing Syntactic and Semantics Action Refinement

NARCIS (Netherlands)

Goltz, Ursula; Gorrieri, Roberto; Rensink, Arend

The semantic definition of action refinement on labelled configuration structures is compared with the notion of syntactic substitution, which can be used as another notion of action refinement in a process algebraic setting. The comparison is done by studying a process algebra equipped with

Steel refining possibilities in LF

Science.gov (United States)

Dumitru, M. G.; Ioana, A.; Constantin, N.; Ciobanu, F.; Pollifroni, M.

2018-01-01

This article presents the main possibilities for steel refining in Ladle Furnace (LF). These, are presented: steelmaking stages, steel refining through argon bottom stirring, online control of the bottom stirring, bottom stirring diagram during LF treatment of a heat, porous plug influence over the argon stirring, bottom stirring porous plug, analysis of porous plugs disposal on ladle bottom surface, bottom stirring simulation with ANSYS, bottom stirring simulation with Autodesk CFD.

On Syntactic and Semantic Action Refinement

NARCIS (Netherlands)

Hagiya, M.; Goltz, U.; Mitchell, J.C.; Gorrieri, R.; Rensink, Arend

1994-01-01

The semantic definition of action refinement on labelled event structures is compared with the notion of syntactic substitution, which can be used as another notion of action refinement in a process algebraic setting. This is done by studying a process algebra equipped with the ACP sequential

Refinement for Transition Systems with Responses

Directory of Open Access Journals (Sweden)

Marco Carbone

2012-07-01

Full Text Available Motivated by the response pattern for property specifications and applications within flexible workflow management systems, we report upon an initial study of modal and mixed transition systems in which the must transitions are interpreted as must eventually, and in which implementations can contain may behaviors that are resolved at run-time. We propose Transition Systems with Responses (TSRs as a suitable model for this study. We prove that TSRs correspond to a restricted class of mixed transition systems, which we refer to as the action-deterministic mixed transition systems. We show that TSRs allow for a natural definition of deadlocked and accepting states. We then transfer the standard definition of refinement for mixed transition systems to TSRs and prove that refinement does not preserve deadlock freedom. This leads to the proposal of safe refinements, which are those that preserve deadlock freedom. We exemplify the use of TSRs and (safe refinements on a small medication workflow.

Design of Grain Refiners for Aluminium Alloys

Science.gov (United States)

Tronche, A.; Greer, A. L.

The efficiency of a grain refiner can be quantified as the number of grains per nucleant particle in the solidified product. Even for effective refiners in aluminium, such as Al-5Ti-1B, it is known from experiments that efficiencies are very low, at best 10-3 to 102. It is of interest to explore the reasons for such low values, and to assess the prospects for increased efficiency though design of refiners. Recently it has been shown [1] that a simple recalescence-based model can make quantitative predictions of grain size as a function of refiner addition level, cooling rate and solute content. In the model, the initiation of grains is limited by the free growth from nucleant particles, the size distribution of which is very important. The present work uses this model as the basis for discussing the effect of particle size distribution on grain refiner performance. Larger particles (of TiB2 in the case of present interest) promote greater efficiency, as do narrower size distributions. It is shown that even if the size distribution could be exactly specified, compromises would have to be made to balance efficiency (defined as above) with other desirable characteristics of a refiner.

A refinement methodology for object-oriented programs

OpenAIRE

Tafat , Asma; Boulmé , Sylvain; Marché , Claude

2010-01-01

International audience; Refinement is a well-known approach for developing correct-byconstruction software. It has been very successful for producing high quality code e.g., as implemented in the B tool. Yet, such refinement techniques are restricted in the sense that they forbid aliasing (and more generally sharing of data-structures), which often happens in usual programming languages. We propose a sound approach for refinement in presence of aliases. Suitable abstractions of programs are d...

Bauxite Mining and Alumina Refining

Science.gov (United States)

Frisch, Neale; Olney, David

2014-01-01

Objective: To describe bauxite mining and alumina refining processes and to outline the relevant physical, chemical, biological, ergonomic, and psychosocial health risks. Methods: Review article. Results: The most important risks relate to noise, ergonomics, trauma, and caustic soda splashes of the skin/eyes. Other risks of note relate to fatigue, heat, and solar ultraviolet and for some operations tropical diseases, venomous/dangerous animals, and remote locations. Exposures to bauxite dust, alumina dust, and caustic mist in contemporary best-practice bauxite mining and alumina refining operations have not been demonstrated to be associated with clinically significant decrements in lung function. Exposures to bauxite dust and alumina dust at such operations are also not associated with the incidence of cancer. Conclusions: A range of occupational health risks in bauxite mining and alumina refining require the maintenance of effective control measures. PMID:24806720

South Korea - oil refining overview

International Nuclear Information System (INIS)

Hayes, D.

1999-01-01

Following the economic problems of the 1990s, the petroleum refining industry of South Korea underwent much involuntary restructuring in 1999 with respect to takeovers and mergers and these are discussed. The demand for petroleum has now pretty well recovered. The reasons for fluctuating prices in the 1990s, how the new structure should be cushioned against changes in the future, and the potential for South Korea to export refined petroleum, are all discussed

Price implications for Russia's oil refining

International Nuclear Information System (INIS)

Khartukov, Eugene M.

1998-01-01

Over the past several years, Russia's oil industry has undergone its radical transformation from a wholly state-run and generously subsidized oil distribution system toward a substantially privatized, cash-strapped, and quasi-market ''petropreneurship''. This fully applies to the industry's downstream sector. Still unlike more dynamic E and C operations, the country's refining has turned out better fenced off competitive market forces and is less capable to respond to market imperatives. Consequently, jammed between depressed product prices and persistent feedstock costs, Russian refiners were badly hit by the world oil glut - which has made a radical modernization of the obsolete refining sector clearly a must. (author)

Optimizing refiner operation with statistical modelling

Energy Technology Data Exchange (ETDEWEB)

Broderick, G [Noranda Research Centre, Pointe Claire, PQ (Canada)

1997-02-01

The impact of refining conditions on the energy efficiency of the process and on the handsheet quality of a chemi-mechanical pulp was studied as part of a series of pilot scale refining trials. Statistical models of refiner performance were constructed from these results and non-linear optimization of process conditions were conducted. Optimization results indicated that increasing the ratio of specific energy applied in the first stage led to a reduction of some 15 per cent in the total energy requirement. The strategy can also be used to obtain significant increases in pulp quality for a given energy input. 20 refs., 6 tabs.

Grain refinement mechanism in A3003 alloy

International Nuclear Information System (INIS)

Cho, Hoon; Shin, Je-Sik; Lee, Byoung-Soo; Jo, Hyung-Ho

2009-01-01

In the present study, in order to find out an grain refinement mechanism, 0.1wt.% Al-10wt.%Ti master alloy was added into A3003 alloy melt contained in graphite crucible and in alumina crucible, and then the melt holding time at 750 deg. C was systematically changed from 1 min up to 120 min. It is interesting to note that the grain refinement and fading phenomena remarkably depend on the crucible material. The fading effect in the specimens using alumina crucible can be explained as the result of TiAl 3 phase dissolution into molten aluminium matrix. In the specimens using graphite crucible, the grain refinement was occurred gradually with increasing holding time. It was suggest that the continuous grain refinement is due to transition of refinement mechanism from TiAl 3 phase to TiC phase. It can be mentioned that the TiC formed from titanium and carbon solute in the aluminium melt, which came from the Al-10Ti alloy and the graphite crucible.

Refining discordant gene trees.

Science.gov (United States)

Górecki, Pawel; Eulenstein, Oliver

2014-01-01

Evolutionary studies are complicated by discordance between gene trees and the species tree in which they evolved. Dealing with discordant trees often relies on comparison costs between gene and species trees, including the well-established Robinson-Foulds, gene duplication, and deep coalescence costs. While these costs have provided credible results for binary rooted gene trees, corresponding cost definitions for non-binary unrooted gene trees, which are frequently occurring in practice, are challenged by biological realism. We propose a natural extension of the well-established costs for comparing unrooted and non-binary gene trees with rooted binary species trees using a binary refinement model. For the duplication cost we describe an efficient algorithm that is based on a linear time reduction and also computes an optimal rooted binary refinement of the given gene tree. Finally, we show that similar reductions lead to solutions for computing the deep coalescence and the Robinson-Foulds costs. Our binary refinement of Robinson-Foulds, gene duplication, and deep coalescence costs for unrooted and non-binary gene trees together with the linear time reductions provided here for computing these costs significantly extends the range of trees that can be incorporated into approaches dealing with discordance.

Basic effects of pulp refining on fiber properties--a review.

Science.gov (United States)

Gharehkhani, Samira; Sadeghinezhad, Emad; Kazi, Salim Newaz; Yarmand, Hooman; Badarudin, Ahmad; Safaei, Mohammad Reza; Zubir, Mohd Nashrul Mohd

2015-01-22

The requirement for high quality pulps which are widely used in paper industries has increased the demand for pulp refining (beating) process. Pulp refining is a promising approach to improve the pulp quality by changing the fiber characteristics. The diversity of research on the effect of refining on fiber properties which is due to the different pulp sources, pulp consistency and refining equipment has interested us to provide a review on the studies over the last decade. In this article, the influence of pulp refining on structural properties i.e., fibrillations, fine formation, fiber length, fiber curl, crystallinity and distribution of surface chemical compositions is reviewed. The effect of pulp refining on electrokinetic properties of fiber e.g., surface and total charges of pulps is discussed. In addition, an overview of different refining theories, refiners as well as some tests for assessing the pulp refining is presented. Copyright © 2014 Elsevier Ltd. All rights reserved.

Coupling parallel adaptive mesh refinement with a nonoverlapping domain decomposition solver

Czech Academy of Sciences Publication Activity Database

Kůs, Pavel; Šístek, Jakub

2017-01-01

Roč. 110, August (2017), s. 34-54 ISSN 0965-9978 R&D Projects: GA ČR GA14-02067S Institutional support: RVO:67985840 Keywords : adaptive mesh refinement * parallel algorithms * domain decomposition Subject RIV: BA - General Mathematics OBOR OECD: Applied mathematics Impact factor: 3.000, year: 2016 http://www.sciencedirect.com/science/article/pii/S0965997816305737

Coupling parallel adaptive mesh refinement with a nonoverlapping domain decomposition solver

Czech Academy of Sciences Publication Activity Database

Kůs, Pavel; Šístek, Jakub

2017-01-01

Roč. 110, August (2017), s. 34-54 ISSN 0965-9978 R&D Projects: GA ČR GA14-02067S Institutional support: RVO:67985840 Keywords : adaptive mesh refinement * parallel algorithms * domain decomposition Subject RIV: BA - General Mathematics OBOR OECD: Applied mathematics Impact factor: 3.000, year: 2016 http://www.sciencedirect.com/science/ article /pii/S0965997816305737

Oil refining expansion criteria for Brazil

International Nuclear Information System (INIS)

Tavares, M.E.E.; Szklo, A.S.; Machado, G.V.; Schaeffer, R.; Mariano, J.B.; Sala, J.F.

2006-01-01

This paper assesses different strategies for the expansion of Brazil's oil refining segment, using criteria that range from energy security (reducing imports and vulnerability for key products) through to maximizing the profitability of this sector (boosting the output of higher value oil products) and adding value to Brazil's oil production (reducing exports of heavy acid oil). The development prospects are analyzed for conventional fuel production technology routes, sketching out three possible refining schemes for Brazilian oil and a GTL plant for producing gasoil from natural gas. Market scenario simulations indicate that investments will be required in Brazil's oil refining segment over and above those allocated to planned modifications in its current facilities, reducing the nation's vulnerability in terms of gasoil and petrochemical naphtha imports. Although not economically attractive, oil refining is a key activity that is crucial to oil company strategies. The decision to invest in this segment depends on local infrastructure conditions, environmental constraints and fuel specifications, in addition to oil company strategies, steady growth in demand and the definition of a government policy that eases institutional risks. (author)

Oil refining expansion criteria for Brazil

International Nuclear Information System (INIS)

Tavares, Marina Elisabete Espinho; Szklo, Alexandre Salem; Machado, Giovani Vitoria; Schaeffer, Roberto; Mariano, Jacqueline Barboza; Sala, Janaina Francisco

2006-01-01

This paper assesses different strategies for the expansion of Brazil's oil refining segment, using criteria that range from energy security (reducing imports and vulnerability for key products) through to maximizing the profitability of this sector (boosting the output of higher value oil products) and adding value to Brazil's oil production (reducing exports of heavy acid oil). The development prospects are analyzed for conventional fuel production technology routes, sketching out three possible refining schemes for Brazilian oil and a GTL plant for producing gasoil from natural gas. Market scenario simulations indicate that investments will be required in Brazil's oil refining segment over and above those allocated to planned modifications in its current facilities, reducing the nation's vulnerability in terms of gasoil and petrochemical naphtha imports. Although not economically attractive, oil refining is a key activity that is crucial to oil company strategies. The decision to invest in this segment depends on local infrastructure conditions, environmental constraints and fuel specifications, in addition to oil company strategies, steady growth in demand and the definition of a government policy that eases institutional risks

Accurate macromolecular crystallographic refinement: incorporation of the linear scaling, semiempirical quantum-mechanics program DivCon into the PHENIX refinement package

Energy Technology Data Exchange (ETDEWEB)

Borbulevych, Oleg Y.; Plumley, Joshua A.; Martin, Roger I. [QuantumBio Inc., 2790 West College Avenue, State College, PA 16801 (United States); Merz, Kenneth M. Jr [University of Florida, Gainesville, Florida (United States); Westerhoff, Lance M., E-mail: lance@quantumbioinc.com [QuantumBio Inc., 2790 West College Avenue, State College, PA 16801 (United States)

2014-05-01

Semiempirical quantum-chemical X-ray macromolecular refinement using the program DivCon integrated with PHENIX is described. Macromolecular crystallographic refinement relies on sometimes dubious stereochemical restraints and rudimentary energy functionals to ensure the correct geometry of the model of the macromolecule and any covalently bound ligand(s). The ligand stereochemical restraint file (CIF) requires a priori understanding of the ligand geometry within the active site, and creation of the CIF is often an error-prone process owing to the great variety of potential ligand chemistry and structure. Stereochemical restraints have been replaced with more robust functionals through the integration of the linear-scaling, semiempirical quantum-mechanics (SE-QM) program DivCon with the PHENIX X-ray refinement engine. The PHENIX/DivCon package has been thoroughly validated on a population of 50 protein–ligand Protein Data Bank (PDB) structures with a range of resolutions and chemistry. The PDB structures used for the validation were originally refined utilizing various refinement packages and were published within the past five years. PHENIX/DivCon does not utilize CIF(s), link restraints and other parameters for refinement and hence it does not make as many a priori assumptions about the model. Across the entire population, the method results in reasonable ligand geometries and low ligand strains, even when the original refinement exhibited difficulties, indicating that PHENIX/DivCon is applicable to both single-structure and high-throughput crystallography.

Refined large N duality for knots

DEFF Research Database (Denmark)

Kameyama, Masaya; Nawata, Satoshi

We formulate large N duality of U(N) refined Chern-Simons theory with a torus knot/link in S³. By studying refined BPS states in M-theory, we provide the explicit form of low-energy effective actions of Type IIA string theory with D4-branes on the Ω-background. This form enables us to relate...

Region-of-interest volumetric visual hull refinement

KAUST Repository

Knoblauch, Daniel; Kuester, Falko

2010-01-01

This paper introduces a region-of-interest visual hull refinement technique, based on flexible voxel grids for volumetric visual hull reconstructions. Region-of-interest refinement is based on a multipass process, beginning with a focussed visual

Mercury in Orange Birch Bolete Leccinum versipelle and soil substratum: bioconcentration by mushroom and probable dietary intake by consumers.

Science.gov (United States)

Krasińska, Grażyna; Falandysz, Jerzy

2016-01-01

The aim of this study was to examine the contamination, accumulation, and distribution of mercury in fruiting bodies by Leccinum versipelle fungus collected from distant sites across Poland. Mercury was determined using validated method by cold-vapor atomic absorption spectroscopy after direct sample matrix combustion. A large set of data gained using 371 fruiting bodies and 204 soil samples revealed the susceptibility of L. versipelle to Hg contamination and permitted the estimation of probable intake of Hg contaminant by consumers foraging for this species. The range of median values of Hg determined in caps of L. versipelle was from 0.20 to 2.0 mg kg(-1) dry biomass, and the median for 19 localities was 0.65 mg kg(-1) dry biomass. The values of the Hg bioconcentration factor (BCF) determined for L. versipelle correlated negatively with Hg contents. Mercury in topsoil beneath L. versipelle ranged from 0.019 to 0.041 mg kg(-1) dry matter for less-contaminated locations (BCF of 17 to 65 for caps) and from 0.076 to 0.39 mg kg(-1) dry matter for more contaminated locations (BCF of 1.9 to 22). Fruiting bodies of L. versipelle collected in some regions of Poland if consumed in amount of 300 g in one meal in a week could provide Hg doses above the provisionally tolerable weekly intake (PTWI) value of 0.004 mg Hg kg(-1) body mass, while regular consumptions for most of the locations were below the limit even with more frequent consumption. Also summarized are available data on Hg for three species of fungi of genus Leccinum foraged in Europe.

Implementation of refined core thermal-hydraulic calculation feature in the MARS/MASTER code

International Nuclear Information System (INIS)

Joo, H. K.; Jung, J. J.; Cho, B. O.; Ji, S. K.; Lee, W. J.; Jang, M. H.

2000-01-01

As an effort to enhance the fidelity of the core thermal/hydraulic calculation in the MARS/MASTER code, a best-estimate system/core coupled code, the COBRA-III module of MASTER is activated that enables refined core T/H calculations. Since the COBRA-III module is capable of using fuel-assembly sized nodes, the resolution of the T/H solution is high so that accurate incorporation of local T/H feedback effects becomes possible. The COBRA-III module is utilized such that the refined core T/H calculation is performed using the coarse-mesh flow boundary conditions specified by MARS at both ends of the core. The results of application to the OECD MSLB benchmark analysis indicate that the local peaking factor can be reduced by upto 15% with the refined calculation through the accurate representation of the local Doppler effect evaluation, although the prediction of the global transient behaviors such as the total core power change remain essentially unaffected

Energy conservation potential in China’s petroleum refining industry: Evidence and policy implications

International Nuclear Information System (INIS)

Lin, Boqiang; Xie, Xuan

2015-01-01

Highlights: • A long-term equilibrium relationship of energy demand in China’s petroleum refining industry is established. • The sectoral energy conservation potential is evaluated by using scenarios analysis. • Energy prices, enterprise scale, R and D investment and ownership structure affect electricity intensity. • Future policy for energy conservation in China’s petroleum refining industry is suggested. - Abstract: China is currently the second largest petroleum refining country in the world due to rapid growth in recent years. Because the petroleum refining industry is energy-intensive, the rapid growth in petroleum refining and development caused massive energy consumption. China’s urbanization process will guarantee sustained growth of the industry for a long time. Therefore, it is necessary to study the energy conservation potential of the petroleum industry. This paper estimates the energy conservation potential of the industry by applying a cointegration model to investigate the long-run equilibrium relationship between energy consumption and some factors such as energy price, enterprise scale, R and D investment and ownership structure. The results show that R and D investment has the greatest reduction impact on energy intensity, and the growth of market participants (i.e. the decline of the share of state-owned companies) can improve energy efficiency of this industry. Under the advanced energy-saving scenario, the accumulated energy conservation potential will reach 230.18 million tons of coal equivalent (tce). Finally, we provide some targeted policy recommendations for industrial energy conservation

US refining reviewed

International Nuclear Information System (INIS)

Yamaguchi, N.D.

1998-01-01

The paper reviews the history, present position and future prospects of the petroleum industry in the USA. The main focus is on supply and demand, the high quality of the products, refinery capacity and product trade balances. Diagrams show historical trends in output, product demand, demand for transport fuels and oil, refinery capacity, refinery closures, and imports and exports. Some particularly salient points brought out were (i) production of US crude shows a marked downward trend but imports of crude will continue to increase, (ii) product demand will continue to grow even though the levels are already high, (iii) the demand is dominated by those products that typically yield the highest income for the refiner, (i.e. high quality transport fuels for environmental compliance), (iv) refinery capacity has decreased since 1980 and (v) refining will continue to have financial problems but will still be profitable. (UK)

Neutrosophic Refined Similarity Measure Based on Cosine Function

Directory of Open Access Journals (Sweden)

Said Broumi

2014-12-01

Full Text Available In this paper, the cosine similarity measure of neutrosophic refined (multi- sets is proposed and its properties are studied. The concept of this cosine similarity measure of neutrosophic refined sets is the extension of improved cosine similarity measure of single valued neutrosophic. Finally, using this cosine similarity measure of neutrosophic refined set, the application of medical diagnosis is presented.

Future of French refining

International Nuclear Information System (INIS)

Calvet, B.

1993-01-01

Over recent years, the refining industry has had to grapple with a growing burden of environmental and safety regulations concerning not only its plants and other facilities, but also its end products. At the same time, it has had to bear the effects of the reduction of the special status that used to apply to petroleum, and the consequences of economic freedom, to which we should add, as specifically concerns the French market, the impact of energy policy and the pro-nuclear option. The result is a drop in heavy fuel oil from 36 million tonnes per year in 1973 to 6.3 million in 1992, and in home-heating fuel from 37 to 18 million per year. This fast-moving market is highly competitive. The French market in particular is wide open to imports, but the refining companies are still heavy exporters for those products with high added-value, like lubricants, jet fuel, and lead-free gasolines. The competition has led the refining companies to commit themselves to quality, and to publicize their efforts in this direction. This is why the long-term perspectives for petroleum fuels are still wide open. This is supported by the probable expectation that the goal of economic efficiency is likely to soften the effects of the energy policy, which penalizes petroleum products, in that they have now become competitive again. In the European context, with the challenge of environmental protection and the decline in heavy fuel outlets, French refining has to keep on improving the quality of its products and plants, which means major investments. The industry absolutely must return to a more normal level of profitability, in order to sustain this financial effort, and generate the prosperity of its high-performance plants and equipment. 1 fig., 5 tabs

The evolution of oil refining in Europe

Energy Technology Data Exchange (ETDEWEB)

Reid, A. [CONCAWE, Brussels (Belgium)

2013-04-01

Back in 1963 when CONCAWE was founded, the world looked very different from what it is today, and so did the global and European refining industry. Oil product markets were expanding fast and new refineries were being built at a steady rate. The oil crisis of the 1970s brought an abrupt end to this, heralding a long era of consolidation and stepwise adaptation. At the same time the nature of the global oil business shifted from fully integrated companies producing, transporting and refining their own oil to a much more diversified situation where oil production ('upstream') and refining/distribution ('downstream') gradually became two essentially separate businesses. From being purely a 'cost centre' in an integrated chain, refining has become a separate activity in its own right, operating as a 'profit centre' between two global markets - crude oil and products - which, although not entirely independent, have their own dynamics and influences. In addition demand gradually shifted towards lighter products while the quality requirements on all products were considerably tightened. This article explores the new challenges that these changes have imposed on EU refiners, and describes CONCAWE's contributions to understanding their impact on refinery production and investments.

Refining of raw materials, lignite present economic problems

Energy Technology Data Exchange (ETDEWEB)

Schirmer, G.

1985-06-01

East Germany seeks an economic intensification program that involves refining raw materials to a higher level. Lignite briquetting prior to liquefaction and gasification illustrates both the theoretical and practical aspects of that goal and also introduces questions of secure supplies. The author describes the special labor processes, use of technology, recycling of waste materials, and other new problems that the approach entails as the refined raw materials become new materials or energy sources. Economics based on the value of the refined product and the cost of the materials determine the degree of refinement. The concept also involves the relationship of producer and user as profits increase.

Refining's-clean new jingle

International Nuclear Information System (INIS)

Anon.

1992-01-01

This paper reports that at a time when profit margins are slim and gasoline demand is down, the U.S. petroleum-refining industry is facing one of its greatest challenges; How to meet new federal and state laws for reformulated gasoline, oxygenated fuels, low-sulfur diesel and other measures to improve the environment. The American Petroleum Institute (API) estimates that industry will spend between $15 and $23 billion by the end of the decade to meet the U.S. Clean Air Act Amendments (CAAA) of 1990, and other legislation. ENSR Consulting and Engineering's capital-spending figure runs to between $70 and 100 billion this decade, including $24 billion to produce reformulated fuels and $10-12 billion to reduce refinery emissions. M.W. Kellogg Co. estimates that refiners may have to spend up to $30 billion this decade to meet the demand for reformulated gasoline. The estimates are wide-ranging because refiners are still studying their options and delaying final decisions as long as they can, to try to ensure they are the best and least-costly decisions. Oxygenated fuels will be required next winter, but federal regulations for reformulated gasoline won't go into effect until 1995, while California's tougher reformulated-fuels law will kick in the following year

A modified parallel artificial membrane permeability assay for evaluating the bioconcentration of highly hydrophobic chemicals in fish.

Science.gov (United States)

Kwon, Jung-Hwan; Escher, Beate I

2008-03-01

Low cost in vitro tools are needed at the screening stage of assessment of bioaccumulation potential of new and existing chemicals because the number of chemical substances that needs to be tested highly exceeds the capacity of in vivo bioconcentration tests. Thus, the parallel artificial membrane permeability assay (PAMPA) system was modified to predict passive uptake/ elimination rate in fish. To overcome the difficulties associated with low aqueous solubility and high membrane affinity of highly hydrophobic chemicals, we measured the rate of permeation from the donor poly(dimethylsiloxane)(PDMS) disk to the acceptor PDMS disk through aqueous and PDMS membrane boundary layers and term the modified PAMPA system "PDMS-PAMPA". Twenty chemicals were selected for validation of PDMS-PAMPA. The measured permeability is proportional to the passive elimination rate constant in fish and was used to predict the "minimum" in vivo elimination rate constant. The in vivo data were very close to predicted values except for a few polar chemicals and metabolically active chemicals, such as pyrene and benzo[a]pyrene. Thus, PDMS-PAMPA can be an appropriate in vitro system for nonmetabolizable chemicals. Combination with metabolic clearance rates using a battery of metabolic degradation assays would enhance the applicability for metabolizable chemicals.

Refinement of the concept of uncertainty.

Science.gov (United States)

Penrod, J

2001-04-01

To analyse the conceptual maturity of uncertainty; to develop an expanded theoretical definition of uncertainty; to advance the concept using methods of concept refinement; and to analyse congruency with the conceptualization of uncertainty presented in the theory of hope, enduring, and suffering. Uncertainty is of concern in nursing as people experience complex life events surrounding health. In an earlier nursing study that linked the concepts of hope, enduring, and suffering into a single theoretical scheme, a state best described as 'uncertainty' arose. This study was undertaken to explore how this conceptualization fit with the scientific literature on uncertainty and to refine the concept. Initially, a concept analysis using advanced methods described by Morse, Hupcey, Mitcham and colleagues was completed. The concept was determined to be partially mature. A theoretical definition was derived and techniques of concept refinement using the literature as data were applied. The refined concept was found to be congruent with the concept of uncertainty that had emerged in the model of hope, enduring and suffering. Further investigation is needed to explore the extent of probabilistic reasoning and the effects of confidence and control on feelings of uncertainty and certainty.

Refinement Checking on Parametric Modal Transition Systems

DEFF Research Database (Denmark)

Benes, Nikola; Kretínsky, Jan; Larsen, Kim Guldstrand

2015-01-01

Modal transition systems (MTS) is a well-studied specification formalism of reactive systems supporting a step-wise refinement methodology. Despite its many advantages, the formalism as well as its currently known extensions are incapable of expressing some practically needed aspects in the refin...

Japan's refiner/marketers headed for major shakeout

International Nuclear Information System (INIS)

Anon.

1996-01-01

Japan's downstream oil industry is in a state of crisis and headed for a major shakeout. The major catalyst for this was a dramatic deregulation step during April 1996 that allowed refined petroleum product imports by non-refiners. The move, together with a sharp drop in refining margins, falling retail gasoline prices, and a service station sector on the brink of collapse, are all leading to massive changes in the way the country's refiners and marketers do business. This paper reviews the collapse of corporate profits during this period of deregulation; the development of a new price system geared toward bringing the prices of gasoline, fuel oil, and kerosene into line with each other to offset the fall in gasoline prices; and industry restructuring including mergers, acquisitions, and marketing consolidation. The paper then makes predictions on the outcome of these changes on the Japanese oil industry

Pilot scale refinning of crude soybean oil | Mensah | Journal of ...

African Journals Online (AJOL)

Pilot scale refinning of crude soybean oil. ... Abstract. A laboratory process for refining soybean has been scaled up to a 145 tonne per annum pilot plant to refine crude soybean oil. ... The quality of the refined oil was found to be within national and codex standard specifications for edible oil from vegetable sources.

Optimization of palm oil physical refining process for reduction of 3-monochloropropane-1,2-diol (3-MCPD) ester formation.

Science.gov (United States)

Zulkurnain, Musfirah; Lai, Oi Ming; Tan, Soo Choon; Abdul Latip, Razam; Tan, Chin Ping

2013-04-03

The reduction of 3-monochloropropane-1,2-diol (3-MCPD) ester formation in refined palm oil was achieved by incorporation of additional processing steps in the physical refining process to remove chloroester precursors prior to the deodorization step. The modified refining process was optimized for the least 3-MCPD ester formation and acceptable refined palm oil quality using response surface methodology (RSM) with five processing parameters: water dosage, phosphoric acid dosage, degumming temperature, activated clay dosage, and deodorization temperature. The removal of chloroester precursors was largely accomplished by increasing the water dosage, while the reduction of 3-MCPD esters was a compromise in oxidative stability and color of the refined palm oil because some factors such as acid dosage, degumming temperature, and deodorization temperature showed contradictory effects. The optimization resulted in 87.2% reduction of 3-MCPD esters from 2.9 mg/kg in the conventional refining process to 0.4 mg/kg, with color and oil stability index values of 2.4 R and 14.3 h, respectively.

Technological studies on uranium refining at nuclear materials authority, Egypt

International Nuclear Information System (INIS)

Mohammed, H.S.

1997-01-01

In 1992 nuclear materials authority (NMA) took a decision to establish yellow cake refining. Unit so as to study refining of El-Atshan yellow cake which recently produced by ion-exchange pilot plant, production sector. The research studies followed the conventional refining rout to produce nuclear grade UO 3 . This implies investigations on some common solvents to refine the cake viz. tri alkyl phosphates, tri alkyl phosphine oxides, dialkyl phosphoric acid as well as high-molecular weight long-chain tertiary amines. Moreover, non-conventional refining process has also been presented depending on the selectivity of uranyl ion to be dissolved by carbonate and to be precipitated by hydrogen peroxide. Most of the proposed processes were found feasible to refine El-Atshan yellow cake. however, the non- conventional refining process appears to be the most promising, owing to its superior performance and economy

Effects of grain refinement on the biocorrosion and in vitro bioactivity of magnesium

Energy Technology Data Exchange (ETDEWEB)

Saha, Partha; Roy, Mangal [Department of Bioengineering, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); Datta, Moni Kanchan [Department of Bioengineering, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); Center for Complex Engineered Multifunctional Materials, University of Pittsburgh, Pittsburgh, PA 15261 (United States); Lee, Boeun [Department of Bioengineering, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); Kumta, Prashant N., E-mail: pkumta@pitt.edu [Department of Bioengineering, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); Center for Complex Engineered Multifunctional Materials, University of Pittsburgh, Pittsburgh, PA 15261 (United States); Mechanical Engineering and Materials Science, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); Chemical and Petroleum Engineering, Swanson School of Engineering, University of Pittsburgh, PA 15261 (United States); School of Dental Medicine, University of Pittsburgh, PA 15261 (United States); McGowan Institute of Regenerative Medicine, University of Pittsburgh, PA 15261 (United States)

2015-12-01

Magnesium is a new class of biodegradable metals potentially suitable for bone fracture fixation due to its suitable mechanical properties, high degradability and biocompatibility. However, rapid corrosion and loss in mechanical strength under physiological conditions render it unsuitable for load-bearing applications. In the present study, grain refinement was implemented to control bio-corrosion demonstrating improved in vitro bioactivity of magnesium. Pure commercial magnesium was grain refined using different amounts of zirconium (0.25 and 1.0 wt.%). Corrosion behavior was studied by potentiodynamic polarization (PDP) and mass loss immersion tests demonstrating corrosion rate decrease with grain size reduction. In vitro biocompatibility tests conducted by MC3T3-E1 pre-osteoblast cells and measured by DNA quantification demonstrate significant increase in cell proliferation for Mg–1 wt.% Zr at day 5. Similarly, alkaline phosphatase (ALP) activity was higher for grain refined Mg. Alloys were also tested for ability to support osteoclast differentiation using RAW264.7 monocytes with receptor activator of nuclear factor kappa-β ligand (RANKL) supplemented cell culture. Osteoclast differentiation process was observed to be severely restricted for smaller grained Mg. Overall, the results indicate grain refinement to be useful not only for improving corrosion resistance of Mg implants for bone fixation devices but also potentially modulate bone regeneration around the implant. - Highlights: • The biocorrosion and biocompatibility of pure Mg and Mg grain refined with different Zr levels were investigated. • Corrosion resistance in HBSS and compressive strength of pure Mg was significantly improved with Zr addition. • Electrochemical and immersion corrosion tests showed a fourfold decrease in corrosion rate of pure Mg with 1% Zr addition. • Grain refinement of pure Mg demonstrated enhanced osteoblast cell activity and proliferation.

Effects of grain refinement on the biocorrosion and in vitro bioactivity of magnesium

International Nuclear Information System (INIS)

Saha, Partha; Roy, Mangal; Datta, Moni Kanchan; Lee, Boeun; Kumta, Prashant N.

2015-01-01

Magnesium is a new class of biodegradable metals potentially suitable for bone fracture fixation due to its suitable mechanical properties, high degradability and biocompatibility. However, rapid corrosion and loss in mechanical strength under physiological conditions render it unsuitable for load-bearing applications. In the present study, grain refinement was implemented to control bio-corrosion demonstrating improved in vitro bioactivity of magnesium. Pure commercial magnesium was grain refined using different amounts of zirconium (0.25 and 1.0 wt.%). Corrosion behavior was studied by potentiodynamic polarization (PDP) and mass loss immersion tests demonstrating corrosion rate decrease with grain size reduction. In vitro biocompatibility tests conducted by MC3T3-E1 pre-osteoblast cells and measured by DNA quantification demonstrate significant increase in cell proliferation for Mg–1 wt.% Zr at day 5. Similarly, alkaline phosphatase (ALP) activity was higher for grain refined Mg. Alloys were also tested for ability to support osteoclast differentiation using RAW264.7 monocytes with receptor activator of nuclear factor kappa-β ligand (RANKL) supplemented cell culture. Osteoclast differentiation process was observed to be severely restricted for smaller grained Mg. Overall, the results indicate grain refinement to be useful not only for improving corrosion resistance of Mg implants for bone fixation devices but also potentially modulate bone regeneration around the implant. - Highlights: • The biocorrosion and biocompatibility of pure Mg and Mg grain refined with different Zr levels were investigated. • Corrosion resistance in HBSS and compressive strength of pure Mg was significantly improved with Zr addition. • Electrochemical and immersion corrosion tests showed a fourfold decrease in corrosion rate of pure Mg with 1% Zr addition. • Grain refinement of pure Mg demonstrated enhanced osteoblast cell activity and proliferation

Cavitation-aided grain refinement in aluminium alloys

NARCIS (Netherlands)

Atamanenko, T.V.

2010-01-01

This thesis deals with grain refinement under the influence of ultrasonic-driven cavitation in aluminium casting processes. Three major goals of this research were: (1) to identify the mechanism of the cavitation-aided grain refinement at different stages of solidification; (2) to reveal the

Accurate macromolecular crystallographic refinement: incorporation of the linear scaling, semiempirical quantum-mechanics program DivCon into the PHENIX refinement package.

Science.gov (United States)

Borbulevych, Oleg Y; Plumley, Joshua A; Martin, Roger I; Merz, Kenneth M; Westerhoff, Lance M

2014-05-01

Macromolecular crystallographic refinement relies on sometimes dubious stereochemical restraints and rudimentary energy functionals to ensure the correct geometry of the model of the macromolecule and any covalently bound ligand(s). The ligand stereochemical restraint file (CIF) requires a priori understanding of the ligand geometry within the active site, and creation of the CIF is often an error-prone process owing to the great variety of potential ligand chemistry and structure. Stereochemical restraints have been replaced with more robust functionals through the integration of the linear-scaling, semiempirical quantum-mechanics (SE-QM) program DivCon with the PHENIX X-ray refinement engine. The PHENIX/DivCon package has been thoroughly validated on a population of 50 protein-ligand Protein Data Bank (PDB) structures with a range of resolutions and chemistry. The PDB structures used for the validation were originally refined utilizing various refinement packages and were published within the past five years. PHENIX/DivCon does not utilize CIF(s), link restraints and other parameters for refinement and hence it does not make as many a priori assumptions about the model. Across the entire population, the method results in reasonable ligand geometries and low ligand strains, even when the original refinement exhibited difficulties, indicating that PHENIX/DivCon is applicable to both single-structure and high-throughput crystallography.

Preparation of Al-Ti-B grain refiner by SHS technology[Self-propagating High-temperature Synthesis

Energy Technology Data Exchange (ETDEWEB)

Nikitin, V.I.; Wanqi, J.I.E.; Kandalova, E.G.; Makarenko, A.G.; Yong, L.

2000-02-01

Since the discovery of the grain refinement effect of aluminum by titanium, especially with the existence of B or C in 1950, grain refiners are widely accepted in industry for microstructure control of aluminum alloys. Research on this topic is to obtain the highest grain refinement efficiency with the lowest possible addition of master alloy. It is widely accepted that the morphology and size of TiAl{sub 3} particles, which are known as heterogeneous nucleation centers, are important factors deterring the grain refinement efficiency. Fine TiAl{sub 3} particles are favorable. The grain refinement process shows a heredity phenomenon, which means that structural information from initial materials transfers through a melt to the final product. It is important to find the connection between microstructural parameters of the master alloy and the final product. To improve the quality of Al-Ti-B master alloys for the use as a grain refiner, a new method based on SHS (self-propagating high-temperature synthesis) technology has been developed in Samara State Technical University to produce the master alloys. SHS, as a new method for preparation of materials, was first utilized by Merzhanov in 1967. This method uses the energy from highly exothermic reactions to sustain the chemical reaction in a combustion wave. The advantages of SHS include simplicity, low energy requirement, and higher product purity. Because SHS reactions can take place between elemental reactants, it is easy to control product composition. The purposes of this investigation were to fabricate an SHS Al-5%Ti-1%B master alloy, to analyze its structure and to test its grain refining performance.

Structural improvement of unliganded simian immunodeficiency virus gp120 core by normal-mode-based X-ray crystallographic refinement

International Nuclear Information System (INIS)

Chen, Xiaorui; Lu, Mingyang; Poon, Billy K.; Wang, Qinghua; Ma, Jianpeng

2009-01-01

The structural model of the unliganded and fully glycosylated simian immunodeficiency virus gp120 core determined to 4.0 Å resolution was substantially improved using a recently developed normal-mode-based anisotropic B-factor refinement method. The envelope protein gp120/gp41 of simian and human immunodeficiency viruses plays a critical role in viral entry into host cells. However, the extraordinarily high structural flexibility and heavy glycosylation of the protein have presented enormous difficulties in the pursuit of high-resolution structural investigation of some of its conformational states. An unliganded and fully glycosylated gp120 core structure was recently determined to 4.0 Å resolution. The rather low data-to-parameter ratio limited refinement efforts in the original structure determination. In this work, refinement of this gp120 core structure was carried out using a normal-mode-based refinement method that has been shown in previous studies to be effective in improving models of a supramolecular complex at 3.42 Å resolution and of a membrane protein at 3.2 Å resolution. By using only the first four nonzero lowest-frequency normal modes to construct the anisotropic thermal parameters, combined with manual adjustments and standard positional refinement using REFMAC5, the structural model of the gp120 core was significantly improved in many aspects, including substantial decreases in R factors, better fitting of several flexible regions in electron-density maps, the addition of five new sugar rings at four glycan chains and an excellent correlation of the B-factor distribution with known structural flexibility. These results further underscore the effectiveness of this normal-mode-based method in improving models of protein and nonprotein components in low-resolution X-ray structures

Optimization bitumen-based upgrading and refining schemes

Energy Technology Data Exchange (ETDEWEB)

Munteanu, M.; Chen, J. [National Centre for Upgrading Technology, Devon, AB (Canada); Natural Resources Canada, Devon, AB (Canada). CanmetENERGY

2009-07-01

This poster highlighted the results of a study in which the entire refining scheme for Canadian bitumen as feedstocks was modelled and simulated under different process configurations, operating conditions and product structures. The aim of the study was to optimize the economic benefits, product quality and energy use under a range of operational scenarios. Optimal refining schemes were proposed along with process conditions for existing refinery configurations and objectives. The goal was to provide guidelines and information for upgrading and refining process design and retrofitting. Critical steps were identified with regards to the upgrading process. It was concluded that the information obtained from this study would lead to significant improvement in process performance and operations, and in reducing the capital cost for building new upgraders and refineries. The simulation results provided valuable information for increasing the marketability of bitumen, reducing greenhouse gas emissions and other environmental impacts associated with bitumen upgrading and refining. tabs., figs.

1991 worldwide refining and gas processing directory

International Nuclear Information System (INIS)

Anon.

1990-01-01

This book ia an authority for immediate information on the industry. You can use it to find new business, analyze market trends, and to stay in touch with existing contacts while making new ones. The possibilities for business applications are numerous. Arranged by country, all listings in the directory include address, phone, fax and telex numbers, a description of the company's activities, names of key personnel and their titles, corporate headquarters, branch offices and plant sites. This newly revised edition lists more than 2000 companies and nearly 3000 branch offices and plant locations. This east-to-use reference also includes several of the most vital and informative surveys of the industry, including the U.S. Refining Survey, the Worldwide Construction Survey in Refining, Sulfur, Gas Processing and Related Fuels, the Worldwide Refining and Gas Processing Survey, the Worldwide Catalyst Report, and the U.S. and Canadian Lube and Wax Capacities Report from the National Petroleum Refiner's Association

A Macdonald refined topological vertex

Science.gov (United States)

Foda, Omar; Wu, Jian-Feng

2017-07-01

We consider the refined topological vertex of Iqbal et al (2009 J. High Energy Phys. JHEP10(2009)069), as a function of two parameters ≤ft\\lgroup x, y \\right\\rgroup , and deform it by introducing the Macdonald parameters ≤ft\\lgroup q, t \\right\\rgroup , as in the work of Vuletić on plane partitions (Vuletić M 2009 Trans. Am. Math. Soc. 361 2789-804), to obtain ‘a Macdonald refined topological vertex’. In the limit q → t , we recover the refined topological vertex of Iqbal et al and in the limit x → y , we obtain a qt-deformation of the original topological vertex of Aganagic et al (2005 Commun. Math. Phys. 25 425-78). Copies of the vertex can be glued to obtain qt-deformed 5D instanton partition functions that have well-defined 4D limits and, for generic values of ≤ft\\lgroup q, t\\right\\rgroup , contain infinite-towers of poles for every pole present in the limit q → t .

Modified process for refining niobium by electron beam

International Nuclear Information System (INIS)

Pinatti, D.G.; Takano, C.

1982-01-01

The experimental results, thermodynamic equilibrium and kinetic theory of the metal/gas interaction in refractory metals are reviewed. The adsorption and desorption of nitrogen, hydrogen and CO are reversible, whereas those of oxygen are irreversible, with adsorption of an oxygen atom and volatilisation of the metal oxide. Based upon this fact, a new electron beam refining technology is proposed for niobium, consisting of four points: preparation of an electrode by aluminothermic reduction; zone refining in the first melt; kinetic refining in subsequent melts and compact design of the refining plant. Experimental results from a 300 kW pilot plant were in complete agreement with the technology proposed, giving 2.4 times the productivity predicted by the conventional technology. (Author) [pt

Lossless, Near-Lossless, and Refinement Coding of Bi-level Images

DEFF Research Database (Denmark)

Martins, Bo; Forchhammer, Søren Otto

1997-01-01

We present general and unified algorithms for lossy/lossless codingof bi-level images. The compression is realized by applying arithmetic coding to conditional probabilities. As in the current JBIG standard the conditioning may be specified by a template.For better compression, the more general....... Introducing only a small amount of loss in halftoned test images, compression is increased by up to a factor of four compared with JBIG. Lossy, lossless, and refinement decoding speed and lossless encoding speed are less than a factor of two slower than JBIG. The (de)coding method is proposed as part of JBIG......-2, an emerging international standard for lossless/lossy compression of bi-level images....

Achieving Extreme Resolution in Numerical Cosmology Using Adaptive Mesh Refinement: Resolving Primordial Star Formation

Directory of Open Access Journals (Sweden)

Greg L. Bryan

2002-01-01

Full Text Available As an entry for the 2001 Gordon Bell Award in the "special" category, we describe our 3-d, hybrid, adaptive mesh refinement (AMR code Enzo designed for high-resolution, multiphysics, cosmological structure formation simulations. Our parallel implementation places no limit on the depth or complexity of the adaptive grid hierarchy, allowing us to achieve unprecedented spatial and temporal dynamic range. We report on a simulation of primordial star formation which develops over 8000 subgrids at 34 levels of refinement to achieve a local refinement of a factor of 1012 in space and time. This allows us to resolve the properties of the first stars which form in the universe assuming standard physics and a standard cosmological model. Achieving extreme resolution requires the use of 128-bit extended precision arithmetic (EPA to accurately specify the subgrid positions. We describe our EPA AMR implementation on the IBM SP2 Blue Horizon system at the San Diego Supercomputer Center.

Molecular dynamics-based refinement and validation for sub-5 Å cryo-electron microscopy maps.

Science.gov (United States)

Singharoy, Abhishek; Teo, Ivan; McGreevy, Ryan; Stone, John E; Zhao, Jianhua; Schulten, Klaus

2016-07-07

Two structure determination methods, based on the molecular dynamics flexible fitting (MDFF) paradigm, are presented that resolve sub-5 Å cryo-electron microscopy (EM) maps with either single structures or ensembles of such structures. The methods, denoted cascade MDFF and resolution exchange MDFF, sequentially re-refine a search model against a series of maps of progressively higher resolutions, which ends with the original experimental resolution. Application of sequential re-refinement enables MDFF to achieve a radius of convergence of ~25 Å demonstrated with the accurate modeling of β-galactosidase and TRPV1 proteins at 3.2 Å and 3.4 Å resolution, respectively. The MDFF refinements uniquely offer map-model validation and B-factor determination criteria based on the inherent dynamics of the macromolecules studied, captured by means of local root mean square fluctuations. The MDFF tools described are available to researchers through an easy-to-use and cost-effective cloud computing resource on Amazon Web Services.

Grain refinement of AZ31 magnesium alloy by electromagnetic ...

Indian Academy of Sciences (India)

Low-frequency electromagnetic field; AZ31 magnesium alloy; Al4C3; grain refinement. Abstract. The effects of electromagnetic stirring and Al4C3 grain refiner on the grain refinement of semicontinuously cast AZ31 magnesium alloy were discussed in this investigation. The results indicate that electromagnetic stirring has an ...

Refinement of RAIM via Implementation of Implicit Euler Method

Energy Technology Data Exchange (ETDEWEB)

Lee, Yoonhee; Kim, Han-Chul [Korea Institute of Nuclear and Safety, Daejeon (Korea, Republic of)

2016-10-15

The first approach is a mechanistic approach which is used in LIRIC in which more than 200 reactions are modeled in detail. This approach enables to perform the detailed analysis. However, it requires huge computation burden. The other approach is a simplified model approach which is used in the IMOD, ASTEC/IODE, and etc. Recently, KINS has developed RAIM (Radio-Active Iodine chemistry Model) based on the simplified model approach. Since the numerical analysis module in RAIM is based on the explicit Euler method, there are major issues on the stability of the module. Therefore, implementation of a stable numerical method becomes essential. In this study, RAIM is refined via implementation of implicit Euler method in which the Newton method is used to find the solutions at each time step. The refined RAIM is tested by comparing to RAIM based on the explicit Euler method. In this paper, RAIM was refined by implementing the implicit Euler method. At each time step of the method in the refined RAIM, the reaction kinetics equations are solved by the Newton method in which elements of the Jacobian matrix are expressed analytically. With the results of OECD-BIP P10T2 test, the refined RAIM was compared to RAIM with the explicit Euler method. The refined RAIM shows better agreement with the experimental data than those from the explicit Euler method. For the rapid change of pH during the experiment, the refined RAIM gives more realistic changes in the concentrations of chemical species than those from the explicit Euler method. In addition, in terms of computing time, the refined RAIM shows comparable computing time to that with explicit Euler method. These comparisons are attributed to ⁓10 times larger time step size used in the implicit Euler method, even though computation burden at each time step in the refined RAIM is much higher than that of the explicit Euler method. Compared to the experimental data, the refined RAIM still shows discrepancy, which are attributed

Refinement of RAIM via Implementation of Implicit Euler Method

International Nuclear Information System (INIS)

Lee, Yoonhee; Kim, Han-Chul

2016-01-01

The first approach is a mechanistic approach which is used in LIRIC in which more than 200 reactions are modeled in detail. This approach enables to perform the detailed analysis. However, it requires huge computation burden. The other approach is a simplified model approach which is used in the IMOD, ASTEC/IODE, and etc. Recently, KINS has developed RAIM (Radio-Active Iodine chemistry Model) based on the simplified model approach. Since the numerical analysis module in RAIM is based on the explicit Euler method, there are major issues on the stability of the module. Therefore, implementation of a stable numerical method becomes essential. In this study, RAIM is refined via implementation of implicit Euler method in which the Newton method is used to find the solutions at each time step. The refined RAIM is tested by comparing to RAIM based on the explicit Euler method. In this paper, RAIM was refined by implementing the implicit Euler method. At each time step of the method in the refined RAIM, the reaction kinetics equations are solved by the Newton method in which elements of the Jacobian matrix are expressed analytically. With the results of OECD-BIP P10T2 test, the refined RAIM was compared to RAIM with the explicit Euler method. The refined RAIM shows better agreement with the experimental data than those from the explicit Euler method. For the rapid change of pH during the experiment, the refined RAIM gives more realistic changes in the concentrations of chemical species than those from the explicit Euler method. In addition, in terms of computing time, the refined RAIM shows comparable computing time to that with explicit Euler method. These comparisons are attributed to ⁓10 times larger time step size used in the implicit Euler method, even though computation burden at each time step in the refined RAIM is much higher than that of the explicit Euler method. Compared to the experimental data, the refined RAIM still shows discrepancy, which are attributed

The influence of alloying elements in aluminium on the grain refinement with ALTI5B1

Directory of Open Access Journals (Sweden)

Naglič I.

2009-07-01

Full Text Available This work deals with the influence of alloying elements in aluminium on the grain refinement with various additions of AlTi5B1. Grain-refinement tests were made at a cooling rate of 15 °C/s. The results revealed that in both aluminium and an Al-Fe alloy the grain size decreases with increasing additions of the AlTi5B1 grain refiner. We found that for the same boron content the grain size was smaller in the case of the Al-Fe alloy. The difference in the grain sizes for the same content of boron was approximately 15 μm; this is considerably smaller than the difference between the grain sizes in samples with the same difference of growth-restricting factor made at slower cooling rates.

Zone refining high-purity germanium

International Nuclear Information System (INIS)

Hubbard, G.S.; Haller, E.E.; Hansen, W.L.

1977-10-01

The effects of various parameters on germanium purification by zone refining have been examined. These parameters include the germanium container and container coatings, ambient gas and other operating conditions. Four methods of refining are presented which reproducibly yield 3.5 kg germanium ingots from which high purity (vertical barN/sub A/ - N/sub D/vertical bar less than or equal to2 x 10 10 cm -3 ) single crystals can be grown. A qualitative model involving binary and ternary complexes of Si, O, B, and Al is shown to account for the behavior of impurities at these low concentrations

Refining processes of selected copper alloys

Directory of Open Access Journals (Sweden)

S. Rzadkosz

2009-04-01

Full Text Available The analysis of the refining effectiveness of the liquid copper and selected copper alloys by various micro additions and special refiningsubstances – was performed. Examinations of an influence of purifying, modifying and deoxidation operations performed in a metal bath on the properties of certain selected alloys based on copper matrix - were made. Refining substances, protecting-purifying slag, deoxidation and modifying substances containing micro additions of such elements as: zirconium, boron, phosphor, sodium, lithium, or their compounds introduced in order to change micro structures and properties of alloys, were applied in examinations. A special attention was directed to macro and micro structures of alloys, their tensile and elongation strength and hot-cracks sensitivity. Refining effects were estimated by comparing the effectiveness of micro structure changes with property changes of copper and its selected alloys from the group of tin bronzes.

Adaptive mesh refinement for shocks and material interfaces

Energy Technology Data Exchange (ETDEWEB)

Dai, William Wenlong [Los Alamos National Laboratory

2010-01-01

There are three kinds of adaptive mesh refinement (AMR) in structured meshes. Block-based AMR sometimes over refines meshes. Cell-based AMR treats cells cell by cell and thus loses the advantage of the nature of structured meshes. Patch-based AMR is intended to combine advantages of block- and cell-based AMR, i.e., the nature of structured meshes and sharp regions of refinement. But, patch-based AMR has its own difficulties. For example, patch-based AMR typically cannot preserve symmetries of physics problems. In this paper, we will present an approach for a patch-based AMR for hydrodynamics simulations. The approach consists of clustering, symmetry preserving, mesh continuity, flux correction, communications, management of patches, and load balance. The special features of this patch-based AMR include symmetry preserving, efficiency of refinement across shock fronts and material interfaces, special implementation of flux correction, and patch management in parallel computing environments. To demonstrate the capability of the AMR framework, we will show both two- and three-dimensional hydrodynamics simulations with many levels of refinement.

Oil industry consolidation and refined product prices. Evidence from US wholesale gasoline terminals

International Nuclear Information System (INIS)

Kendix, Michael; Walls, W.D.

2010-01-01

Our objective in this paper is to quantify the impact of petroleum industry consolidation on refined product prices, controlling for other important factors that could also impact prices. Our empirical analysis focuses on the US petroleum refining industry using data on industry consolidation and wholesale gasoline prices collected over the interval 2000-2008. We match refinery units to wholesale city-terminal gasoline markets, and then estimate pooled cross-section time-series regressions to quantify the impact of petroleum industry consolidation on wholesale gasoline prices at city-specific terminals. The results of the empirical analysis of mergers are mixed, showing that some petroleum industry mergers resulted in statistically significant increases in refined product prices; others resulted in statistically significant declines and still others had no statistical impact at all. Our analysis of the effects of measures of market concentration - one at the level of city-specific wholesale terminals and another at the level of regional spot markets - found evidence that less concentrated markets are associated with lower price levels. (author)

Chinese refining capacity for Canadian heavy oil

International Nuclear Information System (INIS)

Bruce, G.W.

2006-01-01

This paper discussed China's refining capacity in relation to exports of Canadian heavy oil. Demand for oil is increasing throughout the world, and China is expected to consume 25 per cent of the projected yearly oil supplies. Alberta currently has an estimated 174 billion barrels of recoverable bitumen, and produces 1.06 million barrels per day. Production is expected to increase to 4.5 million barrels per day by the year 2020. Currently bitumen blends are refined and diluted with naphtha and sweet synthetic crude oil. Bitumen is a challenging feedstock for refineries, and requires thermal production methods or gasification processes. Primary conversion into sour synthetic crude is typically followed by hydrocracking and further refining into finished petroleum products. There are currently 50 refineries in China with a 7.4 million barrel per day capacity. Coastal refineries using imported crude oil have a 4 million barrel per day capacity. New facilities are being constructed and existing plants are being upgraded in order to process heavier and more sour crude oils. However, current refining capabilities in Chinese refineries have a limited ability for resid conversion. It was concluded that while China has a refining infrastructure, only refineries on the coast will use oil sands-derived feedstocks. However, there are currently opportunities to design refineries to match future feedstocks. tabs., figs

On macromolecular refinement at subatomic resolution with interatomic scatterers

Energy Technology Data Exchange (ETDEWEB)

Afonine, Pavel V., E-mail: pafonine@lbl.gov; Grosse-Kunstleve, Ralf W.; Adams, Paul D. [Lawrence Berkeley National Laboratory, One Cyclotron Road, BLDG 64R0121, Berkeley, CA 94720 (United States); Lunin, Vladimir Y. [Institute of Mathematical Problems of Biology, Russian Academy of Sciences, Pushchino 142290 (Russian Federation); Urzhumtsev, Alexandre [IGMBC, 1 Rue L. Fries, 67404 Illkirch and IBMC, 15 Rue R. Descartes, 67084 Strasbourg (France); Faculty of Sciences, Nancy University, 54506 Vandoeuvre-lès-Nancy (France); Lawrence Berkeley National Laboratory, One Cyclotron Road, BLDG 64R0121, Berkeley, CA 94720 (United States)

2007-11-01

Modelling deformation electron density using interatomic scatters is simpler than multipolar methods, produces comparable results at subatomic resolution and can easily be applied to macromolecules. A study of the accurate electron-density distribution in molecular crystals at subatomic resolution (better than ∼1.0 Å) requires more detailed models than those based on independent spherical atoms. A tool that is conventionally used in small-molecule crystallography is the multipolar model. Even at upper resolution limits of 0.8–1.0 Å, the number of experimental data is insufficient for full multipolar model refinement. As an alternative, a simpler model composed of conventional independent spherical atoms augmented by additional scatterers to model bonding effects has been proposed. Refinement of these mixed models for several benchmark data sets gave results that were comparable in quality with the results of multipolar refinement and superior to those for conventional models. Applications to several data sets of both small molecules and macromolecules are shown. These refinements were performed using the general-purpose macromolecular refinement module phenix.refine of the PHENIX package.

Calculating corrections in F-theory from refined BPS invariants and backreacted geometries

Energy Technology Data Exchange (ETDEWEB)

Poretschkin, Maximilian

2015-07-01

-String which are counted in the dual F-theory compactification. Using the refined BPS invariants we can count these states and explain their space-time spin content. In addition, we explain that they fall into representations of E8 which can be explicitly determined. The second application is given by a proposal how to count [p,q]-strings within F-theory which is based on the D3 probe-brane picture and the dual Seiberg-Witten description. As a third contribution to F-theory which is independent of the results obtained in the first part, we consider the backreaction of G{sub 4}-flux onto the geometry of a local model of a Calabi-Yau fourfold geometry. This induces a non-trivial warp-factor and modifies the Kaluza-Klein reduction ansatz. Taking this into account we demonstrate how corrections to the 7-brane gauge coupling function can be computed within F-theory.

Total antioxidant content of alternatives to refined sugar.

Science.gov (United States)

Phillips, Katherine M; Carlsen, Monica H; Blomhoff, Rune

2009-01-01

Oxidative damage is implicated in the etiology of cancer, cardiovascular disease, and other degenerative disorders. Recent nutritional research has focused on the antioxidant potential of foods, while current dietary recommendations are to increase the intake of antioxidant-rich foods rather than supplement specific nutrients. Many alternatives to refined sugar are available, including raw cane sugar, plant saps/syrups (eg, maple syrup, agave nectar), molasses, honey, and fruit sugars (eg, date sugar). Unrefined sweeteners were hypothesized to contain higher levels of antioxidants, similar to the contrast between whole and refined grain products. To compare the total antioxidant content of natural sweeteners as alternatives to refined sugar. The ferric-reducing ability of plasma (FRAP) assay was used to estimate total antioxidant capacity. Major brands of 12 types of sweeteners as well as refined white sugar and corn syrup were sampled from retail outlets in the United States. Substantial differences in total antioxidant content of different sweeteners were found. Refined sugar, corn syrup, and agave nectar contained minimal antioxidant activity (sugar had a higher FRAP (0.1 mmol/100 g). Dark and blackstrap molasses had the highest FRAP (4.6 to 4.9 mmol/100 g), while maple syrup, brown sugar, and honey showed intermediate antioxidant capacity (0.2 to 0.7 mmol FRAP/100 g). Based on an average intake of 130 g/day refined sugars and the antioxidant activity measured in typical diets, substituting alternative sweeteners could increase antioxidant intake an average of 2.6 mmol/day, similar to the amount found in a serving of berries or nuts. Many readily available alternatives to refined sugar offer the potential benefit of antioxidant activity.

Investment in exploration-production and refining 2015

International Nuclear Information System (INIS)

Maisonnier, G.; Hureau, G.; Serbutoviez, S.; Silva, C.

2016-01-01

IFPEN analyses in this study the 2015 evolution of global investment in the field of exploration-production and refining: - Changes in oil and gas prices; - Investment in Exploration/Production: the end of an upward cycle; - Drilling and the global drilling market, upstream activities and markets; - 2015, a breath of fresh air for refining

Effects of grain refinement on the biocorrosion and in vitro bioactivity of magnesium.

Science.gov (United States)

Saha, Partha; Roy, Mangal; Datta, Moni Kanchan; Lee, Boeun; Kumta, Prashant N

2015-12-01

Magnesium is a new class of biodegradable metals potentially suitable for bone fracture fixation due to its suitable mechanical properties, high degradability and biocompatibility. However, rapid corrosion and loss in mechanical strength under physiological conditions render it unsuitable for load-bearing applications. In the present study, grain refinement was implemented to control bio-corrosion demonstrating improved in vitro bioactivity of magnesium. Pure commercial magnesium was grain refined using different amounts of zirconium (0.25 and 1.0 wt.%). Corrosion behavior was studied by potentiodynamic polarization (PDP) and mass loss immersion tests demonstrating corrosion rate decrease with grain size reduction. In vitro biocompatibility tests conducted by MC3T3-E1 pre-osteoblast cells and measured by DNA quantification demonstrate significant increase in cell proliferation for Mg-1 wt.% Zr at day 5. Similarly, alkaline phosphatase (ALP) activity was higher for grain refined Mg. Alloys were also tested for ability to support osteoclast differentiation using RAW264.7 monocytes with receptor activator of nuclear factor kappa-β ligand (RANKL) supplemented cell culture. Osteoclast differentiation process was observed to be severely restricted for smaller grained Mg. Overall, the results indicate grain refinement to be useful not only for improving corrosion resistance of Mg implants for bone fixation devices but also potentially modulate bone regeneration around the implant. Copyright © 2015 Elsevier B.V. All rights reserved.

Biomolecular structure refinement using the GROMOS simulation software

International Nuclear Information System (INIS)

Schmid, Nathan; Allison, Jane R.; Dolenc, Jožica; Eichenberger, Andreas P.; Kunz, Anna-Pitschna E.; Gunsteren, Wilfred F. van

2011-01-01

For the understanding of cellular processes the molecular structure of biomolecules has to be accurately determined. Initial models can be significantly improved by structure refinement techniques. Here, we present the refinement methods and analysis techniques implemented in the GROMOS software for biomolecular simulation. The methodology and some implementation details of the computation of NMR NOE data, 3 J-couplings and residual dipolar couplings, X-ray scattering intensities from crystals and solutions and neutron scattering intensities used in GROMOS is described and refinement strategies and concepts are discussed using example applications. The GROMOS software allows structure refinement combining different types of experimental data with different types of restraining functions, while using a variety of methods to enhance conformational searching and sampling and the thermodynamically calibrated GROMOS force field for biomolecular simulation.

Biomolecular structure refinement using the GROMOS simulation software

Energy Technology Data Exchange (ETDEWEB)

Schmid, Nathan; Allison, Jane R.; Dolenc, Jozica; Eichenberger, Andreas P.; Kunz, Anna-Pitschna E.; Gunsteren, Wilfred F. van, E-mail: wfvgn@igc.phys.chem.ethz.ch [Swiss Federal Institute of Technology ETH, Laboratory of Physical Chemistry (Switzerland)

2011-11-15

For the understanding of cellular processes the molecular structure of biomolecules has to be accurately determined. Initial models can be significantly improved by structure refinement techniques. Here, we present the refinement methods and analysis techniques implemented in the GROMOS software for biomolecular simulation. The methodology and some implementation details of the computation of NMR NOE data, {sup 3}J-couplings and residual dipolar couplings, X-ray scattering intensities from crystals and solutions and neutron scattering intensities used in GROMOS is described and refinement strategies and concepts are discussed using example applications. The GROMOS software allows structure refinement combining different types of experimental data with different types of restraining functions, while using a variety of methods to enhance conformational searching and sampling and the thermodynamically calibrated GROMOS force field for biomolecular simulation.

Pakistan stepping up expansion of refining, transportation sectors

International Nuclear Information System (INIS)

Anon.

1992-01-01

This paper reports that Pakistan is taking steps to speed expansion of its refining and oil transportation infrastructure. While the country has made significant progress toward energy self-efficiency by boosting oil and gas production it still must modernize and expand an aging, inadequate refining sector to meet rapidly growing demand for refined products. Pakistan's government has disclosed plans to build two refineries in the country, one at Rawalpindi near a string of recent oil discoveries, the other somewhere in the southern part of the country, likely Karachi. At the same time, efforts are proceeding to upgrade Pakistan's refineries. In addition, Pakistani state companies continue to press joint ventures in refining and marketing with foreign companies and expand downstream ties with neighbors that are key oil and gas exporters

New Process for Grain Refinement of Aluminum. Final Report

Energy Technology Data Exchange (ETDEWEB)

Dr. Joseph A. Megy

2000-09-22

A new method of grain refining aluminum involving in-situ formation of boride nuclei in molten aluminum just prior to casting has been developed in the subject DOE program over the last thirty months by a team consisting of JDC, Inc., Alcoa Technical Center, GRAS, Inc., Touchstone Labs, and GKS Engineering Services. The Manufacturing process to make boron trichloride for grain refining is much simpler than preparing conventional grain refiners, with attendant environmental, capital, and energy savings. The manufacture of boride grain refining nuclei using the fy-Gem process avoids clusters, salt and oxide inclusions that cause quality problems in aluminum today.

Studies of the Action of Grain-Refining Particles in Aluminium Alloys

Science.gov (United States)

Schumacher, P.; Greer, A. L.

Crystallization from a melt and from a metallic glass both occur in an undercooled liquid. In this way identical nucleation mechanisms can operate in the two cases. However, in metallic glasses, unlike conventional solidification at low undercooling, the low atomic mobility permits the resolution and microscopical study of nucleation processes on added particles. Conventional aluminium grain-refiner based on Al-Ti-B has been used to obtain nucleant particles embedded in a glassy matrix of Al85Y8Ni5Co2 (at%). During crystallization from the glassy state, nucleation and growth of α-Al can be observed on TiB2 particles coated with a layer of Al3Ti Empirical relations found in casting practice of Al-alloys, such as excess Ti necessary for grain refinement, can be related to the observed nucleation mechanism, which is found to be very sensitive to both crystallographic and chemical factors.

Method of optimization of the natural gas refining process

Energy Technology Data Exchange (ETDEWEB)

Sadykh-Zade, E.S.; Bagirov, A.A.; Mardakhayev, I.M.; Razamat, M.S.; Tagiyev, V.G.

1980-01-01

The SATUM (automatic control system of technical operations) system introduced at the Shatlyk field should assure good quality of gas refining. In order to optimize the natural gas refining processes and experimental-analytical method is used in compiling the mathematical descriptions. The program, compiled in Fortran language, in addition to parameters of optimal conditions gives information on the yield of concentrate and water, concentration and consumption of DEG, composition and characteristics of the gas and condensate. The algorithm for calculating optimum engineering conditions of gas refining is proposed to be used in ''advice'' mode, and also for monitoring progress of the gas refining process.

Optimal algebraic multilevel preconditioning for local refinement along a line

NARCIS (Netherlands)

Margenov, S.D.; Maubach, J.M.L.

1995-01-01

The application of some recently proposed algebraic multilevel methods for the solution of two-dimensional finite element problems on nonuniform meshes is studied. The locally refined meshes are created by the newest vertex mesh refinement method. After the introduction of this refinement technique

RBT—A Tool for Building Refined Buneman Trees

DEFF Research Database (Denmark)

Besenbacher, Søren; Mailund; Westh-Nielsen, Lasse

2005-01-01

We have developed a tool implementing an efficient algorithm for refined Buneman tree reconstruction. The algorithm—which has the same complexity as the neighbour-joining method and the (plain) Buneman tree construction—enables refined Buneman tree reconstruction on large taxa sets....

India's refining prospects linked to economic growth

International Nuclear Information System (INIS)

Lewis, E.

1996-01-01

International investors assess refining ventures in India the same way they do comparable projects elsewhere in the world: according to their expectations about investment returns. By that standard, India's appeal is mixed, although its need for some measure of additional refining capacity seems certain. The success of future refinery investments will depend heavily on the government's commitment to policies allowing the economy to grow faster than the population. Unless accompanied by economic growth, expected increases in the population will not automatically raise demand for petroleum products. Decisions about investments in India's refining sector, therefore, must carefully weigh market fundamentals, the business environment, and likely investment performance. This paper reviews the market for the various products and predicts new economic trends

Refinement-Animation for Event-B - Towards a Method of Validation

DEFF Research Database (Denmark)

Hallerstede, Stefan; Leuschel, Michael; Plagge, Daniel

2010-01-01

We provide a detailed description of refinement in Event-B, both as a contribution in itself and as a foundation for the approach to simultaneous animation of multiple levels of refinement that we propose. We present an algorithm for simultaneous multi-level animation of refinement, and show how ...

Cleaning Data with OpenRefine

Directory of Open Access Journals (Sweden)

Seth van Hooland

2013-08-01

Full Text Available Duplicate records, empty values and inconsistent formats are phenomena we should be prepared to deal with when using historical data sets. This lesson will teach you how to discover inconsistencies in data contained within a spreadsheet or a database. As we increasingly share, aggregate and reuse data on the web, historians will need to respond to data quality issues which inevitably pop up. Using a program called OpenRefine, you will be able to easily identify systematic errors such as blank cells, duplicates, spelling inconsistencies, etc. OpenRefine not only allows you to quickly diagnose the accuracy of your data, but also to act upon certain errors in an automated manner.

Outlook for Canadian refining

International Nuclear Information System (INIS)

Boje, G.

1998-01-01

The petroleum supply and demand balance was discussed and a comparison between Canadian and U.S. refineries was provided. The impact of changing product specifications on the petroleum industry was also discussed. The major changes include sulphur reductions in gasoline, benzene and MMT additives. These changes have been made in an effort to satisfy environmental needs. Geographic margin variations in refineries between east and west were reviewed. An overview of findings from the Solomon Refining Study of Canadian and American refineries, which has been very complimentary of the Canadian refining industry, was provided. From this writer's point of view refinery utilization has improved but there is a threat from increasing efficiency of US competitors. Environmental issues will continue to impact upon the industry and while the chances for making economic returns on investment are good for the years ahead, it will be a challenge to maintain profitability

Structural refinement of artificial superlattices by the X-ray diffraction method

CERN Document Server

Ishibashi, Y; Tsurumi, T

1999-01-01

This paper reports a structural refinement of BaTiO sub 3 (BTO)/SrTiO sub 3 (STO) artificially superstructured thin films. The refinement was achieved by taking into account the effect of interdiffusion between BTO and STO. The samples were prepared by a molecular-beam epitaxy method on SrTiO sub 3 (001) substrate at 600 .deg. C. The phonon model was employed to simulate the X-ray diffraction (XRD) profiles. A discrepancy was observed in the intensities of the satellite peaks when the effect of the interdiffusion between BTO and STO was not incorporated in the simulation. In successive simulations, the concentration profile due to the interdiffusion was first calculated according to Fick's second law, and then the coefficients of the Fourier series describing the lattice distortion and the modulation of the structure factor were determined. The XRD profiles thus simulated almost completely agreed with those observed. This indicates that XRD analysis with the calculation process proposed in this study will ena...

Oil refining in U.S. foreign-trade zones

International Nuclear Information System (INIS)

Powell, S.J.; Potter, T.J.

1991-01-01

With the crude-oil import supply being as inexpensive as it is today, relative to domestic supply, many independents have been sourcing their crude-oil needs from abroad and have found it an opportune time to step up their level of refining activity. To further enhance their competitive position with respect to foreign refineries, certain domestic refiners have discovered the operational benefits and savings that result from having a refinery designated as a foreign-trade zone (FTZ) under the Foreign-Trade Zones Act of 1934, as amended. This paper examines the history and use of foreign-trade subzones for refining activities

Improvement of neutronic calculations on a Masurca core using adaptive mesh refinement capabilities

International Nuclear Information System (INIS)

Fournier, D.; Archier, P.; Le Tellier, R.; Suteau, C.

2011-01-01

The simulation of 3D cores with homogenized assemblies in transport theory remains time and memory consuming for production calculations. With a multigroup discretization for the energy variable and a discrete ordinate method for the angle, a system of about 10"4 coupled hyperbolic transport equations has to be solved. For these equations, we intend to optimize the spatial discretization. In the framework of the SNATCH solver used in this study, the spatial problem is dealt with by using a structured hexahedral mesh and applying a Discontinuous Galerkin Finite Element Method (DGFEM). This paper shows the improvements due to the development of Adaptive Mesh Refinement (AMR) methods. As the SNATCH solver uses a hierarchical polynomial basis, p−refinement is possible but also h−refinement thanks to non conforming capabilities. Besides, as the flux spatial behavior is highly dependent on the energy, we propose to adapt differently the spatial discretization according to the energy group. To avoid dealing with too many meshes, some energy groups are joined and share the same mesh. The different energy-dependent AMR strategies are compared to each other but also with the classical approach of a conforming and highly refined spatial mesh. This comparison is carried out on different quantities such as the multiplication factor, the flux or the current. The gain in time and memory is shown for 2D and 3D benchmarks coming from the ZONA2B experimental core configuration of the MASURCA mock-up at CEA Cadarache. (author)

English-Chinese oil refining dictionary. [English-Chinese

Energy Technology Data Exchange (ETDEWEB)

Chou, P; Zing, Z [eds.

1979-01-01

The dictionary is a collection of many disciplines but specialized in the terminology related to petroleum refining. It contains terms in areas such as refining, factory equipment and installation, petroleum products and test analysis, and instrument automation. It also contains terms in areas of petrochemistry, oil storage and transport, computer technology, and environmental protection. The total number of terms collected was approximately 53,000.

Grain Refinement of an Al-2 wt%Cu Alloy by Al3Ti1B Master Alloy and Ultrasonic Treatment

International Nuclear Information System (INIS)

Wang, E Q; Wang, G; Dargusch, M S; StJohn, D H; Qian, M; Eskin, D G

2016-01-01

Both inoculation by AlTiB master alloys and Ultrasonic Treatment (UT) are effective methods of refining the grain size of aluminium alloys. The present study investigates the influence of UT on the grain refinement of an Al-2 wt% Cu alloy with a range of Al3TilB master alloy additions. When the alloy contains the smallest amount of added master alloy, UT caused significant additional grain refinement compared with that provided by the master alloy only. However, the influence of UT on grain size reduces with increasing addition of the master alloy. Plotting the grain size data versus the inverse of the growth restriction factor (Q) reveals that the application of UT causes both an increase in the number of potentially active nuclei and a decrease in the size of the nucleation free zone due to a reduction in the temperature gradient throughout the melt. Both these factors promote the formation of a fine equiaxed grain structure. (paper)

Contextual Distance Refining for Image Retrieval

KAUST Repository

Islam, Almasri

2014-01-01

Recently, a number of methods have been proposed to improve image retrieval accuracy by capturing context information. These methods try to compensate for the fact that a visually less similar image might be more relevant because it depicts the same object. We propose a new quick method for refining any pairwise distance metric, it works by iteratively discovering the object in the image from the most similar images, and then refine the distance metric accordingly. Test show that our technique improves over the state of art in terms of accuracy over the MPEG7 dataset.

Contextual Distance Refining for Image Retrieval

KAUST Repository

Islam, Almasri

2014-09-16

Recently, a number of methods have been proposed to improve image retrieval accuracy by capturing context information. These methods try to compensate for the fact that a visually less similar image might be more relevant because it depicts the same object. We propose a new quick method for refining any pairwise distance metric, it works by iteratively discovering the object in the image from the most similar images, and then refine the distance metric accordingly. Test show that our technique improves over the state of art in terms of accuracy over the MPEG7 dataset.

In-situ partitioning and bioconcentration of polycyclic aromatic hydrocarbons among water, suspended particulate matter, and fish in the Dongjiang and Pearl Rivers and the Pearl River Estuary, China

International Nuclear Information System (INIS)

Li, Haiyan; Lu, Lei; Huang, Wen; Yang, Juan; Ran, Yong

2014-01-01

Highlights: • PAHs are relatively higher in marine fish than in freshwater fish. • PAHs respectively show significant correlations with DOC, POC, and Chl a. • The log K oc for PAHs is one order magnitude higher than the predicted. • The log BCF values in fish and their tissues are nonlinear in respect to log K ow . • Lipid is related to PAHs in freshwater fish, but not in marine fishes. - Abstract: The partitioning and bioaccumulation of polycyclic aromatic hydrocarbons (PAHs) in water, suspended particulate matter (SPM), and fish samples from the Dongjiang River (DR), Pearl River (PR), and the Pearl River Estuary (PRE) were examined. Although PAHs are much lower in PRE than in DR or PR, PAHs in some fish species are significantly higher in PRE than in DR or PR. Aqueous or particulate PAHs respectively show significant correlations with dissolved organic carbon, particulate organic matter, and chlorophyll a, suggesting that biological pumping effect regulates their distribution. The in situ partitioning coefficients (log K oc ) for PAHs are one order magnitude higher than the empirical log K oc –log K ow correlation. The bioconcentration factor (BCF) is slightly higher for the marine fish than for the freshwater fish. The above phenomena indicate that BCF may vary due to the diversity of fish species, feeding habits, and metabolism of PAHs in fish

Refinement in Z and Object-Z foundations and advanced applications

CERN Document Server

Derrick, John

2013-01-01

Refinement is one of the cornerstones of the formal approach to software engineering, and its use in various domains has led to research on new applications and generalisation. This book brings together this important research in one volume, with the addition of examples drawn from different application areas. It covers four main themes:Data refinement and its application to ZGeneralisations of refinement that change the interface and atomicity of operationsRefinement in Object-ZModelling state and behaviour by combining Object-Z with CSPRefinement in Z and Object-Z: Foundations and Advanced A

Singapore refiners in midst of huge construction campaign

International Nuclear Information System (INIS)

Land, R.

1992-01-01

This paper reports that Singapore's downstream capacity continues to mushroom. Singapore refiners, upbeat about long term prospects for petroleum products demand in the Asia-Pacific region, and are pressing plans to boost processing capacity. Their plans go beyond capacity expansions. They are proceeding with projects to upgrade refineries to emphasize production of higher value products and to further integrate refining capabilities wit the region's petrochemical industry. Planned expansion and upgrading projects at Singapore refineries call for outlays of more than $1 billion to boost total capacity to about 1.1 million b/d in 1993 and 1.27 million b/d by 1995. That would be the highest level since the mid-1980s, when refiners such as Shell Singapore cut capacity amid an oil glut. Singapore refineries currently are running at effective full capacity of 1.04 million b/d. Meanwhile, Singapore refiners are aggressively courting customers in the Indochina subcontinent, where long isolated centrally planned economies are turning gradually to free markets

Directions in refining and upgrading of heavy oil and bitumen

International Nuclear Information System (INIS)

Dawson, B.; Parker, R. J.; Flint, L.

1997-01-01

The expansion of heavy oil transportation, marketing and refining facilities over the past two decades have been reviewed to show the strides that several Canadian refiners have taken to build up the facilities required to process synthetic crude oil (SCO). Key points made at a conference, convened by the National Centre for Upgrading Technology (NCUT), held in Edmonton during September 1997 to discuss current and future directions in the refining and marketing of heavy oil, bitumen and SCO, were summarized. Among the key points mentioned were: (1) the high entry barriers faced by centralized upgraders, (2) the advantages of integrating SCO or heavy oil production with downstream refining, (3) the stiff competition from Venezuela and Mexico that both SCO and heavy oil will face in the U.S. PADD II market, (4) the differences between Canadian refiners who have profited from hydrocracking and are better able to handle coker-based SCO, and American refiners who rely chiefly on catalytic cracking and are less able to process the highly aromatic SCO, and (5) the disproportionate cost in the upgrading process represented by the conversion of asphaltenes. Challenges and opportunities for key stakeholders, i.e. producers, refiners, marketers and technology licensors also received much attention at the Edmonton conference

30 CFR 208.4 - Royalty oil sales to eligible refiners.

Science.gov (United States)

2010-07-01

... 30 Mineral Resources 2 2010-07-01 2010-07-01 false Royalty oil sales to eligible refiners. 208.4... MANAGEMENT SALE OF FEDERAL ROYALTY OIL General Provisions § 208.4 Royalty oil sales to eligible refiners. (a... and defense. The Secretary will review these items and will determine whether eligible refiners have...

75 FR 18015 - Credit for Renewable Electricity Production, Refined Coal Production, and Indian Coal Production...

Science.gov (United States)

2010-04-08

..., Refined Coal Production, and Indian Coal Production, and Publication of Inflation Adjustment Factors and... coal production, and Indian coal production under section 45. FOR FURTHER INFORMATION CONTACT: Philip... Coal, and Indian Coal:'', Line 26, the language ``is 2.15 cents per kilowatt hour on the'' is corrected...

Development of an efficient grain refiner for Al-7Si alloy

Energy Technology Data Exchange (ETDEWEB)

Kori, S.A.; Murty, B.S.; Chakraborty, M. [Indian Inst. of Technol., Kharagpur (India). Dept. of Metall. and Mater. Eng.

2000-03-15

The response of Al-7Si alloy towards grain refinement by Al-Ti-B master alloys (with different Ti-B ratios) at different addition levels has been studied in detail. The results indicate that high B-containing master alloys are powerful grain refiners when compared to conventional grain refiners like Al-5Ti-lB master alloys. In the present study, indigenously developed master alloys have been used for the grain refinement of alloys Al-7Si and LM-25. Significant improvements in mechanical properties have been obtained with a combination of grain refiner and Sr as modifier. (orig.)

Local grid refinement for free-surface flow simulations

NARCIS (Netherlands)

van der Plas, Peter

2017-01-01

The principal goal of the current study is to explore and investigate the potential of local grid refinement for increasing the numerical efficiency of free-surface flow simulations in a practical context. In this thesis we propose a method for local grid refinement in the free-surface flow model

Oil refining in South Asia and Australasia

International Nuclear Information System (INIS)

Yamaguchi, N.D.

2000-01-01

An overview of the oil markets of Southeast Asia and Australasia is presented focussing on oil refining. Key statistics of both areas are tabulated, and figures providing information on GDP/capita, crude production, comparison of demand barrels, and product demand are provided. Crude oil production and supply, oil product demand, and the refining industries are examined with details given of evolution of capacity and cracking to distillation ratios

Investment in Exploration-Production and Refining - 2016

International Nuclear Information System (INIS)

Maisonnier, Guy; Hureau, Geoffroy; Serbutoviez, Sylvain; Silva, Constancio

2017-03-01

IFPEN analyses in this study the 2016 evolution of global investment in the field of exploration-production and refining: - Trends in oil and gas prices; - Investment in exploration/production: in sharp decline for the second consecutive year - the first time this has happened since 1986; - The global drilling market; - Geophysical: global activity and markets; - Offshore construction: market and business; - A significant reduction in refining projects (atmospheric distillation and conversion)

Refining a Tool for the Selection of Experts in Educational Research

Directory of Open Access Journals (Sweden)

Miguel Cruz Ramírez

2012-11-01

Full Text Available In this paper we report a research study geared toward refining an empirical instrument for the selection of experts for educational research, according to its reliability and internal consistency. To this end we used a three-round Delphi technique and subjected the results to a factor analysis. Latent variables were determined that explain the nature of the sources of argumentation necessary for ensuring an adequate level of competence on the part of the experts.

Problems persist for French refining sector

International Nuclear Information System (INIS)

Beck, R.J.

1992-01-01

This paper reports that France's refiners face a continuing shortfall of middle distillate capacity and a persistent surplus of heavy fuel oil. That's the main conclusion of the official Hydrocarbon Directorate's report on how France's refining sector performed in 1991. Imports up---The directorate noted that although net production of refined products in French refineries rose to 1.534 million b/d in 1991 from 1.48 million b/d in 1990, products imports jumped 9.7% to 602,000 b/d in the period. The glut of heavy fuel oil eased to some extent last year because French nuclear power capacity, heavily dependent on ample water supplies, was crimped by drought. That spawned fuel switching. The most note worthy increase in imports was for motor diesel, climbing to 176,000 b/d from 148,000 b/d in 1990. Tax credits are spurring French consumption of that fuel. For the first time, consumption of motor diesel in 1991 outstripped that of gasoline at 374,000 b/d and 356,000 b/d respectively

Refining glass structure in two dimensions

Science.gov (United States)

Sadjadi, Mahdi; Bhattarai, Bishal; Drabold, D. A.; Thorpe, M. F.; Wilson, Mark

2017-11-01

Recently determined atomistic scale structures of near-two dimensional bilayers of vitreous silica (using scanning probe and electron microscopy) allow us to refine the experimentally determined coordinates to incorporate the known local chemistry more precisely. Further refinement is achieved by using classical potentials of varying complexity: one using harmonic potentials and the second employing an electrostatic description incorporating polarization effects. These are benchmarked against density functional calculations. Our main findings are that (a) there is a symmetry plane between the two disordered layers, a nice example of an emergent phenomena, (b) the layers are slightly tilted so that the Si-O-Si angle between the two layers is not 180∘ as originally thought but rather 175 ±2∘ , and (c) while interior areas that are not completely imagined can be reliably reconstructed, surface areas are more problematic. It is shown that small crystallites that appear are just as expected statistically in a continuous random network. This provides a good example of the value that can be added to disordered structures imaged at the atomic level by implementing computer refinement.

Segmental Refinement: A Multigrid Technique for Data Locality

KAUST Repository

Adams, Mark F.; Brown, Jed; Knepley, Matt; Samtaney, Ravi

2016-01-01

We investigate a domain decomposed multigrid technique, termed segmental refinement, for solving general nonlinear elliptic boundary value problems. We extend the method first proposed in 1994 by analytically and experimentally investigating its complexity. We confirm that communication of traditional parallel multigrid is eliminated on fine grids, with modest amounts of extra work and storage, while maintaining the asymptotic exactness of full multigrid. We observe an accuracy dependence on the segmental refinement subdomain size, which was not considered in the original analysis. We present a communication complexity analysis that quantifies the communication costs ameliorated by segmental refinement and report performance results with up to 64K cores on a Cray XC30.

Segmental Refinement: A Multigrid Technique for Data Locality

KAUST Repository

Adams, Mark F.

2016-08-04

We investigate a domain decomposed multigrid technique, termed segmental refinement, for solving general nonlinear elliptic boundary value problems. We extend the method first proposed in 1994 by analytically and experimentally investigating its complexity. We confirm that communication of traditional parallel multigrid is eliminated on fine grids, with modest amounts of extra work and storage, while maintaining the asymptotic exactness of full multigrid. We observe an accuracy dependence on the segmental refinement subdomain size, which was not considered in the original analysis. We present a communication complexity analysis that quantifies the communication costs ameliorated by segmental refinement and report performance results with up to 64K cores on a Cray XC30.

Environmental monitoring program design for uranium refining and conversion operations

International Nuclear Information System (INIS)

1984-08-01

The objective of this study was to develop recommendations for the design of environmental monitoring programs at Canadian uranium refining and conversion operations. In order to develop monitoring priorities, chemical and radioactive releases to the air and water were developed for reference uranium refining and conversion facilities. The relative significance of the radioactive releases was evaluated through a pathways analysis which estimated dose to individual members of the critical receptor group. The effects of chemical releases to the environment were assessed by comparing predicted air and water contaminant levels to appropriate standards or guidelines. For the reference facilities studied, the analysis suggested that environmental effects are likely to be dominated by airborne release of both radioactive and nonradioactive contaminants. Uranium was found to be the most important radioactive species released to the air and can serve as an overall indicator of radiological impacts for any of the plants considered. The most important nonradioactive air emission was found to be fluoride (as hydrogen fluoride) from the uranium hexafluoride plant. For the uranium trioxide and uranium dioxide plants, air emissions of oxides of nitrogen were considered to be most important. The study recommendations for the design of an environmental monitoring program are based on consideration of those factors most likely to affect local air and water quality, and human radiation exposure. Site- and facility-specific factors will affect monitoring program design and the selection of components such as sampling media, locations and frequency, and analytical methods

Refinement of the experimental dynamic structure factor for liquid para-hydrogen and ortho-deuterium using semi-classical quantum simulation

International Nuclear Information System (INIS)

Smith, Kyle K. G.; Rossky, Peter J.; Poulsen, Jens Aage; Cunsolo, A.

2014-01-01

The dynamic structure factor of liquid para-hydrogen and ortho-deuterium in corresponding thermodynamic states (T = 20.0 K, n = 21.24 nm −3 ) and (T = 23.0 K, n = 24.61 nm −3 ), respectively, has been computed by both the Feynman-Kleinert linearized path-integral (FK-LPI) and Ring-Polymer Molecular Dynamics (RPMD) methods and compared with Inelastic X Ray Scattering spectra. The combined use of computational and experimental methods enabled us to reduce experimental uncertainties in the determination of the true sample spectrum. Furthermore, the refined experimental spectrum of para-hydrogen and ortho-deuterium is consistently reproduced by both FK-LPI and RPMD results at momentum transfers lower than 12.8 nm −1 . At larger momentum transfers the FK-LPI results agree with experiment much better for ortho-deuterium than for para-hydrogen. More specifically we found that for k ∼ 20.0 nm −1 para-hydrogen provides a test case for improved approximations to quantum dynamics

Solving the Sophistication-Population Paradox of Game Refinement Theory

OpenAIRE

Xiong , Shuo; Tiwary , Parth ,; Iida , Hiroyuki

2016-01-01

Part 4: Short Papers; International audience; A mathematical model of game refinement was proposed based on uncertainty of game outcome. This model has been shown to be useful in measuring the entertainment element in the domains such as boardgames and sport games. However, game refinement theory has not been able to explain the correlation between the popularity of a game and the game refinement value. This paper introduces another aspect in the study of game entertainment, the concept of “a...

A refined approach: Saudi Arabia moves beyond crude

International Nuclear Information System (INIS)

Krane, Jim

2015-01-01

Saudi Arabia's role in global energy markets is changing. The kingdom is reshaping itself as a supplier of refined petroleum products while moving beyond its long-held role as a simple exporter of crude oil. This change is commensurate with the typical development trajectory of a state progressing to a more advanced stage of global economic integration. Gains from increased refining include reducing fuel imports and capturing margins now bequeathed to competitors. Refining also allows the kingdom to export its heavy crude oil to a wider array of customers, beyond select importers configured to handle heavy crudes. However, the move also presents strategic complications. The world's 'swing supplier' of oil may grow less willing or able to adjust supply to suit market demands. In the process, Saudi Arabia may have to update the old “oil for security” relationship that links it with Washington, augmenting it with a more diverse set of economic and investment ties with individual companies and countries, including China. -- Highlights: •Saudi Arabia is diverting crude oil into an expanding refining sector. •In doing so, the kingdom is moving beyond its role as global “swing supplier” of crude oil. •The kingdom will benefit from increased refining, including enhanced demand for heavy crude. •Strategic complications may force it to seek security partners beyond Washington

Bayesian ensemble refinement by replica simulations and reweighting

Science.gov (United States)

Hummer, Gerhard; Köfinger, Jürgen

2015-12-01

We describe different Bayesian ensemble refinement methods, examine their interrelation, and discuss their practical application. With ensemble refinement, the properties of dynamic and partially disordered (bio)molecular structures can be characterized by integrating a wide range of experimental data, including measurements of ensemble-averaged observables. We start from a Bayesian formulation in which the posterior is a functional that ranks different configuration space distributions. By maximizing this posterior, we derive an optimal Bayesian ensemble distribution. For discrete configurations, this optimal distribution is identical to that obtained by the maximum entropy "ensemble refinement of SAXS" (EROS) formulation. Bayesian replica ensemble refinement enhances the sampling of relevant configurations by imposing restraints on averages of observables in coupled replica molecular dynamics simulations. We show that the strength of the restraints should scale linearly with the number of replicas to ensure convergence to the optimal Bayesian result in the limit of infinitely many replicas. In the "Bayesian inference of ensembles" method, we combine the replica and EROS approaches to accelerate the convergence. An adaptive algorithm can be used to sample directly from the optimal ensemble, without replicas. We discuss the incorporation of single-molecule measurements and dynamic observables such as relaxation parameters. The theoretical analysis of different Bayesian ensemble refinement approaches provides a basis for practical applications and a starting point for further investigations.

The future of refining industry is in Asia

International Nuclear Information System (INIS)

Dupin, L.

2010-01-01

The decision of Total Group to close down the refining activity of its Flandres' site at Dunkerque (France) is a testimony of the deep restructuring that is affecting this sector. The migration of the refining activity towards Middle-East and Asia has started several years ago. The World capacities are increasing: in 2009 4.36 billion tons of petroleum products were refined in the world, representing a 1.9% rise with respect to 2008. 661 refineries exist in the world, among which 6 were inaugurated in 2009, 115 are located in Europe and 12 in France. The bad health of the European refining activity is beneficial to Middle and Asia where investments in new production capacities follow on from one another. From now to 2030, these areas will benefit from 70% of the worldwide investments compared to 11% only for Europe and North America. The decline of the European refining industry is directly linked to decay of the automotive fuel consumption and to the increase of the diesel fuel share with respect to gasoline. On the other hand, Asia, and in particular China and India, follow the exactly opposite trend thanks to their population and economic growths. Therefore, European oil companies try to invest in Asia and are looking for new production capacities in China and India. (J.S.)

The Analysis of the Chloride and Fluoride Influences on the Reducer Refinement Processes (Carbo-N-Ox Aluminum Alloys

Directory of Open Access Journals (Sweden)

Bydałek A. W.

2013-09-01

Full Text Available Slag refining slag with west materials was analysed used the DTA methods. In the paper a method of determining the reduction capability, with the Carbo-N-Ox method, of slag solutions was used. Some relations between the stimulators in the environment - slag - metal system allow to initiate mass exchange reactions in the process of slag refining.The presented in work course of behaviour permits on choice of basic composition of slaglite, the of necessary components stimulating quantities, as well as on accomplishment of opinion of ability refinement. The worked out programme Slag-Prop, after introduction of data with experiment, it allows on next corrections in composition of proposed mixtures also, should be put on properly elaborated factors of multistage reaction with essential usage of suitable stimulators.

Refining - Panorama 2008; Raffinage - Panorama 2008

Energy Technology Data Exchange (ETDEWEB)

NONE

2008-07-01

Investment rallied in 2007, and many distillation and conversion projects likely to reach the industrial stage were announced. With economic growth sustained in 2006 and still pronounced in 2007, oil demand remained strong - especially in emerging countries - and refining margins stayed high. Despite these favorable business conditions, tensions persisted in the refining sector, which has fallen far behind in terms of investing in refinery capacity. It will take renewed efforts over a long period to catch up. Looking at recent events that have affected the economy in many countries (e.g. the sub-prime crisis), prudence remains advisable.

The Charfuel coal refining process

International Nuclear Information System (INIS)

Meyer, L.G.

1991-01-01

The patented Charfuel coal refining process employs fluidized hydrocracking to produce char and liquid products from virtually all types of volatile-containing coals, including low rank coal and lignite. It is not gasification or liquefaction which require the addition of expensive oxygen or hydrogen or the use of extreme heat or pressure. It is not the German pyrolysis process that merely 'cooks' the coal, producing coke and tar-like liquids. Rather, the Charfuel coal refining process involves thermal hydrocracking which results in the rearrangement of hydrogen within the coal molecule to produce a slate of co-products. In the Charfuel process, pulverized coal is rapidly heated in a reducing atmosphere in the presence of internally generated process hydrogen. This hydrogen rearrangement allows refinement of various ranks of coals to produce a pipeline transportable, slurry-type, environmentally clean boiler fuel and a slate of value-added traditional fuel and chemical feedstock co-products. Using coal and oxygen as the only feedstocks, the Charfuel hydrocracking technology economically removes much of the fuel nitrogen, sulfur, and potential air toxics (such as chlorine, mercury, beryllium, etc.) from the coal, resulting in a high heating value, clean burning fuel which can increase power plant efficiency while reducing operating costs. The paper describes the process, its thermal efficiency, its use in power plants, its pipeline transport, co-products, environmental and energy benefits, and economics

Asian oil refining. Demand growth and deregulation - an uncertain future

International Nuclear Information System (INIS)

Sameer Nawaz.

1996-01-01

The objective of the report is to identify the most important features of the oil refining industry in Asia. Major developments in consumption patterns changes in regional importance of countries are discussed, highlighting potential future developments. The first chapter introduces the various refining processes and presents a simple model for the analysis of complex refineries. Chapter 2 examines the development of the Asian refining industry against a background of economic growth and analyses trends in consumption of all products in Asian countries. In Chapter 3, the key issues concerning the refining industry are examined, among them the forces driving consumption, including the importance of economic development, and electricity and transport demand. The importance of product imports and international trade is discussed, and the extent of government involvement and the effects of changing retail and market prices are analysed. Chapter 4 looks at the strategies that oil and gas companies are following in the Asian refining industry. Particular significance is attached to the vertical integration of the oil majors, Japanese and Middle Eastern oil companies. A brief overview of the importance of the petrochemical industry is presented. The countries of Asia that are involved in the refining industry are profiled in Chapter 5. The future trend in oil consumption is examined in Chapter 6. There follows a brief discussion of the plans to expand crude refining capacity in the various countries and a forecast of the state of overcapacity which will result. In the final chapter, brief profiles of some of the most important companies in the Asian refining industry are presented, discussing their major activities and future plans. (Author)

THE QUESTION OF THE EFFECTIVENESS OF OIL REFINING IN RUSSIA: AN ECONOMETRIC ANALYSIS

Directory of Open Access Journals (Sweden)

Sokolov A. V.

2016-09-01

Full Text Available The relations between the financial statements’ figures of the complex of refining companies - the core of Russian refining industry from 2006 to 2013 - were analyzed using component and regression analysis from the standpoint of the effectiveness of their activities during the modernization period. Through the component analysis the main factors that influenced the final financial results of the enterprises during the given period were determined. Regression models of panel data with fixed and random effects were made for 19 enterprises. Regression analysis revealed no statistically significant dependencies of the efficiency (profitability on the production scale (enterprise revenue. The dynamics of certain types of expenses were analyzed in order to explain the differences in the profitability dynamics. It revealed virtually no difference in the values of the individual effects of enterprises in different areas of specialization (profile.

Grain refinement of permanent mold cast copper base alloys. Final report

Energy Technology Data Exchange (ETDEWEB)

Sadayappan, M.; Thomson, J. P.; Elboujdaini, M.; Gu, G. Ping; Sahoo, M.

2004-04-29

Grain refinement behavior of copper alloys cast in permanent molds was investigated. This is one of the least studied subjects in copper alloy castings. Grain refinement is not widely practiced for leaded copper alloys cast in sand molds. Aluminum bronzes and high strength yellow brasses, cast in sand and permanent molds, were usually fine grained due to the presence of more than 2% iron. Grain refinement of the most common permanent mold casting alloys, leaded yellow brass and its lead-free replacement EnviroBrass III, is not universally accepted due to the perceived problem of hard spots in finished castings and for the same reason these alloys contain very low amounts of iron. The yellow brasses and Cu-Si alloys are gaining popularity in North America due to their low lead content and amenability for permanent mold casting. These alloys are prone to hot tearing in permanent mold casting. Grain refinement is one of the solutions for reducing this problem. However, to use this technique it is necessary to understand the mechanism of grain refinement and other issues involved in the process. The following issues were studied during this three year project funded by the US Department of Energy and the copper casting industry: (1) Effect of alloying additions on the grain size of Cu-Zn alloys and their interaction with grain refiners; (2) Effect of two grain refining elements, boron and zirconium, on the grain size of four copper alloys, yellow brass, EnviroBrass II, silicon brass and silicon bronze and the duration of their effect (fading); (3) Prediction of grain refinement using cooling curve analysis and use of this method as an on-line quality control tool; (4) Hard spot formation in yellow brass and EnviroBrass due to grain refinement; (5) Corrosion resistance of the grain refined alloys; (6) Transfer the technology to permanent mold casting foundries; It was found that alloying elements such as tin and zinc do not change the grain size of Cu-Zn alloys

The present state of refining in France

International Nuclear Information System (INIS)

1996-01-01

The european refining industry suffers from a production over-capacity and closures are inevitable; the situation is even worse in France due to the imbalance between gas oil and gasoline prices and the weak margin for distributors. The French refining industry is however an important and essential link for its strategic fuel and petroleum product supply, and represent 17000 jobs. Several measures are introduced by the French Industry department towards restructuring, capacity reduction and fuel price harmonization

A new process of electron beam refining of niobium

International Nuclear Information System (INIS)

Pinatti, D.G.

1981-01-01

A review of thermodynamic equilibrium, the kinetic theory and experimental results of the metal-gas interaction in refractory metals is presented. N 2 , H 2 and CO absorption and desorption take place by a reversible process while O 2 takes place by a irreversible process with atom absorption and metal oxide desorption. A new technology of electron beam refining of Niobium is proposed based on four points: 1) preparation of the aluminothermic reduced electrode, 2) zone refining in the first melt, 3) kinetic theory of refining in the following melts and 4) design of a compact furnace. Experimental results in a pilot plant of 300 KW have shown complete agreement with the proposed technology yielding a productivity 2.4 times larger than the value predicted by the conventional technology of electron beam refining of Niobium. (Author) [pt

Factors affecting heavy metal uptake in plant selection for phytoremediation

Energy Technology Data Exchange (ETDEWEB)

Anton, A.; Mathe-Gaspar, G. [Research Inst. for Soil Science and Agricultural Chemistry of the Hungarian Academy of Sciences, Budapest (Hungary)

2005-04-01

The heavy metal uptake of ten plant species was studied under different soil and climatic conditions. Effects of soil pH, temperature, plant species and phenophase on the heavy metal content of stems and leaves were determined in pot experiments. Plants and soil samples were collected from a lead/zinc mine ore (Gyoengyoesoroszi, Hungary) and characterised by high contents of Pb, Zn, As, Cd, Cu. The possibility of an adapted phytoremediation technology was indicated by different bioconcentration factors (BCF). The BCF depended markedly (10- to 100-fold) on plant species and environmental conditions. Based on our results a ''season-adapted'' phytoextraction technology with different plant species (utilising their different temperature requirements and/or harvest time) is suggested. (orig.)

European refining: evolution or revolution?

International Nuclear Information System (INIS)

Cuthbert, N.

1999-01-01

A recent detailed analysis of the refining business in Europe (by Purvin and Gurtz) was used to highlight some key issues facing the industry. The article was written under five sub-sections: (i) economic environment (assessment of the economic prospects for Europe), (ii) energy efficiency and global warming (lists the four points of the EU car makers' voluntary agreement), (iii) fuel quality and refinery investment (iv) refinery capacity and utilisation and (v) industry structure and development. Diagrams show GDP per capita for East and West, European road fuel demand to 2015 and European net trade and European refinery ownership by crude capacity. It was concluded that the future of refining in Europe is 'exciting and challenging' and there are likely to be more large joint venture refineries. (UK)

Success in Asian refining -- Strategies for a growth industry

International Nuclear Information System (INIS)

Burke, B.F.

1994-01-01

Asia offers some of the best growth opportunities to the global refining industry. Many of its nations are in the process of industrializing, with a rapid rise in living standards and associated energy use. Growth trends are firmly established, with petroleum use in particular increasing rapidly as modern transport infrastructures develop. Of perhaps greater importance is Asia's potential for continued growth based on population and GDP trends. While the expected growth offers a wide range of opportunities, succeeding in the unique Asian marketplace will be a challenge mastered by only a few new entrants. This paper will examine some of the critical issues that will drive success and shape the refining business in Asia. Industry fundamentals will be reviewed, with a focus on growth and profit drivers. With the fundamental framework established, the unique challenges posed by the Asian environment, including cultural issues, investment requirements, regulatory trends and issues in market development will be discussed. The ability to succeed in Asia by identifying factors that create local advantage within a very diverse region will be discussed. The need to merge corporate capabilities and objectives with regional opportunities is the key requirement to succeed in entering or expanding in the region

Multilevel local refinement and multigrid methods for 3-D turbulent flow

Energy Technology Data Exchange (ETDEWEB)

Liao, C.; Liu, C. [UCD, Denver, CO (United States); Sung, C.H.; Huang, T.T. [David Taylor Model Basin, Bethesda, MD (United States)

1996-12-31

A numerical approach based on multigrid, multilevel local refinement, and preconditioning methods for solving incompressible Reynolds-averaged Navier-Stokes equations is presented. 3-D turbulent flow around an underwater vehicle is computed. 3 multigrid levels and 2 local refinement grid levels are used. The global grid is 24 x 8 x 12. The first patch is 40 x 16 x 20 and the second patch is 72 x 32 x 36. 4th order artificial dissipation are used for numerical stability. The conservative artificial compressibility method are used for further improvement of convergence. To improve the accuracy of coarse/fine grid interface of local refinement, flux interpolation method for refined grid boundary is used. The numerical results are in good agreement with experimental data. The local refinement can improve the prediction accuracy significantly. The flux interpolation method for local refinement can keep conservation for a composite grid, therefore further modify the prediction accuracy.

Uranium refining process using ion exchange membrane

International Nuclear Information System (INIS)

Yamaguchi, Akira

1977-01-01

As for the method of refining uranium ore being carried out in Europe and America at present, uranium ore is roughly refined at the mine sites to yellow cake, then this is transported to refineries and refined by dry method. This method has the following faults, namely the number of processes is large, it requires expensive corrosion-resistant materials because of high temperature treatment, and the impurities in uranium tend to increase. On the other hand, in case of EXCER method, treatment is carried out at low temperature, and high purity uranium can be obtained, but the efficiency of electrolytic reduction process is extremely low, and economically infeasible. In the wet refining method called PNC process, uranium tetrafluoride is produced from uranium ore without making yellow cake, therefore the process is rationalized largely, and highly economical. The electrolytic reduction process in this method was developed by Asahi Chemical Industry Co., Ltd. by constructing the pilot plant in Ningyotoge Mine. The ion exchange membrane, the electrodes, and the problems concerning the process and the engineering for commercial plants were investigated. The electrolytic reduction process, the pilot plant, the development of the elements of electrolytic cells, the establishment of analytical process, the measurement of the electrolytic characteristics, the demonstration operation, and the life time of the electrolytic diaphragm are reported. (Kako, I.)

A Novel Admixture-Based Pharmacogenetic Approach to Refine Warfarin Dosing in Caribbean Hispanics

Science.gov (United States)

Claudio-Campos, Karla; Rivera-Miranda, Giselle; Bermúdez-Bosch, Luis; Renta, Jessicca Y.; Cadilla, Carmen L.; Cruz, Iadelisse; Feliu, Juan F.; Vergara, Cunegundo; Ruaño, Gualberto

2016-01-01

Aim This study is aimed at developing a novel admixture-adjusted pharmacogenomic approach to individually refine warfarin dosing in Caribbean Hispanic patients. Patients & Methods A multiple linear regression analysis of effective warfarin doses versus relevant genotypes, admixture, clinical and demographic factors was performed in 255 patients and further validated externally in another cohort of 55 individuals. Results The admixture-adjusted, genotype-guided warfarin dosing refinement algorithm developed in Caribbean Hispanics showed better predictability (R2 = 0.70, MAE = 0.72mg/day) than a clinical algorithm that excluded genotypes and admixture (R2 = 0.60, MAE = 0.99mg/day), and outperformed two prior pharmacogenetic algorithms in predicting effective dose in this population. For patients at the highest risk of adverse events, 45.5% of the dose predictions using the developed pharmacogenetic model resulted in ideal dose as compared with only 29% when using the clinical non-genetic algorithm (pwarfarin dose variance when externally validated in 55 individuals from an independent validation cohort (MAE = 0.89 mg/day, 24% mean bias). Conclusions Results supported our rationale to incorporate individual’s genotypes and unique admixture metrics into pharmacogenetic refinement models in order to increase predictability when expanding them to admixed populations like Caribbean Hispanics. Trial Registration ClinicalTrials.gov NCT01318057 PMID:26745506

Refinement of the ferri and paramagnetic phases of magnetite measured by neutron multiple diffraction

International Nuclear Information System (INIS)

Mazzochi, V.L.; Parente, C.B.R.

1989-10-01

Structural parameters of the ferri and paramagnetic phases of magnetite have been refined from neutron multiple diffraction data. Experimental patterns were obtained by measuring the III primary reflection of a natural single crystal of this compound, at room temperature for the ferrimagnetic phase and 703 0 C for the paramagnetic phase. Theoretical multiple diffraction patterns for both phases have been calculated by the program MULTI which uses the iterative method. In this method intensities are caluclated as Taylor series expansions summed up to a order sufficient for a good approximation. A step by step process has been used in the refinements similarly to the parameter-shift method. Final values for the discrepancy factor found for the ferri and paramagnetic phases were R = 3.96% and R = 3.46%, respectively. (author) [pt

Adaptive mesh refinement for storm surge

KAUST Repository

Mandli, Kyle T.; Dawson, Clint N.

2014-01-01

An approach to utilizing adaptive mesh refinement algorithms for storm surge modeling is proposed. Currently numerical models exist that can resolve the details of coastal regions but are often too costly to be run in an ensemble forecasting framework without significant computing resources. The application of adaptive mesh refinement algorithms substantially lowers the computational cost of a storm surge model run while retaining much of the desired coastal resolution. The approach presented is implemented in the GeoClaw framework and compared to ADCIRC for Hurricane Ike along with observed tide gauge data and the computational cost of each model run. © 2014 Elsevier Ltd.

Adaptive mesh refinement for storm surge

KAUST Repository

Mandli, Kyle T.

2014-03-01

An approach to utilizing adaptive mesh refinement algorithms for storm surge modeling is proposed. Currently numerical models exist that can resolve the details of coastal regions but are often too costly to be run in an ensemble forecasting framework without significant computing resources. The application of adaptive mesh refinement algorithms substantially lowers the computational cost of a storm surge model run while retaining much of the desired coastal resolution. The approach presented is implemented in the GeoClaw framework and compared to ADCIRC for Hurricane Ike along with observed tide gauge data and the computational cost of each model run. © 2014 Elsevier Ltd.

Russian refining - an industry in transition

Energy Technology Data Exchange (ETDEWEB)

Barrett, E [CentreInvest, Moscow (Russian Federation)

1999-02-01

In the old Soviet Union (now called the CIS), the refining industry is undergoing much modernisation, although the process is far from complete. Eventually, the CIS is expected to have a market-responsive competitive refining business. The expected transformation is discussed according to a five-stage plan. The stages are (i) the change from horizontally integrated entity to vertically integrated global concerns, (ii) the change from over-manned dinosaurs to modern efficient businesses, (iii) the move towards smaller, more advanced market-orientated processes, (iv) improving the transport and storage infrastructures and (v) improving accountability and profitability. The predictions for 2005 onwards are for sustained profitability. (UK)

Variability-Specific Abstraction Refinement for Family-Based Model Checking

DEFF Research Database (Denmark)

Dimovski, Aleksandar; Wasowski, Andrzej

2017-01-01

and property, while the number of possible scenarios is very large. In this work, we present an automatic iterative abstraction refinement procedure for family-based model checking. We use Craig interpolation to refine abstract variational models based on the obtained spurious counterexamples (traces...

Zone refining of sintered, microwave-derived YBCO superconductors

International Nuclear Information System (INIS)

Warrier, K.G.K.; Varma, H.K.; Mani, T.V.; Damodaran, A.D.; Balachandran, U.

1993-07-01

Post-sintering treatments such as zone melting under thermal gradient has been conducted on sintered YBCO tape cast films. YBCO precursor powder was derived through decomposition of a mixture of nitrates of cations in a microwave oven for ∼4 min. The resulting powder was characterized and made into thin sheets by tape casting and then sintered at 945 C for 5 h. The sintered tapes were subjected to repeated zone refining operations at relatively high speeds of ∼30 mm/h. A microstructure having uniformly oriented grains in the a-b plane throughout the bulk of the sample was obtained by three repeated zone refining operations. Details of precursor preparation, microwave processing and its advantages, zone refining conditions, and microstructural features are presented in this paper

Oil refining and product marketing developments in southeast Asia

International Nuclear Information System (INIS)

Szabo, A.M.

1992-01-01

Views on the future are based on supplies from a relatively stable Middle East and continued economic growth in the southeast Asian and Pacific countries. Under these circumstances the oil market for the Association of Southeast Asian Nations (ASEAN) will expand considerably during the decade of the 90's. Pacific country demand, 5.92 MMB/D, in 1990 is likely to grow to 7.06 MMB/D in 2000. Regional production could supply about 40% of this. The Asia-Pacific shortage of refining capacity could lead to high regional refined product prices and health refining profit margins. (author)

Electromyogram refinement using muscle synergy based regulation of uncertain information.

Science.gov (United States)

Min, Kyuengbo; Shin, Duk; Lee, Jongho; Kakei, Shinji

2018-04-27

Electromyogram signal (EMG) measurement frequently experiences uncertainty attributed to issues caused by technical constraints such as cross talk and maximum voluntary contraction. Due to these problems, individual EMGs exhibit uncertainty in representing their corresponding muscle activations. To regulate this uncertainty, we proposed an EMG refinement, which refines EMGs with regulating the contribution redundancy of the signals from EMGs to approximating torques through EMG-driven torque estimation (EDTE) using the muscular skeletal forward dynamic model. To regulate this redundancy, we must consider the synergistic contribution redundancy of muscles, including "unmeasured" muscles, to approximating torques, which primarily causes redundancy of EDTE. To suppress this redundancy, we used the concept of muscle synergy, which is a key concept of analyzing the neurophysiological regulation of contribution redundancy of muscles to exerting torques. Based on this concept, we designed a muscle-synergy-based EDTE as a framework for EMG refinement, which regulates the abovementioned uncertainty of individual EMGs in consideration of unmeasured muscles. In achieving the proposed EMG refinement, the most considerable point is to suppress a large change such as overestimation attributed to enhancement of the contribution of particular muscles to estimating torques. Therefore it is reasonable to refine EMGs by minimizing the change in EMGs. To evaluate this model, we used a Bland-Altman plot, which quantitatively evaluates the proportional bias of refined signals to EMGs. Through this evaluation, we showed that the proposed EDTE minimizes the bias while approximating torques. Therefore this minimization optimally regulates the uncertainty of EMGs and thereby leads to optimal EMG refinement. Copyright © 2018 Elsevier Ltd. All rights reserved.

Decontamination of transuranic contaminated metals by melt refining

International Nuclear Information System (INIS)

Heshmatpour, B.; Copeland, G.L.; Heestand, R.L.

1983-01-01

Melt refining of transuranic contaminated metals is a possible decontamination process with the potential advantages of producing metal for reuse and of simplifying chemical analyses. By routinely achieving the 10 nCi/g( about0.1ppm) level by melt refining, scrap metal can be removed from the transuranic waste category. (To demonstrate the effectiveness of this melt refining process, mild steel, stainless steel, nickel, and copper were contaminated with 500 ppm (μg/g) PuO 2 and melted with various fluxes. The solidified slags and metals were analyzed for their plutonium contents, and corresponding partition ratios for plutonium were calculated. Some metals were double refined in order to study the effect of secondary slag treatment. The initial weight of the slags was also varied to investigate the effect of slag weight on the degree of plutonium removal. In general, all four metals could be decontaminated below 1 ppm (μg/g) Pu ( about100 nCi/g) by a single slag treatment. Doubling the slag weight did not improve decontamination significantly; however, double slag treatment using 5 wt.% slag did decontaminate the metals to below 0.1 ppm (μg/g) Pu (10 nCi/g).)

Role of manganese on the grain refining efficiency of AZ91D magnesium alloy refined by Al4C3

International Nuclear Information System (INIS)

Liu Shengfa; Zhang Yuan; Han Hui

2010-01-01

A novel Mg-50% Al 4 C 3 (hereafter in wt.%) master alloy has been developed by powder in situ synthesis process, the role of manganese on the grain refining efficiency of AZ91D magnesium alloy refined by this master alloy has been investigated. X-ray diffraction (XRD) and energy dispersive X-ray spectroscopy (EDS) results show the existence of Al 4 C 3 particles in this master alloy. After addition of 0.6% Al 4 C 3 or combined addition of 0.6% Al 4 C 3 and 0.27% Mn, the average grain size of AZ91D decreased dramatically from 360 μm to 210 μm, and from 360 μm to130 μm, respectively. However, no further refinement of grain size was achieved with additional amount of Mn exceeding 0.27% for AZ91D alloy refined by 0.6% Al 4 C 3 in the present investigation. Al-C-O-Mn-Fe-rich intermetallic particles with an Al-C-O-rich coating film, often observed in the central region of magnesium grains of the AZ91D alloy treated by the combination of Al 4 C 3 and Mn, are proposed to be the potent nucleating substrates for primary α-Mg.

On R factors for dynamic structure crystallography

DEFF Research Database (Denmark)

Coppens, Philip; Kaminski, Radoslaw; Schmøkel, Mette Stokkebro

2010-01-01

In studies of dynamic changes in crystals in which induced metastable species may have lifetimes of microseconds or less, refinements are most sensitive if based on the changes induced in the measured intensities. Agreement factors appropriate for such refinements, based on the ratios of the inte...... of the intensities before and after the external perturbation is applied, are discussed and compared with R factors commonly applied in static structure crystallography....

Micromechanisms of grain refinement during extrusion of Mg-0.3 at.% Al at low homologous temperature

Czech Academy of Sciences Publication Activity Database

Jäger, Aleš; Gärtnerová, Viera; Mukai, T.

2014-01-01

Roč. 93, Jul (2014), s. 102-109 ISSN 1044-5803 R&D Projects: GA ČR GBP108/12/G043 Institutional support: RVO:68378271 Keywords : magnesium * extrusion * dynamic recrystallization * EBSD * grain refinement * bimodal structure Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.845, year: 2014

40 CFR 80.555 - What provisions are available to a large refiner that acquires a small refiner or one or more of...

Science.gov (United States)

2010-07-01

... FUELS AND FUEL ADDITIVES Motor Vehicle Diesel Fuel; Nonroad, Locomotive, and Marine Diesel Fuel; and ECA... May 31, 2010 for a refinery acquired from a motor vehicle diesel fuel small refiner or beyond the... motor vehicle diesel fuel small refiner or beyond the dates specified in § 80.554(a) or (b), as...

Creating a simplified model of oil refining and solution of the model using a linear programming method. Part 1, Model presentation

Energy Technology Data Exchange (ETDEWEB)

Duric, M; Novakovic, M; Stojkanovic, L

1983-01-01

Based on a detailed analysis of technological limitations in oil refining at an oil refinery (NPZ) in the separation of petroleum products, specifications with regard to quality and market limitations, a general model is created of oil refining. The number of actual variables is reduced to a minimum, while the number of linear limitations is adapted to the selected technology and raw material quality. The nonlinearity of certain characteristics is overcome using the so called movement factor.

The Influence of Grain Refiners on the Efficiency of Ceramic Foam Filters

Science.gov (United States)

Towsey, Nicholas; Schneider, Wolfgang; Krug, Hans-Peter; Hardman, Angela; Keegan, Neil J.

An extensive program of work has been carried out to evaluate the efficiency of ceramic foam filters under carefully controlled conditions. Work reported at previous TMS meetings showed that in the absence of grain refiners, ceramic foam filters have the capacity for high filtration efficiency and consistent, reliable performance. The current phase of the investigation focuses on the impact grain refiner additions have on filter performance. The high filtration efficiencies obtained using 50 or 80ppi CFF's in the absence of grain refiners diminish when Al-3%Ti-1%B grain refiners are added. This, together with the impact of incoming inclusion loading on filter performance and the level of grain refiner addition are considered in detail. The new generation Al-3%Ti-0.15%C grain refiner has also been included. At typical addition levels (1kg/tonne) the effect on filter efficiency is similar to that for TiB2based grain refiners. The work was again conducted on a production scale using AA1050 alloy. Metal quality was determined using LiMCA and PoDFA. Spent filters were also analysed.

Strategic issues and implications for the refining and marketing sector

International Nuclear Information System (INIS)

Jeffe, R.A.

1995-01-01

Refiners have faced a challenging business environment for the past decade. During this period, the industry has made approximately $25 billion of capital expenditures primarily to comply with increased governmental mandates, faced highly volatile petroleum product prices and garnered a return to equity of only 5%. While worldwide and US refining capacity has been flat in recent years, demand for refined petroleum products has been on the upswing and domestic supplies have also increased due to improved US capacity utilization rates (76% in 1984 and 93% in 1994) and increased imports (gasoline sales up 11% since 1984). The result has been highly volatile and generally weak refining margins (net Gulf Coast crack spread ranging from ($.95)/bbl in 1984 to $1.84/bbl in 1990 and averaging $.81/bbl since 1984). In response to the sustained difficulties in the marketplace, one has recently witnessed some strategic realignment in the industry. Several of the integrated companies, frustrated with the required capital expenditures and meager returns, have decided to shed non-core, non-strategic refining assets. For the most part, these assets have been bought by independents at, by historical measures, very attractive terms. This paper will provide an overview of the economics of the refining business, discuss the recent trends in refinery M and A activity and summarize possible implications of the recent strategic realignment

Formal refinement of extended state machines

Directory of Open Access Journals (Sweden)

Thomas Fayolle

2016-06-01

Full Text Available In a traditional formal development process, e.g. using the B method, the informal user requirements are (manually translated into a global abstract formal specification. This translation is especially difficult to achieve. The Event-B method was developed to incrementally and formally construct such a specification using stepwise refinement. Each increment takes into account new properties and system aspects. In this paper, we propose to couple a graphical notation called Algebraic State-Transition Diagrams (ASTD with an Event-B specification in order to provide a better understanding of the software behaviour. The dynamic behaviour is captured by the ASTD, which is based on automata and process algebra operators, while the data model is described by means of an Event-B specification. We propose a methodology to incrementally refine such specification couplings, taking into account new refinement relations and consistency conditions between the control specification and the data specification. We compare the specifications obtained using each approach for readability and proof complexity. The advantages and drawbacks of the traditional approach and of our methodology are discussed. The whole process is illustrated by a railway CBTC-like case study. Our approach is supported by tools for translating ASTD's into B and Event-B into B.

Mirror of the refined topological vertex from a matrix model

CERN Document Server

Eynard, B

2011-01-01

We find an explicit matrix model computing the refined topological vertex, starting from its representation in terms of plane partitions. We then find the spectral curve of that matrix model, and thus the mirror symmetry of the refined vertex. With the same method we also find a matrix model for the strip geometry, and we find its mirror curve. The fact that there is a matrix model shows that the refined topological string amplitudes also satisfy the remodeling the B-model construction.

Effect of Chemical Refining on Citrullus Colocynthis and Pongamia ...

African Journals Online (AJOL)

Oil from the both plant seeds was evaluated (both before and after refining) for different physico-chemical parameters like free fatty acids, iodine value, peroxide value, saponification value, unsaponifiable matter and fatty acid composition. Oil yield (30-35 %) in both plants was found average. After refining, per cent reduction ...

Whether integrating refining and petrochemical business can provide opportunities for development of petrochemical industry in Serbia

Directory of Open Access Journals (Sweden)

Popović Zoran M.

2016-01-01

Full Text Available Since the beginning of 90s of last century both the petroleum industry and petrochemical industry have operated in difficult circumstances. In particularly, margins of petroleum and petrochemical industry were exacerbated during global economic crisis in 2008-2009 years. At that time, as one option that could be the solution, the global analysts had started to more intense investigate the benefits of Refining-Petrochemical Integration. Shortly afterwards, more and more petroleum refineries and petrochemical manufacturers began to see the future in this kind of operational, managerial, marketing and commercial connection. This paper evaluates, in particular, the achieved level of integration of refinery and petrochemical businesses in Central and South-Eastern Europe. And specifically, the paper identifies current capabilities and future chances of linking this kind of integration between Serbian refining and petrochemical players. The viability of integration between possible actors and benefits of every single refining-petrochemical interface in Serbia depend on many factors, and therefore each integrated system is unique and requires prior serious Cost Benefit Analysis.

Linkages between the markets for crude oil and the markets for refined products

International Nuclear Information System (INIS)

Didziulis, V.S.

1990-01-01

To understand the crude oil price determination process it is necessary to extend the analysis beyond the markets for petroleum. Crude oil prices are determined in two closely related markets: the markets for crude oil and the markets for refined products. An econometric-linear programming model was developed to capture the linkages between the markets for crude oil and refined products. In the LP refiners maximize profits given crude oil supplies, refining capacities, and prices of refined products. The objective function is profit maximization net of crude oil prices. The shadow price on crude oil gives the netback price. Refined product prices are obtained from the econometric models. The model covers the free world divided in five regions. The model is used to analyze the impacts on the markets of policies that affect crude oil supplies, the demands for refined products, and the refining industry. For each scenario analyzed the demand for crude oil is derived from the equilibrium conditions in the markets for products. The demand curve is confronted with a supply curve which maximizes revenues providing an equilibrium solution for both crude oil and product markets. The model also captures crude oil price differentials by quality. The results show that the demands for crude oil are different across regions due to the structure of the refining industries and the characteristics of the demands for refined products. Changes in the demands for products have a larger impact on the markets than changes in the refining industry. Since markets for refined products and crude oil are interrelated they can't be analyzed individually if an accurate and complete assessment of a policy is to be made. Changes in only one product market in one region affect the other product markets and the prices of crude oil

Refined analysis results for multimedia network costs and profits

DEFF Research Database (Denmark)

Tahkokorpi, M.; Falch, Morten; Skouby, Knud Erik

This deliverable describes the techno-economic business model developed in EURORIM WP3 and presents the refined results of the multimedia service delivery cost-profit calculations......This deliverable describes the techno-economic business model developed in EURORIM WP3 and presents the refined results of the multimedia service delivery cost-profit calculations...

Refining and petrochemicals

International Nuclear Information System (INIS)

Benazzi, E.

2003-01-01

Down sharply in 2002, refining margins showed a clear improvement in the first half-year of 2003. As a result, the earnings reported by oil companies for financial year 2002 were significantly lower than in 2001, but the prospects are brighter for 2003. In the petrochemicals sector, slow demand and higher feedstock prices eroded margins in 2002, especially in Europe and the United States. The financial results for the first part of 2003 seem to indicate that sector profitability will not improve before 2004. (author)

Refining of biodiesel by ceramic membrane separation

Energy Technology Data Exchange (ETDEWEB)

Wang, Yong; Ou, Shiyi; Tan, Yanlai; Tang, Shuze [Department of Food Science and Engineering, Jinan University, Guangzhou 510632 (China); Wang, Xingguo; Liu, Yuanfa [School of Food Science and Technology, Jiangnan University, Wuxi 214112 (China)

2009-03-15

A ceramic membrane separation process for biodiesel refining was developed to reduce the considerable usage of water needed in the conventional water washing process. Crude biodiesel produced by refined palm oil was micro-filtered by ceramic membranes of the pore size of 0.6, 0.2 and 0.1 {mu}m to remove the residual soap and free glycerol, at the transmembrane pressure of 0.15 MPa and temperature of 60 C. The flux through membrane maintained at 300 L m{sup -} {sup 2} h{sup -} {sup 1} when the volumetric concentrated ratio reached 4. The content of potassium, sodium, calcium and magnesium in the whole permeate was 1.40, 1.78, 0.81 and 0.20 mg/kg respectively, as determined by inductively coupled plasma-atomic emission spectroscopy. These values are lower than the EN 14538 specifications. The residual free glycerol in the permeate was estimated by water extraction, its value was 0.0108 wt.%. This ceramic membrane technology was a potential environmental process for the refining of biodiesel. (author)

Production of Al-Ti-C grain refiners with the addition of elemental carbon

International Nuclear Information System (INIS)

Gezer, Berke Turgay; Toptan, Fatih; Daglilar, Sibel; Kerti, Isil

2010-01-01

Grain refining process used in aluminium alloys, has an important role for preventing columnar, coarse grains and encouraging fine, equiaxed grain formation. Al-Ti-B grain refiners are widely used as aluminium grain refiners despite the problems in application Al-Ti-C refiners have an increasing demand in recent years. In the present work, Al-Ti-C grain refiners with different Ti:C ratios were produced by insitu method with the addition of elemental carbon. Microstructures were characterised by optic microscope and scanning electron microscope equipped with energy dispersive spectroscopy. The effects of temperature, holding time and Ti:C ratio on the grain refinement process were investigated and optimum conditions were determined.

European oil refining: strategies for a competitive future

International Nuclear Information System (INIS)

MacDonald, James.

1997-07-01

European Oil Refining investigates how the industry came to be in crisis and what the future holds. As well as an extensive analysis of past and present market shifts, the report predicts likely future developments and their consequences for investors. The report reviews the European oil sector in a global context, calculates the cost to refiners of key environmental legislation, assesses the problems caused by changing product demand and crude supply, examines possible solutions to the problems of low margins and overcapacity, evaluates the key players' main strategies to increase their competitiveness, analyses the western European oil refining industry by country, details the refinery operations of the major countries of central and eastern Europe, profiles 15 of the major oil companies and estimates the increase in investment required as a result of legislative and demand changes. (author)

Current research progress in grain refinement of cast magnesium alloys: A review article

International Nuclear Information System (INIS)

Ali, Yahia; Qiu, Dong; Jiang, Bin; Pan, Fusheng; Zhang, Ming-Xing

2015-01-01

Grain refinement of cast magnesium alloys, particularly in magnesium–aluminium (Mg–Al) based alloys, has been an active research topic in the past two decades, because it has been considered as one of the most effective approaches to simultaneously increase the strength, ductility and formability. The development of new grain refiners was normally based on the theories/models that were established through comprehensive and considerable studies of grain refinement in cast Al alloys. Generally, grain refinement in cast Al can be achieved through either inoculation treatment, which is a process of adding, or in situ forming, foreign particles to promote heterogeneous nucleation rate, or restricting grain growth by controlling the constitutional supercooling or both. But, the concrete and tangible grain refinement mechanism in cast metals is still not fully understood and there are a number of controversies. Therefore, most of the new developed grain refiners for Mg–Al based alloys are not as efficient as the commercially available ones, such as zirconium in non-Al containing Mg alloys. To facilitate the research in grain refinement of cast magnesium alloys, this review starts with highlighting the theoretical aspects of grain refinement in cast metals, followed by reviewing the latest research progress in grain refinement of magnesium alloys in terms of the solute effect and potent nucleants

Current research progress in grain refinement of cast magnesium alloys: A review article

Energy Technology Data Exchange (ETDEWEB)

Ali, Yahia; Qiu, Dong [School of Mechanical and Mining Engineering, University of Queensland, St Lucia, QLD 4072 (Australia); Jiang, Bin; Pan, Fusheng [College of Materials Science and Engineering, Chongqing University, Chongqing 400030 (China); Zhang, Ming-Xing, E-mail: Mingxing.Zhang@uq.edu.au [School of Mechanical and Mining Engineering, University of Queensland, St Lucia, QLD 4072 (Australia)

2015-01-15

Grain refinement of cast magnesium alloys, particularly in magnesium–aluminium (Mg–Al) based alloys, has been an active research topic in the past two decades, because it has been considered as one of the most effective approaches to simultaneously increase the strength, ductility and formability. The development of new grain refiners was normally based on the theories/models that were established through comprehensive and considerable studies of grain refinement in cast Al alloys. Generally, grain refinement in cast Al can be achieved through either inoculation treatment, which is a process of adding, or in situ forming, foreign particles to promote heterogeneous nucleation rate, or restricting grain growth by controlling the constitutional supercooling or both. But, the concrete and tangible grain refinement mechanism in cast metals is still not fully understood and there are a number of controversies. Therefore, most of the new developed grain refiners for Mg–Al based alloys are not as efficient as the commercially available ones, such as zirconium in non-Al containing Mg alloys. To facilitate the research in grain refinement of cast magnesium alloys, this review starts with highlighting the theoretical aspects of grain refinement in cast metals, followed by reviewing the latest research progress in grain refinement of magnesium alloys in terms of the solute effect and potent nucleants.

Concentration factors of radionuclides in the marine organisms

International Nuclear Information System (INIS)

1996-03-01

Parameters related to the bioconcentration of radionuclides in the marine were shown by 'Assessment and guideline to the target value of dose in the environment of the power light water reactor facilities' (Nuclear Safety Commission), but the guideline data did not contain Ru and Ce relating to the reprocessing plant. So that more new data than these of 'Technical Reports Series No. 247' (published by IAEA in 1985) were mainly collected. Especially the data of nuclides with poor data of concentration factors (CF) and natural radionuclides (Po-210, Pb-210) were gathered. These data were pigeonholed and many tables (element, kinds of organisms, experimental methods) were made by separating the general remarks from the original experimental reports. The contents of this report are given as under, history of concentration factor (CF), determination method of CF, CF calculation method, calculation models related to CF, tables of metabolic parameters, tables of CF, the present conditions of studies for uptake of radionuclides with long half-life into the marine organisms, CF abstract tables and trial calculation of human exposure by eating the marine organisms. (S.Y.)

A Novel Admixture-Based Pharmacogenetic Approach to Refine Warfarin Dosing in Caribbean Hispanics.

Directory of Open Access Journals (Sweden)

Jorge Duconge

Full Text Available This study is aimed at developing a novel admixture-adjusted pharmacogenomic approach to individually refine warfarin dosing in Caribbean Hispanic patients.A multiple linear regression analysis of effective warfarin doses versus relevant genotypes, admixture, clinical and demographic factors was performed in 255 patients and further validated externally in another cohort of 55 individuals.The admixture-adjusted, genotype-guided warfarin dosing refinement algorithm developed in Caribbean Hispanics showed better predictability (R2 = 0.70, MAE = 0.72mg/day than a clinical algorithm that excluded genotypes and admixture (R2 = 0.60, MAE = 0.99mg/day, and outperformed two prior pharmacogenetic algorithms in predicting effective dose in this population. For patients at the highest risk of adverse events, 45.5% of the dose predictions using the developed pharmacogenetic model resulted in ideal dose as compared with only 29% when using the clinical non-genetic algorithm (p<0.001. The admixture-driven pharmacogenetic algorithm predicted 58% of warfarin dose variance when externally validated in 55 individuals from an independent validation cohort (MAE = 0.89 mg/day, 24% mean bias.Results supported our rationale to incorporate individual's genotypes and unique admixture metrics into pharmacogenetic refinement models in order to increase predictability when expanding them to admixed populations like Caribbean Hispanics.ClinicalTrials.gov NCT01318057.

Analysis model for forecasting extreme temperature using refined rank set pair

Directory of Open Access Journals (Sweden)

Qiao Ling-Xia

2013-01-01

Full Text Available In order to improve the precision of forecasting extreme temperature time series, a refined rank set pair analysis model with a refined rank transformation function is proposed to improve precision of its prediction. The measured values of the annual highest temperature of two China’s cities, Taiyuan and Shijiazhuang, in July are taken to examine the performance of a refined rank set pair model.

Periodic depuration of anthracene metabolites by rainbow trout

International Nuclear Information System (INIS)

Linder, G.; Bergman, H.L.

1984-01-01

Rainbow trout Salmo gairdneri, statically exposed to 36 μg/liter anthracene (including 9- 14 C-C anthracene), bioconcentrated the polynuclear aromatic hydrocarbon 200 times the exposure concentration over 18 hours. Then, during a 96-hour clearance periods, mass-balance analysis of fish and water samples indicated that anthracene was rapidly converted to polar metabolites(s), then eliminated periodically. Maximum depuration occurred during the dark phase of a 16-hour-light: 8-hour-dark photocycle. Of the 2-3% contribution of 14 C metabolites(s) to the total 14 C residue, nearly half came from the bile. This periodic depuration may be circadian, although this requires confirmation by further work; to the extent it affects metabolic fate of bioconcentrated organics, periodic depuration undoubtedly contributes to differences between predicted and observed bioconcentration factors

Potency of high-intensity ultrasonic treatment for grain refinement of magnesium alloys

International Nuclear Information System (INIS)

Ramirez, A.; Qian Ma; Davis, B.; Wilks, T.; StJohn, D.H.

2008-01-01

High-intensity ultrasonic treatment (UT) for grain refinement of magnesium alloys has been investigated using a novel theoretical approach in order to better understand its grain-refining potential and the mechanism of nucleation. The process demonstrated significantly superior grain-refining potency to carbon inoculation for Al-containing magnesium alloys but inferior potency to zirconium for Al-free alloys. Details revealed by applying the theoretical approach to ultrasonic grain refinement provide new clues to understanding the mechanism of grain nucleation by UT

Trends in heavy oil production and refining in California

International Nuclear Information System (INIS)

Olsen, D.K.; Ramzel, E.B.; Pendergrass, R.A. II.

1992-07-01

This report is one of a series of publications assessing the feasibility of increasing domestic heavy oil production and is part of a study being conducted for the US Department of Energy. This report summarizes trends in oil production and refining in Canada. Heavy oil (10 degrees to 20 degrees API gravity) production in California has increased from 20% of the state's total oil production in the early 1940s to 70% in the late 1980s. In each of the three principal petroleum producing districts (Los Angeles Basin, Coastal Basin, and San Joaquin Valley) oil production has peaked then declined at different times throughout the past 30 years. Thermal production of heavy oil has contributed to making California the largest producer of oil by enhanced oil recovery processes in spite of low oil prices for heavy oil and stringent environmental regulation. Opening of Naval Petroleum Reserve No. 1, Elk Hills (CA) field in 1976, brought about a major new source of light oil at a time when light oil production had greatly declined. Although California is a major petroleum-consuming state, in 1989 the state used 13.3 billion gallons of gasoline or 11.5% of US demand but it contributed substantially to the Nation's energy production and refining capability. California is the recipient and refines most of Alaska's 1.7 million barrel per day oil production. With California production, Alaskan oil, and imports brought into California for refining, California has an excess of oil and refined products and is a net exporter to other states. The local surplus of oil inhibits exploitation of California heavy oil resources even though the heavy oil resources exist. Transportation, refining, and competition in the market limit full development of California heavy oil resources

Fetching and Parsing Data from the Web with OpenRefine

Directory of Open Access Journals (Sweden)

Evan Peter Williamson

2017-08-01

Full Text Available OpenRefine is a powerful tool for exploring, cleaning, and transforming data. An earlier Programming Historian lesson, “Cleaning Data with OpenRefine”, introduced the basic functionality of Refine to efficiently discover and correct inconsistency in a data set. Building on those essential data wrangling skills, this lesson focuses on Refine’s ability to fetch URLs and parse web content. Examples introduce some of the advanced features to transform and enhance a data set including: - fetch URLs using Refine - construct URL queries to retrieve information from a simple web API - parse HTML and JSON responses to extract relevant data - use array functions to manipulate string values - use Jython to extend Refine’s functionality It will be helpful to have basic familiarity with OpenRefine, HTML, and programming concepts such as variables and loops to complete this lesson.

Genomic multiple sequence alignments: refinement using a genetic algorithm

Directory of Open Access Journals (Sweden)

Lefkowitz Elliot J

2005-08-01

Full Text Available Abstract Background Genomic sequence data cannot be fully appreciated in isolation. Comparative genomics – the practice of comparing genomic sequences from different species – plays an increasingly important role in understanding the genotypic differences between species that result in phenotypic differences as well as in revealing patterns of evolutionary relationships. One of the major challenges in comparative genomics is producing a high-quality alignment between two or more related genomic sequences. In recent years, a number of tools have been developed for aligning large genomic sequences. Most utilize heuristic strategies to identify a series of strong sequence similarities, which are then used as anchors to align the regions between the anchor points. The resulting alignment is globally correct, but in many cases is suboptimal locally. We describe a new program, GenAlignRefine, which improves the overall quality of global multiple alignments by using a genetic algorithm to improve local regions of alignment. Regions of low quality are identified, realigned using the program T-Coffee, and then refined using a genetic algorithm. Because a better COFFEE (Consistency based Objective Function For alignmEnt Evaluation score generally reflects greater alignment quality, the algorithm searches for an alignment that yields a better COFFEE score. To improve the intrinsic slowness of the genetic algorithm, GenAlignRefine was implemented as a parallel, cluster-based program. Results We tested the GenAlignRefine algorithm by running it on a Linux cluster to refine sequences from a simulation, as well as refine a multiple alignment of 15 Orthopoxvirus genomic sequences approximately 260,000 nucleotides in length that initially had been aligned by Multi-LAGAN. It took approximately 150 minutes for a 40-processor Linux cluster to optimize some 200 fuzzy (poorly aligned regions of the orthopoxvirus alignment. Overall sequence identity increased only

Need for refining capacity creates opportunities for producers in Middle East

International Nuclear Information System (INIS)

Ali, M.S.S.

1994-01-01

Oil industry interest in refining has revived in the past few years in response to rising oil consumption. The trend creates opportunities, for countries in the Middle East, which do not own refining assets nearly in proportion to their crude oil reserved. By closing this gap between reserves and refining capacity, the countries can ease some of the instability now characteristic of the oil market. Some major oil producing countries have begun to move downstream. During the 1980s, Venezuela, Kuwait, Saudi Arabia, Libya, and other members of the Organization of Petroleum Exporting Countries acquired refining assets through direct total purchase or joint ventures. Nevertheless, the oil industry remains largely unintegrated, with the Middle East holding two thirds of worldwide oil reserves but only a small share downstream. As worldwide refining capacity swings from a period of surplus toward one in which the need for new capacity will be built. The paper discusses background of the situation, shrinking surplus, investment requirements, sources of capital, and shipping concerns

A grid-enabled web service for low-resolution crystal structure refinement.

Science.gov (United States)

O'Donovan, Daniel J; Stokes-Rees, Ian; Nam, Yunsun; Blacklow, Stephen C; Schröder, Gunnar F; Brunger, Axel T; Sliz, Piotr

2012-03-01

Deformable elastic network (DEN) restraints have proved to be a powerful tool for refining structures from low-resolution X-ray crystallographic data sets. Unfortunately, optimal refinement using DEN restraints requires extensive calculations and is often hindered by a lack of access to sufficient computational resources. The DEN web service presented here intends to provide structural biologists with access to resources for running computationally intensive DEN refinements in parallel on the Open Science Grid, the US cyberinfrastructure. Access to the grid is provided through a simple and intuitive web interface integrated into the SBGrid Science Portal. Using this portal, refinements combined with full parameter optimization that would take many thousands of hours on standard computational resources can now be completed in several hours. An example of the successful application of DEN restraints to the human Notch1 transcriptional complex using the grid resource, and summaries of all submitted refinements, are presented as justification.

Tri-Clustered Tensor Completion for Social-Aware Image Tag Refinement.

Science.gov (United States)

Tang, Jinhui; Shu, Xiangbo; Qi, Guo-Jun; Li, Zechao; Wang, Meng; Yan, Shuicheng; Jain, Ramesh

2017-08-01

Social image tag refinement, which aims to improve tag quality by automatically completing the missing tags and rectifying the noise-corrupted ones, is an essential component for social image search. Conventional approaches mainly focus on exploring the visual and tag information, without considering the user information, which often reveals important hints on the (in)correct tags of social images. Towards this end, we propose a novel tri-clustered tensor completion framework to collaboratively explore these three kinds of information to improve the performance of social image tag refinement. Specifically, the inter-relations among users, images and tags are modeled by a tensor, and the intra-relations between users, images and tags are explored by three regularizations respectively. To address the challenges of the super-sparse and large-scale tensor factorization that demands expensive computing and memory cost, we propose a novel tri-clustering method to divide the tensor into a certain number of sub-tensors by simultaneously clustering users, images and tags into a bunch of tri-clusters. And then we investigate two strategies to complete these sub-tensors by considering (in)dependence between the sub-tensors. Experimental results on a real-world social image database demonstrate the superiority of the proposed method compared with the state-of-the-art methods.

Refining and petrochemicals

International Nuclear Information System (INIS)

Benazzi, E.; Alario, F.

2004-01-01

In 2003, refining margins showed a clear improvement that continued throughout the first three quarters of 2004. Oil companies posted significantly higher earnings in 2003 compared to 2002, with the results of first quarter 2004 confirming this trend. Due to higher feedstock prices, the implementation of new capacity and more intense competition, the petrochemicals industry was not able to boost margins in 2003. In such difficult business conditions, aggravated by soaring crude prices, the petrochemicals industry is not likely to see any improvement in profitability before the second half of 2004. (author)

Initiating technical refinements in high-level golfers: Evidence for contradictory procedures.

Science.gov (United States)

Carson, Howie J; Collins, Dave; Richards, Jim

2016-01-01

When developing motor skills there are several outcomes available to an athlete depending on their skill status and needs. Whereas the skill acquisition and performance literature is abundant, an under-researched outcome relates to the refinement of already acquired and well-established skills. Contrary to current recommendations for athletes to employ an external focus of attention and a representative practice design,  Carson and  Collins' (2011) [Refining and regaining skills in fixation/diversification stage performers: The Five-A Model. International Review of Sport and Exercise Psychology, 4, 146-167. doi: 10.1080/1750984x.2011.613682 ] Five-A Model requires an initial narrowed internal focus on the technical aspect needing refinement: the implication being that environments which limit external sources of information would be beneficial to achieving this task. Therefore, the purpose of this paper was to (1) provide a literature-based explanation for why techniques counter to current recommendations may be (temporarily) appropriate within the skill refinement process and (2) provide empirical evidence for such efficacy. Kinematic data and self-perception reports are provided from high-level golfers attempting to consciously initiate technical refinements while executing shots onto a driving range and into a close proximity net (i.e. with limited knowledge of results). It was hypothesised that greater control over intended refinements would occur when environmental stimuli were reduced in the most unrepresentative practice condition (i.e. hitting into a net). Results confirmed this, as evidenced by reduced intra-individual movement variability for all participants' individual refinements, despite little or no difference in mental effort reported. This research offers coaches guidance when working with performers who may find conscious recall difficult during the skill refinement process.

Grain refinement through severe plastic deformation (SPD) processing

International Nuclear Information System (INIS)

Izairi, N.; Vevecka - Priftaj, A.

2012-01-01

There is considerable current interest in processing metallic samples through procedures involving the imposition of severe plastic deformation (SPD). These procedures lead to very significant grain refinement to the submicrometer or even the nanometer level, resulting in advanced physical properties. Among various SPD processes, Equal Channel Angular Pressing, High pressure Torsion and Accumulated Roll Bonding have been widely used for many metals and alloys. In the present work, we present an overview of the most used methods of SPD for grain refinement and the production of bulk nano structured materials with enhancement in their mechanical and functional properties. In order to examine the potential for using ECAP to refine the grain size and improve the mechanical properties, two commercial 5754 Al alloy and AA 3004 , were selected for study. Processing by ECAP gives a reduction in the grain size and an increase in the microhardness. (Author)

Future prospects for palm oil refining and modifications

Directory of Open Access Journals (Sweden)

Gibon Véronique

2009-07-01

Full Text Available Palm oil is rich in minor components that impart unique nutritional properties and need to be preserved. In this context, refining technologies have been improved, with the dual temperature deodorizer, the double condensing unit and the ice condensing system. The DOBI is a good tool to assess quality of the crude palm oil and its ability to be properly refined. Specially refined oils open a market for new high quality products (golden palm oil, red palm oil, white soaps, etc.. Palm oil is a good candidate for the multi-step dry fractionation process, aiming to the production of commodity oils and specialty fats (cocoa butter replacers. New technological developments allow quality and yield improvements. Palm oil and fractions are also valuable feedstock for enzymatic interesterification in which applications are for commodity oil (low-trans margarines and shortenings and for special products (cocoa butter equivalents, infant formulation, ….

Unilever food safety assurance system for refined vegetable oils and fats

Directory of Open Access Journals (Sweden)

van Duijn Gerrit

2010-03-01

Full Text Available The Unilever Food Safety Assurance system for refined oils and fats is based on risk assessments for the presence of contaminants or pesticide residues in crude oils, and refining process studies to validate the removal of these components. Crude oil risk assessments were carried out by combining supply chain visits, and analyses of the contaminant and pesticide residue levels in a large number of crude oil samples. Contaminants like poly-aromatic hydrocarbons and hydrocarbons of mineral origin, and pesticide residues can largely be removed by refining. For many years, this Food Safety Assurance System has proven to be effective in controlling contaminant levels in refined vegetable oils and fats.

Structure of Insulin: Results of joint neutron and X-ray refinement

Energy Technology Data Exchange (ETDEWEB)

Wlodawer, A; Savage, H; Dodson, G

1989-02-01

Neutron diffraction data for porcine 2Zn insulin were collected to 2.2 A resolution from a single crystal deuterated by slow exchange of mother liquor. A joint neutron/X-ray restrained-least-squares refinement was undertaken using the neutron data, as well as the 1.5 A resolution X-ray data collected previously. The final R factors were 0.182 for the X-ray data and 0.191 for the neutron data. Resulting atomic coordinates were compared with the initial X-ray model, showing a total r.m.s. shift of 0.36 A for the protein and 0.6 A for the solvent. Protonation of a number of individual amino acids was investigated by analysis of the neutron maps. No D atoms were found between the carboxylates of Glu B13 which make an intermolecular contact, suggesting nonbonded interaction rather than the predicted hydrogen bond. Amide hydrogen exchange was investigated in a refinement of their atomic occupancies. Regions of unexchanged amide groups were found in the center of the B helices. The results of this study emphasize the limited amount of information available in neutron diffraction studies of proteins at resolution lower than 2 A.

Hirshfeld atom refinement for modelling strong hydrogen bonds.

Science.gov (United States)

Woińska, Magdalena; Jayatilaka, Dylan; Spackman, Mark A; Edwards, Alison J; Dominiak, Paulina M; Woźniak, Krzysztof; Nishibori, Eiji; Sugimoto, Kunihisa; Grabowsky, Simon

2014-09-01

High-resolution low-temperature synchrotron X-ray diffraction data of the salt L-phenylalaninium hydrogen maleate are used to test the new automated iterative Hirshfeld atom refinement (HAR) procedure for the modelling of strong hydrogen bonds. The HAR models used present the first examples of Z' > 1 treatments in the framework of wavefunction-based refinement methods. L-Phenylalaninium hydrogen maleate exhibits several hydrogen bonds in its crystal structure, of which the shortest and the most challenging to model is the O-H...O intramolecular hydrogen bond present in the hydrogen maleate anion (O...O distance is about 2.41 Å). In particular, the reconstruction of the electron density in the hydrogen maleate moiety and the determination of hydrogen-atom properties [positions, bond distances and anisotropic displacement parameters (ADPs)] are the focus of the study. For comparison to the HAR results, different spherical (independent atom model, IAM) and aspherical (free multipole model, MM; transferable aspherical atom model, TAAM) X-ray refinement techniques as well as results from a low-temperature neutron-diffraction experiment are employed. Hydrogen-atom ADPs are furthermore compared to those derived from a TLS/rigid-body (SHADE) treatment of the X-ray structures. The reference neutron-diffraction experiment reveals a truly symmetric hydrogen bond in the hydrogen maleate anion. Only with HAR is it possible to freely refine hydrogen-atom positions and ADPs from the X-ray data, which leads to the best electron-density model and the closest agreement with the structural parameters derived from the neutron-diffraction experiment, e.g. the symmetric hydrogen position can be reproduced. The multipole-based refinement techniques (MM and TAAM) yield slightly asymmetric positions, whereas the IAM yields a significantly asymmetric position.

Oil price scenarios and refining profitability

International Nuclear Information System (INIS)

Sweeney, B.

1993-01-01

Currently refining profitability is low because there has been an overbuilding of conversion capacity in Western Europe in the last round. Oil marketing, the chemicals business and the fundamental economy itself are at low points in their cycles which have not coincided, at least in the UK, since 1975. Against that gloomy background, it is predicted that downstream profitability will recover in the mid-1990s. Crude oil prices will remain low until the call on OPEC crude increases again and takes up the capacity which has been brought on stream in response to the Gulf War. When this happens, it is likely to trigger another price spike and another round of investment in production capacity. Environmentally driven investments in desulphurisation or emissions reduction will be poorly remunerated all the way through the value chain. Refining margins will recover when white oil demand growth tightens up the need for conversion capacity. Marketing will need to reduce the retail network overcapacity in the mature markets if it is to improve its profitability. In this period of low profitability, even with the light at the end of the tunnel for refiners in the middle of the decade, the industry structure is under threat. There is a strong argument for new modes of competitive behaviour which are backed by strong elements of cooperation. (author)

Influences of different degassing processes on refining effect and properties of 4004 Al alloy

Directory of Open Access Journals (Sweden)

Wang Liping

2013-03-01

Full Text Available In order to improve the plasticity of 4004 Al alloy and subsequently the productivity of 4004 Al foil, the research studied in detail the influence of the rotary impeller degassing process on the refining effect of 4004 Al alloy, in which the impacts of four major parameters: gas flow, rotational speed, refining time, and stewing time, on degassing rate of 4004 Al alloy was systematically studied by using an orthogonal experiment methodology. Results show that the rotational speed has the greatest impact on the degassing of 4004 Al alloy, followed by gas flow and refining time; stewing time has the least impact. The optimum purification parameters obtained by current orthogonal analysis were: rotor speed of 500 r·min-1, inert gas flow of 0.4 mL·h-1, refining time of 15 min, and stewing time of 6 min. Degassing rate using the optimum parameters reaches 68%. In addition, the comparison experiments among C2Cl6 refining, rotary impeller degassing, and combined treatment of C2Cl6 refining and rotary impeller degassing for 4004 Al alloy were performed. The experimental data indicated that the combined treatment of C2Cl6 refining and rotary impeller degassing has the best degassing effect. Degassing rate of C2Cl6 refining, rotary impeller degassing and combined refining treatment is 39%, 69.1% and 76.9%, respectively. The mechanical properties of the specimen refined by rotary impeller degassing were higher than those by C2Cl6 refining, but lower than those by combined refining treatment.

The Analysis of the Refined Financial Management of Modern Enterprises

Directory of Open Access Journals (Sweden)

Li Ran

2016-01-01

Full Text Available This paper briefly introduces the concept of the refined financial management, elaborates on its characteristics and puts forward some main points about it. It also comes up with some personal suggestions for reference on effective ways of refining financial management.

Profex: a graphical user interface for the Rietveld refinement program BGMN

OpenAIRE

Doebelin, Nicola; Kleeberg, Reinhard

2015-01-01

Profex is a graphical user interface for the Rietveld refinement program BGMN. Its interface focuses on preserving BGMN’s powerful and flexible scripting features by giving direct access to BGMN input files. Very efficient workflows for single or batch refinements are achieved by managing refinement control files and structure files, by providing dialogues and shortcuts for many operations, by performing operations in the background, and by providing import filters for CIF and XML crystal str...

Process for refining hydrocarbons

Energy Technology Data Exchange (ETDEWEB)

Risenfeld, E H

1924-11-26

A process is disclosed for the refining of hydrocarbons or other mixtures through treatment in vapor form with metal catalysts, characterized by such metals being used as catalysts, which are obtained by reduction of the oxide of minerals containing the iron group, and by the vapors of the hydrocarbons, in the presence of the water vapor, being led over these catalysts at temperatures from 200 to 300/sup 0/C.

Investment in exploration-production and refining 2014

International Nuclear Information System (INIS)

Hureau, Geoffroy; Serbutoviez, Sylvain; Silva, Constancio; Maisonnier, Guy

2014-11-01

IFPEN analyses in this study the 2014 evolution of global investment in the field of exploration-production and refining: 1 - Changes in oil and gas prices: General background: weak economy and global disorder, Oil prices: fundamentals that could help to relax oil prices?, Gas prices: fall in Europe, stability in Japan, increase in the US; 2 - Exploration and production - Slowdown in growth: moderate rise in investment in 2014, exploration - Discoveries in 2014, Russia: sanctions will have limited short term impact, implications of the reforms to the Mexican energy sector; 3 - Drilling activity and market throughout the world: onshore and offshore drilling (Number of wells drilled throughout the world, Number of onshore wells, Number of offshore wells, Drilling, equipment and well services markets, Onshore drilling market, Offshore drilling market, Fracking market), Geophysical activity and the geophysical market, Offshore construction activity and the offshore construction market (Offshore construction activities, Rig construction activity, Floating Platform Systems (FPS), Sub-sea constructions, Offshore construction market); 4 - Refining - Significant increase in spending: increase in industrial costs, a slowdown in the increase in excess capacity in the future?, A bleak future for the european refining sector

P-Refinement and P-Threads (Preprint)

National Research Council Canada - National Science Library

Dong, Steven; Karniadakis, George E

2002-01-01

...]) in d dimensions, which is higher than lower-order methods. In this paper, we demonstrate that by employing multi-threading within MPI processes we manage to counter- balance the cost increase associated with P-refinement...

Carcinogenicity of petroleum lubricating oil distillates: effects of solvent refining, hydroprocessing, and blending.

Science.gov (United States)

Halder, C A; Warne, T M; Little, R Q; Garvin, P J

1984-01-01

Certain refining processes were investigated to determine their influence on the dermal carcinogenic activity of petroleum-derived lubricating oil distillates. Specifically, the effects of solvent refining, hydroprocessing, a combination of both processes, and the blending of oils processed using each technique were evaluated in standard mouse skin-painting bioassays. The refining process used as well as the level or severity of treatment greatly influenced the carcinogenic outcome of processed lubricating oils. Solvent refining at severities normally used appeared to eliminate carcinogenicity. In contrast, hydroprocessing alone at mild levels of treatment was successful only in reducing the carcinogenic potency; severe hydroprocessing conditions were necessary to eliminate carcinogenic activity without the use of additional refining processes. Carcinogenic activity could also be eliminated by following moderate solvent refining with mild hydroprocessing. Blending of hydroprocessed oils with solvent-refined oils resulted in a substantial reduction or even elimination of carcinogenic activity. However, the degree of protection obtained varied with the particular distillates used and appeared largely dependent on the inherent biological activity of the hydroprocessed oil.

Refining in the 1990's: Restructuring and resurgence

International Nuclear Information System (INIS)

Cobb, C.B.

1994-01-01

After two years of uncertainty in dealing with the 1990 Clean Air Act Amendments coupled with the shutdown of 5% of total US refining capacity, the industry is now positioning itself for continued operations throughout the remainder of the decade. However, refineries are experiencing a shift in the mode of operations to a period of more restructuring (closings, ventures, alliances, etc.) followed by a resurgence in financial performance. The purpose of this paper is to examine the current industry and highlight the reasons for industry's current plans. The authors also speculate about the strategies companies will choose to better their financial performance. Fundamentally, the characteristics of a mature domestic business remain the driving force that shape decision making. In responding to the maturing of refining, the authors suggest that refiners will change the way they conduct business over the next few years. Building on the theme of the 1993 NPRA paper, strategies will target the domestic side of the business while simultaneously shifting to a global perspective

Refining SCJ Mission Specifications into Parallel Handler Designs

Directory of Open Access Journals (Sweden)

Frank Zeyda

2013-05-01

Full Text Available Safety-Critical Java (SCJ is a recent technology that restricts the execution and memory model of Java in such a way that applications can be statically analysed and certified for their real-time properties and safe use of memory. Our interest is in the development of comprehensive and sound techniques for the formal specification, refinement, design, and implementation of SCJ programs, using a correct-by-construction approach. As part of this work, we present here an account of laws and patterns that are of general use for the refinement of SCJ mission specifications into designs of parallel handlers used in the SCJ programming paradigm. Our notation is a combination of languages from the Circus family, supporting state-rich reactive models with the addition of class objects and real-time properties. Our work is a first step to elicit laws of programming for SCJ and fits into a refinement strategy that we have developed previously to derive SCJ programs.

Assume-Guarantee Abstraction Refinement Meets Hybrid Systems

Science.gov (United States)

Bogomolov, Sergiy; Frehse, Goran; Greitschus, Marius; Grosu, Radu; Pasareanu, Corina S.; Podelski, Andreas; Strump, Thomas

2014-01-01

Compositional verification techniques in the assume- guarantee style have been successfully applied to transition systems to efficiently reduce the search space by leveraging the compositional nature of the systems under consideration. We adapt these techniques to the domain of hybrid systems with affine dynamics. To build assumptions we introduce an abstraction based on location merging. We integrate the assume-guarantee style analysis with automatic abstraction refinement. We have implemented our approach in the symbolic hybrid model checker SpaceEx. The evaluation shows its practical potential. To the best of our knowledge, this is the first work combining assume-guarantee reasoning with automatic abstraction-refinement in the context of hybrid automata.

India beckons participants in burgeoning refining sector

International Nuclear Information System (INIS)

Anon.

1992-01-01

This paper reports that India has opened its refining sector to full private investment for the first time in more than 2 decades. The government again gave a green light to construction of three 120,000 b/d grassroots refineries in East, West, and Central India. The projects had won various governmental approvals in the past few years, but never moved off high center for a variety of economic and regulatory reasons. The difference this time is that the government is offering interests in the projects to private foreign and domestic investors. It's part of India's push to boost overall refining capacity by more than 80% this century

GAMER: A GRAPHIC PROCESSING UNIT ACCELERATED ADAPTIVE-MESH-REFINEMENT CODE FOR ASTROPHYSICS

International Nuclear Information System (INIS)

Schive, H.-Y.; Tsai, Y.-C.; Chiueh Tzihong

2010-01-01

We present the newly developed code, GPU-accelerated Adaptive-MEsh-Refinement code (GAMER), which adopts a novel approach in improving the performance of adaptive-mesh-refinement (AMR) astrophysical simulations by a large factor with the use of the graphic processing unit (GPU). The AMR implementation is based on a hierarchy of grid patches with an oct-tree data structure. We adopt a three-dimensional relaxing total variation diminishing scheme for the hydrodynamic solver and a multi-level relaxation scheme for the Poisson solver. Both solvers have been implemented in GPU, by which hundreds of patches can be advanced in parallel. The computational overhead associated with the data transfer between the CPU and GPU is carefully reduced by utilizing the capability of asynchronous memory copies in GPU, and the computing time of the ghost-zone values for each patch is diminished by overlapping it with the GPU computations. We demonstrate the accuracy of the code by performing several standard test problems in astrophysics. GAMER is a parallel code that can be run in a multi-GPU cluster system. We measure the performance of the code by performing purely baryonic cosmological simulations in different hardware implementations, in which detailed timing analyses provide comparison between the computations with and without GPU(s) acceleration. Maximum speed-up factors of 12.19 and 10.47 are demonstrated using one GPU with 4096 3 effective resolution and 16 GPUs with 8192 3 effective resolution, respectively.

Refined control of cell stemness allowed animal evolution in the oxic realm

DEFF Research Database (Denmark)

Hammarlund, Emma U; von Stedingk, Kristoffer; Påhlman, Sven

2018-01-01

Animal diversification on Earth has long been presumed to be associated with the increasing extent of oxic niches. Here, we challenge that view. We start with the fact that hypoxia (cells continuously-and paradoxically......-regenerate animal tissue in oxygenated settings. Novel insights from tumour biology illuminate how cell stemness nevertheless can be achieved through the action of oxygen-sensing transcription factors in oxygenated, regenerating tissue. We suggest that these hypoxia-inducible transcription factors provided animals...... with unprecedented control over cell stemness that allowed them to cope with fluctuating oxygen concentrations. Thus, a refinement of the cellular hypoxia-response machinery enabled cell stemness at oxic conditions and, then, animals to evolve into the oxic realm. This view on the onset of animal diversification...

Horn clause verification with convex polyhedral abstraction and tree automata-based refinement

DEFF Research Database (Denmark)

Kafle, Bishoksan; Gallagher, John Patrick

2017-01-01

In this paper we apply tree-automata techniques to refinement of abstract interpretation in Horn clause verification. We go beyond previous work on refining trace abstractions; firstly we handle tree automata rather than string automata and thereby can capture traces in any Horn clause derivations...... underlying the Horn clauses. Experiments using linear constraint problems and the abstract domain of convex polyhedra show that the refinement technique is practical and that iteration of abstract interpretation with tree automata-based refinement solves many challenging Horn clause verification problems. We...... compare the results with other state-of-the-art Horn clause verification tools....

Refining capacity in Quebec : the Quebec market, industry viewpoint

International Nuclear Information System (INIS)

Trudelle, F.

2004-01-01

Canada's second largest oil refinery is operated by Ultramar Ltd. in Levis, Quebec. The refinery, which supplies 45 per cent of all Quebec's petroleum, distributes its products to Quebec, Ontario and the Maritime provinces. The refinery currently produces 215,000 barrels per day. Ultramar is a division of Valero, an American firm which has a total refining capacity of 2.4 million barrels per day. A summary of the company's petroleum energy distribution, consumption, and reserves was presented and compared with the national and global position. It was noted that world demand for petroleum products increases yearly by 1 to 1.5 per cent while the demand for automobile fuel in North America increases by 2.5 to 3.5 per cent. In the last 10 years, world demand has increased by more than 22 per cent but refining capacity has only increased by 12 per cent. The average profitability of the refining industry from 1992 to 2002 was approximately 5.5 per cent, which limited investments in new refinery installations. Much of the industry's profits have been utilized to modify installations in order to reduce the sulphur content in gasoline and diesel fuels. Furthermore, the obtention of permits to construct new refining installations has become a major obstacle and the ratification of the Kyoto Protocol may signify a 30 per cent reduction in automotive fuel demand. Given this, there is currently some hesitation and uncertainty by the refining industry to proceed with new major installations. tabs., figs

Tissue uptake, distribution and elimination of {sup 14}C-PFOA in zebrafish (Danio rerio)

Energy Technology Data Exchange (ETDEWEB)

Ulhaq, Mazhar [Department of Biomedical Sciences and Veterinary Public Health, Swedish University of Agricultural Sciences, SE-750 07 Uppsala (Sweden); Sundström, Maria [Environmental Chemistry Unit, Department of Materials and Environmental Chemistry, Stockholm University, SE-106 91 Stockholm (Sweden); Larsson, Pia; Gabrielsson, Johan [Department of Biomedical Sciences and Veterinary Public Health, Swedish University of Agricultural Sciences, SE-750 07 Uppsala (Sweden); Bergman, Åke [Environmental Chemistry Unit, Department of Materials and Environmental Chemistry, Stockholm University, SE-106 91 Stockholm (Sweden); Norrgren, Leif [Department of Biomedical Sciences and Veterinary Public Health, Swedish University of Agricultural Sciences, SE-750 07 Uppsala (Sweden); Örn, Stefan, E-mail: Stefan.Orn@slu.se [Department of Biomedical Sciences and Veterinary Public Health, Swedish University of Agricultural Sciences, SE-750 07 Uppsala (Sweden)

2015-06-15

Highlights: • Bioconcentration of PFOA at steady-state was approximately 20–30 times. • High concentrations were observed in bile and intestines implying enterohepatic circulation. • PFOA accumulated in oocytes indicating maternal transfer. - Abstract: Perfluorooctanoic acid (PFOA) is a long-chain perfluorinated chemical that has been shown to be non-degradable and persistent in the environment. Laboratory studies on bioconcentration and compound-specific tissue distribution in fish can be valuable for prediction of the persistence and environmental effects of the chemicals. In the present study male and female zebrafish (Danio rerio) were continuously exposed to 10 μg/L of radiolabeled perfluorooctanoic acid ({sup 14}C-PFOA) for 40 days, after which the exposed fish were transferred to fresh clean water for another 80 days wash-out period. At defined periodic intervals during the uptake and wash-out, fish were sampled for liquid scintillation counting and whole body autoradiography to profile the bioconcentration and tissue distribution of PFOA. The steady-state concentration of {sup 14}C-PFOA in the zebrafish was reached within 20–30 days of exposure. The concentration-time course of {sup 14}C-PFOA displayed a bi-exponential decline during washout, with a terminal half-life of approximately 13–14 days. At steady-state the bioconcentration of {sup 14}C-PFOA into whole-body fish was approximately 20–30 times greater than that of the exposure concentration, with no differences between females and males. The bioconcentration factors for liver and intestine were approximately 100-fold of the exposure medium, while in brain, ovary and gall bladder the accumulation factors were in the range 15–20. Whole-body autoradiograms confirmed the highest labeling of PFOA in bile and intestines, which implies enterohepatic circulation of PFOA. The {sup 14}C-PFOA was also observed in maturing vitellogenic oocytes, suggesting chemical accumulation via yolk proteins

Refining mineral oils

Energy Technology Data Exchange (ETDEWEB)

1946-07-05

A process is described refining raw oils such as mineral oils, shale oils, tar, their fractions and derivatives, by extraction with a selected solvent or a mixture of solvents containing water, forming a solvent more favorable for the hydrocarbons poor in hydrogen than for hydrocarbons rich in hydrogen, this process is characterized by the addition of an aiding solvent for the water which can be mixed or dissolved in the water and the solvent or in the dissolving mixture and increasing in this way the solubility of the water in the solvent or the dissolving mixture.

Assessing food allergy risks from residual peanut protein in highly refined vegetable oil

NARCIS (Netherlands)

Blom, W.M.; Kruizinga, A.G.; Rubingh, C.M.; Remington, B.C.; Crevel, R.W.R.; Houben, G.F.

2017-01-01

Refined vegetable oils including refined peanut oil are widely used in foods. Due to shared production processes, refined non-peanut vegetable oils can contain residual peanut proteins. We estimated the predicted number of allergic reactions to residual peanut proteins using probabilistic risk

The changing face of U.S. refining: Ominous notes

International Nuclear Information System (INIS)

Anon.

1992-01-01

As environmental protection comes of age in the US, a complex series of structural changes is also expected - in enforcement bureaucracy, manufacturing, and in energy consumption. It is already quite obvious in the petroleum refining industry. A side effect may be the export of jobs. Buyouts and closures are expected, as is increased refined product import dependency. This issue updates expected changes in gasoline and distillate product requirements in the US, and reports some ominous statements from some of the oil industry's affected parties. This issue also presented the following: (1) the ED Refining Netback Data Series for the US Gulf and West Coasts, Rotterdam, and Singapore as of Jan. 24, 1992; and (2) the ED Fuel Price Tax Series for countries of the Eastern Hemisphere, Jan. 1992 edition

Refinement of the gross theory of nuclear {beta}-decay, and hindrance of the first-forbidden transition of rank 1

Energy Technology Data Exchange (ETDEWEB)

Nakata, Hidehiko [Waseda Univ., Tokyo (Japan). Dept. of Physics; Tachibana, Takahiro; Yamada, Masami

1997-03-01

Recently the gross theory of nuclear {beta}-decay was refined for odd-odd nuclei. In this refinement, the effect of the selection rule of {beta}-transitions from the ground states of odd-odd nuclei to those of even-even nuclei was taken into account based on a statistical consideration. The transitions to the first 2{sup +} excited states in even-even nuclei were also taken into account according to the selection rule approximately. In that study, it was found that the transitions between 1{sup -} ground states of the odd-odd nuclei and 0{sup +} ground states of even-even nuclei, belonging to the first-forbidden transitions of rank 1, are strongly hindered. A reduction factor was introduced for the transitions to the ground states of even-even nuclei to take into account this hindrance. It was also found that the strength functions of the Gamow-Teller transitions obtained from the conventional gross theory are underestimated by a factor of about 3. In order to improve this underestimation, the Lorentz-type function was adopted for the one-particle strength function in the model instead of the hyperbolic-secant-type function. In the present study we have newly analyzed the experimental ft-values of odd-A nuclei, and found that the first-forbidden transitions of rank 1 are also considerably hindered between the ground states. Following the above refinement we have calculated the {beta}-ray spectra of some odd-odd short-lived fission products with the use of the refined gross theory. These results are compared not only with the experiments by Rudstam et al. but also with the conventional gross theory. (author)

Biomaterials Evaluation: Conceptual Refinements and Practical Reforms.

Science.gov (United States)

Masaeli, Reza; Zandsalimi, Kavosh; Tayebi, Lobat

2018-01-01

Regarding the widespread and ever-increasing applications of biomaterials in different medical fields, their accurate assessment is of great importance. Hence the safety and efficacy of biomaterials is confirmed only through the evaluation process, the way it is done has direct effects on public health. Although every biomaterial undergoes rigorous premarket evaluation, the regulatory agencies receive a considerable number of complications and adverse event reports annually. The main factors that challenge the process of biomaterials evaluation are dissimilar regulations, asynchrony of biomaterials evaluation and biomaterials development, inherent biases of postmarketing data, and cost and timing issues. Several pieces of evidence indicate that current medical device regulations need to be improved so that they can be used more effectively in the evaluation of biomaterials. This article provides suggested conceptual refinements and practical reforms to increase the efficiency and effectiveness of the existing regulations. The main focus of the article is on strategies for evaluating biomaterials in US, and then in EU.

Panorama 2011: Refining: varying conditions by region

International Nuclear Information System (INIS)

Silva, C.

2011-01-01

The economic crisis has further weakened a sector that was already facing difficulties, if we look beyond the flush period (2005-2008) when, buoyed by strong demand, margins remained high and refiners could generate profits while maintaining a healthy level of activity. Falling demand and increased over-capacity in some regions - the immediate consequences of the deteriorating economic conditions over the past two years - have led to declining margins and to financial accounts being in the red. The adoption of increasingly stringent emissions standards and product specifications, burdensome regulatory requirements for refineries (for combating local pollution and reducing greenhouse gas emissions), stiffer competition from new fuels: all of these structural factors are weakening the sector, especially in industrialized nations with their more rigorous regulatory compliance. In this generally gloomy climate, numerous new projects are still being envisaged - although many have recently been postponed and tend to be concentrated in developing countries. (author)

Taiwan: refined need for consuming population

International Nuclear Information System (INIS)

Hayes, David.

1995-01-01

A brief discussion is given of the oil and gas industry in Taiwan. Topics covered include the possibility of privatization, refineries and refining contracts overseas, plans for a new petrochemical complex and an offshore submarine transmission pipeline. (UK)

Structure refinement using precession electron diffraction tomography and dynamical diffraction: tests on experimental data

Czech Academy of Sciences Publication Activity Database

Palatinus, Lukáš; Correa, Cinthia Antunes; Steciuk, G.; Jacob, D.; Roussel, P.; Boullay, P.; Klementová, Mariana; Gemmi, M.; Kopeček, Jaromír; Domeneghetti, C.; Cámara, F.; Petříček, Václav

2015-01-01

Roč. 71, č. 6 (2015), 740-751 ISSN 2052-5206 R&D Projects: GA MŠk(CZ) LM2011029; GA ČR GA13-25747S; GA MŠk LO1409 Grant - others:SAFMAT(XE) CZ.2.16/3.1.00/22132; FUNBIO(XE) CZ.2.16/3.1.00/21568 Keywords : XRD * structure refinement * precession electron diffraction Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.892, year: 2015

Effect of some grain refiners on the mechanical properties of aluminum

International Nuclear Information System (INIS)

Zaid, A.I.O.

2001-01-01

It is well established that aluminum and its alloys are grain refined by some refractory metals to enhance their surface qualities and mechanical strengths. In this paper, the literature on grain refining, and its mechanism is reviewed and discussed. Also, the effect of grain refining of commercially pure aluminum by the addition of titanium, boron, vanadium, molybdenum, and zirconium is investigated. The effect of each of these elements on grain size, hardness and mechanical behavior is presented and discussed. It was found that the addition of any of these elements except zirconium resulted in enhancement of grain size, hardness and mechanical strength. An increase of 2.1 % in flow stress of Al grain refined by Ti+B was achieved by addition of 0.1 % V at 0.2 strain. (author)

Refined 3d-3d correspondence

Energy Technology Data Exchange (ETDEWEB)

Alday, Luis F.; Genolini, Pietro Benetti; Bullimore, Mathew; Loon, Mark van [Mathematical Institute, University of Oxford, Andrew Wiles Building,Radcliffe Observatory Quarter, Woodstock Road, Oxford, OX2 6GG (United Kingdom)

2017-04-28

We explore aspects of the correspondence between Seifert 3-manifolds and 3d N=2 supersymmetric theories with a distinguished abelian flavour symmetry. We give a prescription for computing the squashed three-sphere partition functions of such 3d N=2 theories constructed from boundary conditions and interfaces in a 4d N=2{sup ∗} theory, mirroring the construction of Seifert manifold invariants via Dehn surgery. This is extended to include links in the Seifert manifold by the insertion of supersymmetric Wilson-’t Hooft loops in the 4d N=2{sup ∗} theory. In the presence of a mass parameter for the distinguished flavour symmetry, we recover aspects of refined Chern-Simons theory with complex gauge group, and in particular construct an analytic continuation of the S-matrix of refined Chern-Simons theory.

Using atomic energy in the oil refining and petrochemical industry

Energy Technology Data Exchange (ETDEWEB)

Feigin, E.A.; Barashkov, R.Ia.; Raud, E.A.

1982-01-01

A short description of the basic large scale processes for oil refining and petrochemistry in which nuclear reactors can be used is given. The possible industrial plans for using nuclear reactors are examined together with the problems in using the advances in atomic technology in oil refining and petrochemical processes.

Repetitive Identification of Structural Systems Using a Nonlinear Model Parameter Refinement Approach

Directory of Open Access Journals (Sweden)

Jeng-Wen Lin

2009-01-01

Full Text Available This paper proposes a statistical confidence interval based nonlinear model parameter refinement approach for the health monitoring of structural systems subjected to seismic excitations. The developed model refinement approach uses the 95% confidence interval of the estimated structural parameters to determine their statistical significance in a least-squares regression setting. When the parameters' confidence interval covers the zero value, it is statistically sustainable to truncate such parameters. The remaining parameters will repetitively undergo such parameter sifting process for model refinement until all the parameters' statistical significance cannot be further improved. This newly developed model refinement approach is implemented for the series models of multivariable polynomial expansions: the linear, the Taylor series, and the power series model, leading to a more accurate identification as well as a more controllable design for system vibration control. Because the statistical regression based model refinement approach is intrinsically used to process a “batch” of data and obtain an ensemble average estimation such as the structural stiffness, the Kalman filter and one of its extended versions is introduced to the refined power series model for structural health monitoring.

Refining borders of genome-rearrangements including repetitions

Directory of Open Access Journals (Sweden)

JA Arjona-Medina

2016-10-01

Full Text Available Abstract Background DNA rearrangement events have been widely studied in comparative genomic for many years. The importance of these events resides not only in the study about relatedness among different species, but also to determine the mechanisms behind evolution. Although there are many methods to identify genome-rearrangements (GR, the refinement of their borders has become a huge challenge. Until now no accepted method exists to achieve accurate fine-tuning: i.e. the notion of breakpoint (BP is still an open issue, and despite repeated regions are vital to understand evolution they are not taken into account in most of the GR detection and refinement methods. Methods and results We propose a method to refine the borders of GR including repeated regions. Instead of removing these repetitions to facilitate computation, we take advantage of them using a consensus alignment sequence of the repeated region in between two blocks. Using the concept of identity vectors for Synteny Blocks (SB and repetitions, a Finite State Machine is designed to detect transition points in the difference between such vectors. The method does not force the BP to be a region or a point but depends on the alignment transitions within the SBs and repetitions. Conclusion The accurate definition of the borders of SB and repeated genomic regions and consequently the detection of BP might help to understand the evolutionary model of species. In this manuscript we present a new proposal for such a refinement. Features of the SBs borders and BPs are different and fit with what is expected. SBs with more diversity in annotations and BPs short and richer in DNA replication and stress response, which are strongly linked with rearrangements.

Grain refinement of AZ31 by (SiC)P: Theoretical calculation and experiment

International Nuclear Information System (INIS)

Guenther, R.; Hartig, Ch.; Bormann, R.

2006-01-01

Grain refinement of gravity die-cast Mg-alloys can be achieved via two methods: in situ refinement by primary precipitated metallic or intermetallic phases, and inoculation of the melt via ceramic particles that remain stable in the melt due to their high thermodynamic stability. In order to clarify grain refinement mechanisms and optimize possible potent refiners in Mg-alloys, a simulation method for heterogeneous nucleation based on a free growth model has been developed. It allows the prediction of the grain size as a function of the particle size distribution, the volumetric content of ceramic inoculants, the cooling rate and the alloy constitution. The model assumptions were examined experimentally by a study of the grain refinement of (SiC) P in AZ31. Additions of (SiC) P result in significant grain refinement, if appropriate parameters for ceramic particles are chosen. The model makes quantitatively correct predictions for the grain size and its variation with cooling rate

Process for refining shale bitumen

Energy Technology Data Exchange (ETDEWEB)

Plauson, H

1920-09-19

A process is disclosed for refining shale bitumen for use as heavy mineral oil, characterized by mixtures of blown hard shale pitch and heavy mineral oil being blown with hot air at temperatures of 120 to 150/sup 0/ with 1 to 3 percent sulfur, and if necessary with 0.5 to 3 percent of an aldehyde.

Multigrid for refined triangle meshes

Energy Technology Data Exchange (ETDEWEB)

Shapira, Yair

1997-02-01

A two-level preconditioning method for the solution of (locally) refined finite element schemes using triangle meshes is introduced. In the isotropic SPD case, it is shown that the condition number of the preconditioned stiffness matrix is bounded uniformly for all sufficiently regular triangulations. This is also verified numerically for an isotropic diffusion problem with highly discontinuous coefficients.

Unit-cell refinement from powder diffraction scans

International Nuclear Information System (INIS)

Pawley, G.S.

1981-01-01

A procedure for the refinement of the crystal unit cell from a powder diffraction scan is presented. In this procedure knowledge of the crystal structure is not required, and at the end of the refinement a list of indexed intensities is produced. This list may well be usable as the starting point for the application of direct methods. The problems of least-squares ill-conditioning due to overlapping reflections are overcome by constraints. An example using decafluorocyclohexene, C 6 F 10 , shows the quality of fit obtained in a case which may even be a false minimum. The method should become more relevant as powder scans of improved resolution become available, through the use of pulsed neutron sources. (Auth.)

Refining crude oils and gasolines, etc

Energy Technology Data Exchange (ETDEWEB)

1931-11-23

A process of refining crude oils and gasolines distilled from shale and the like is described, consisting of submitting them to a prewash with soda, an oxidation preferably with hypochlorite solution, a hydrogenation with nascent hydrogen, and finally rectification and neutralization.

A conformation-dependent stereochemical library improves crystallographic refinement even at atomic resolution

International Nuclear Information System (INIS)

Tronrud, Dale E.; Karplus, P. Andrew

2011-01-01

A script was created to allow SHELXL to use the new CDL v.1.2 stereochemical library which defines the target values for main-chain bond lengths and angles as a function of the residue’s ϕ/ψ angles. Test refinements using this script show that the refinement behavior of structures at resolutions even better than 1 Å is substantially enhanced by the use of the new conformation-dependent ideal geometry paradigm. To utilize a new conformation-dependent backbone-geometry library (CDL) in protein refinements at atomic resolution, a script was written that creates a restraint file for the SHELXL refinement program. It was found that the use of this library allows models to be created that have a substantially better fit to main-chain bond angles and lengths without degrading their fit to the X-ray data even at resolutions near 1 Å. For models at much higher resolution (∼0.7 Å), the refined model for parts adopting single well occupied positions is largely independent of the restraints used, but these structures still showed much smaller r.m.s.d. residuals when assessed with the CDL. Examination of the refinement tests across a wide resolution range from 2.4 to 0.65 Å revealed consistent behavior supporting the use of the CDL as a next-generation restraint library to improve refinement. CDL restraints can be generated using the service at http://pgd.science.oregonstate.edu/cdl_shelxl/

Refining mass formulas for astrophysical applications: A Bayesian neural network approach

Science.gov (United States)

Utama, R.; Piekarewicz, J.

2017-10-01

Background: Exotic nuclei, particularly those near the drip lines, are at the core of one of the fundamental questions driving nuclear structure and astrophysics today: What are the limits of nuclear binding? Exotic nuclei play a critical role in both informing theoretical models as well as in our understanding of the origin of the heavy elements. Purpose: Our aim is to refine existing mass models through the training of an artificial neural network that will mitigate the large model discrepancies far away from stability. Methods: The basic paradigm of our two-pronged approach is an existing mass model that captures as much as possible of the underlying physics followed by the implementation of a Bayesian neural network (BNN) refinement to account for the missing physics. Bayesian inference is employed to determine the parameters of the neural network so that model predictions may be accompanied by theoretical uncertainties. Results: Despite the undeniable quality of the mass models adopted in this work, we observe a significant improvement (of about 40%) after the BNN refinement is implemented. Indeed, in the specific case of the Duflo-Zuker mass formula, we find that the rms deviation relative to experiment is reduced from σrms=0.503 MeV to σrms=0.286 MeV. These newly refined mass tables are used to map the neutron drip lines (or rather "drip bands") and to study a few critical r -process nuclei. Conclusions: The BNN approach is highly successful in refining the predictions of existing mass models. In particular, the large discrepancy displayed by the original "bare" models in regions where experimental data are unavailable is considerably quenched after the BNN refinement. This lends credence to our approach and has motivated us to publish refined mass tables that we trust will be helpful for future astrophysical applications.

Panorama 2011: Water in fuel production Oil production and refining

International Nuclear Information System (INIS)

Nabzar, L.

2011-01-01

Water plays a vital role in the production of fuels. Against a background of extremely high pressure to do with the need to protect the environment, better manage energy use and operate in a socially responsible manner - as well as the need to protect water as a resource and reduce greenhouse gas emissions, water management has become a major issue for the oil industry. These issues have all more or less been factored into the integrated water management programmes which have been introduced both in oil production and oil refining. These programmes have been designed to keep waste and emissions to a minimum, and to reduce the quantities of water required. (author)

The effect of technogenic emissions on the heavy metals accumulation by herbaceous plants.

Science.gov (United States)

Chaplygin, Victor; Minkina, Tatiana; Mandzhieva, Saglara; Burachevskaya, Marina; Sushkova, Svetlana; Poluektov, Evgeniy; Antonenko, Elena; Kumacheva, Valentina

2018-02-07

The effect of technogenic emissions on the input of Pb, Zn, Cd, Cu, Mn, Cr, and Ni into plants from the Poaceae and Asteraceae families has been studied. Soil and plant contamination by anthropogenic emissions from industrial enterprises leads the decreasing of crop quality; therefore, the monitoring investigation of plants and soils acquires special importance. The herbaceous plants may be used as bioindicators for main environmental changes. It was found that the high level of anthropogenic load related to atmospheric emissions from the power plant favors the heavy metal (HM) accumulation in herbaceous plants. Contamination with Pb, Cd, Cr, and Ni was revealed in plants growing near the power plant. Heavy metals arrive to plants from the soil in the form of mobile compounds. Plant family is one of the main factors affecting the HM distribution in the above- and underground parts of plants. Plants from the Poaceae family accumulate less chemical elements in their aboveground parts than the Asteraceae plants. Ambrosia artemisiifolia and Artemisia austriaca are HM accumulators. For assessing the stability of plants under contamination with HMs, metal accumulation by plants from soil (the bioconcentration factor) and metal phytoavailability from plants above- and underground parts (the acropetal coefficient) were calculated. According to the bioconcentration factor and translocation factor values, Poaceae species are most resistant to technogenic contamination with HMs. The translocation factor highest values were found for Tanacetum vulgare; the lowest bioconcentration factor values were typical for Poa pratensis.

Uptake of phosphorus from feed by carps

International Nuclear Information System (INIS)

Kellermann, H.J.; Buehringer, H.

1993-01-01

One of the aims of the International Conference for the Protection of the North Sea is to reduce the input of nutrients by 50% within the period of 1985 -1995. This is only possible by reducing the riverine input of phosphorus into the North Sea. For the regulated shortlived isotope of this element the bioconcentration factor to fishmeat is determined by the phosporus concentration in the water on the one hand and by the biological turn over rate in tissue on the other hand. Aquaria studies of the turn over rate of carps at different feed applications reveal that the recommended bioconcentration factor does not yield the desired conservative assessment. (orig.) [de

Radioecological studies in marine ecosystems

International Nuclear Information System (INIS)

Kellermann, H.J.; Kanisch, G.

1999-01-01

The bioconcentration factor shows the ratio between concentration of a substance in water or in fish. It is a calculation quantity, used for assessing the possible concentration in fish in proportion to the known concentration in water. Although the element cesium discussed in this report is primarily ingested via the food chain (biomagnification) and not via direct uptake through the gills, but the bioconcentration factor model is nevertheless applicable, because there is a relation between the element's concentration in water and in food. One has to consider, however, the influence on cesium uptake through the quantity of food and species-dependent accumulation. Experimental results obtained for various ecosystems are reported and illustrate the mechanisms involved. (orig./CB) [de

The Generation of AlmFe in Dilute Aluminium Alloys with Different Grain Refining Additions

Science.gov (United States)

Meredith, M. W.; Greer, A. L.; Evans, P. V.; Hamerton, R. G.

Al13Fe4, Al6Fe and AlmFe are common intermetallics in commercial AA1XXX series Al alloys. Grain-refining additions (based on either Al-Ti-B or Al-Ti-C) are usually added to such alloys during solidification processing to aid the grain structure development. They also influence the favoured intermetallic and, hence, can affect the materials' properties. This work simulates commercial casting practices in an attempt to determine the mechanisms by which one intermetallic phase is favoured over another by the introduction of grain-refining additions. Directional solidification experiments on Al-0.3wt.%Fe-0.15wt.%Si with and without grain refiner are conducted using Bridgman apparatus. The type, amount and effectiveness of the grain-refining additions are altered and the resulting intermetallic phase selection followed. The materials are characterised using optical microscopy, scanning electron microscopy and X-ray diffraction. AlmFe is seen to form when Al-Ti-B grain-refiner is introduced but only when the refinement is successful; reducing the effectiveness of the refiner led to Al6Fe forming under all conditions. Al-Ti-C refiners are seen to promote AlmFe at lower solidification velocities than when Al-Ti-B was used even though the grain structure was not as refined. These trends can be explained within existing eutectic theory, by considering growth undercooling.

Grain Refinement of Commercial EC Grade 1070 Aluminium Alloy for Electrical Application

OpenAIRE

Hassanabadi, Massoud

2015-01-01

The aluminium alloys for electrical conductivity applications are generally not grain refinedsince the addition of grain refiners drops the electrical conductivity by introducing impuritiesinto the melt. Non-grain refined aluminium may lead to bar fracture and cracks during themetalworking process. The present study focuses to find an optimum balance between the grain refiner addition andthe electrical conductivity of commercial EC grade 1070 aluminium alloy for electricalapplication. In orde...

Refined Fuchs inequalities for systems of linear differential equations

International Nuclear Information System (INIS)

Gontsov, R R

2004-01-01

We refine the Fuchs inequalities obtained by Corel for systems of linear meromorphic differential equations given on the Riemann sphere. Fuchs inequalities enable one to estimate the sum of exponents of the system over all its singular points. We refine these well-known inequalities by considering the Jordan structure of the leading coefficient of the Laurent series for the matrix of the right-hand side of the system in the neighbourhood of a singular point

Bioconcentration of artificial radionuclides in edible mushrooms: in situ and in vitro studies

Energy Technology Data Exchange (ETDEWEB)

Dementyev, Dmitry V.; Manukovsky, Nikolai S.; Bolsunovsky, Alexander Ya.; Alexandrova, Yuliyana V. [Institute of Biophysics, Siberian Branch of the Russian Academy of Sciences, 660036, Krasnoyarsk (Russian Federation)

2014-07-01

Some areas of the Yenisei River basin are affected by the operation of the Mining-and-Chemical Combine (MCC), producing weapons-grade plutonium. Flood plain soils of the Yenisei contain a wide range of artificial radionuclides, including transuranium elements, which can be accumulated by living organisms. Concentrations of artificial radionuclides and heavy metals accumulated by mushrooms may be several orders of magnitude higher than those accumulated by plants, and, thus, mushrooms may be used as bio-concentrators of radionuclides and heavy metals for bioremediation of contaminated areas. The purposes of this study were to investigate 1) species specificity of accumulation of artificial radionuclides by edible mushrooms in radioactively contaminated areas of the Yenisei River flood plain and 2) accumulation rates of artificial radionuclides, including transuranium elements, in mushrooms under laboratory conditions. Species specificity of accumulation of artificial radionuclides and uranium by mushrooms was analyzed for 12 species of edible mushrooms. The study was performed at the sites affected by MCC operation, which were divided into two groups: 1) the sites only affected by aerosol-bound radionuclides and 2) the sites that also received waterborne radionuclides. Field studies showed great interspecific variations in Cs-137 accumulation by mushrooms. Activity concentrations of Cs-137 in bioindicator species Suillus granulatus and S. Luteus reached 10 kBq/kg dry weight. S. granulatus and S. luteus are concentrators of Cs-137, as suggested by the analysis of concentration factors (CFs), which reached 0.7-16 for these mushroom species. The CF of U-238 in fruiting bodies of the mushrooms was no greater than 0.11. Yenisei flood plain soils contain a wide range of transuranium elements, which can accumulate in environmental objects. Laboratory experiments on accumulation of Am-241 from solution by mycelium and Am-241 accumulation by fruiting bodies of mushrooms

Rising costs call for new European refining strategies

International Nuclear Information System (INIS)

Sweeney, B.N.C.

1993-01-01

The outlook for the global refining industry is for increased spending and reduced margins, largely because of efforts to improve the environment. A look at these trends through the end of the decade is thus in order. Three major industry thrusts are proposed to see refiners through this uncertain period. Three main thrusts are necessary: fixed costs must be reduced by re-engineering business processes and reexamining noncore business units against total and marginal costs. In this respect the best refiners are well ahead of the good ones. New cooperative ways of meeting regulations must be sought, to avoid wasteful over capacity. Joint ventures and alliances with competitors will be needed. The cooperative principle upstream must be extended and new strategies must be sought to meet product demand changes and reduce feedstock costs. The picture that is presented is tough, largely because of the wish to improve the environment. The question that must be continually reviewed is ''Have governments got the right balance in these regulations between the environment and the downstream industry?''

Stability studies on refined soybean oil stored in various conditions

International Nuclear Information System (INIS)

Arawande, J.O.; Amoo, I.A.

2008-01-01

The 12 months stability study of freshly produced refined soybean oil revealed that refined soybean oil stored in plastic containers in dark was more hydrolytically and oxidatively stable than that stored in other containers in light condition. There was no significant difference at P < 0.05 in free fatty acids and acid value of oil stored under light and dark conditions in tin and glass containers but there was significant difference at P < 0.05 in peroxide value of oil stored in light and dark conditions in all the storage containers. Light increased the degree of oxidative rancidity of refined soybean oil, the most in tin containers, followed by glass containers and the least in plastic containers. (author)

Atlantic Basin refining profitability

International Nuclear Information System (INIS)

Jones, R.J.

1998-01-01

A review of the profitability margins of oil refining in the Atlantic Basin was presented. Petroleum refiners face the continuous challenge of balancing supply with demand. It would appear that the profitability margins in the Atlantic Basin will increase significantly in the near future because of shrinking supply surpluses. Refinery capacity utilization has reached higher levels than ever before. The American Petroleum Institute reported that in August 1997, U.S. refineries used 99 per cent of their capacity for several weeks in a row. U.S. gasoline inventories have also declined as the industry has focused on reducing capital costs. This is further evidence that supply and demand are tightly balanced. Some of the reasons for tightening supplies were reviewed. It was predicted that U.S. gasoline demand will continue to grow in the near future. Gasoline demand has not declined as expected because new vehicles are not any more fuel efficient today than they were a decade ago. Although federally-mandated fuel efficiency standards were designed to lower gasoline consumption, they may actually have prevented consumption from falling. Atlantic margins were predicted to continue moving up because of the supply and demand evidence: high capacity utilization rates, low operating inventories, limited capacity addition resulting from lower capital spending, continued U.S. gasoline demand growth, and steady total oil demand growth. 11 figs

The effect of refining step on the changes in viscosity values of vegetable oils

International Nuclear Information System (INIS)

Ergonul, P.G.

2013-01-01

In this work, the viscosity values of chemically refined vegetable oils (sunflower, corn, soybean and rapeseed) and physically refined vegetable oils (olive and palm) were determined during refining processes. At this point of view, fatty acid compositions and viscosity values of oil samples were determined. The edible vegetable oils presented Newtonian behavior in shear rates at ranges 6.28-20.93 s/sup -1/. It was observed that palm oil is more viscous than the others. During physical refining, the effect of both oil type and refining steps were significantly important, whereas in chemical refining only the effect of oil type was found statistically important (p<0.01). It was observed that correlation among fatty acid compositions and viscosity values of the samples showed differences according to oil type. (author)

Hybrid direct and iterative solvers for h refined grids with singularities

KAUST Repository

Paszyński, Maciej R.; Paszyńska, Anna; Dalcin, Lisandro; Calo, Victor M.

2015-01-01

on top of it. The hybrid solver is applied for two or three dimensional grids automatically h refined towards point or edge singularities. The automatic refinement is based on the relative error estimations between the coarse and fine mesh solutions [2

Panorama 2016 - Refining outlook for 2035

International Nuclear Information System (INIS)

Marion, Pierre; Saint-Antonin, Valerie

2015-12-01

The rising influence of objectives intended to address the energy transition in global industry helps to perpetuate a high degree of uncertainty about changes in the transportation sector, currently a bastion of the oil industry. How can the growing need for individual mobility be met while reducing Greenhouse Gas (GHG) emissions in a world of open international competition? The refining sector is gaining strength in Asia and the Middle East to the detriment of Europe and North America, reflecting demand and the intrinsic competitiveness of various geographic regions. The 2025 worldwide roll-out (2020 in Europe) of a bunker fuel grade below 0.5 wt% (percentage by weight) in sulphur could experience delays, given the number of installations to be completed. Finally, the reversal of the 'all diesel' trend in the European transport market is a positive change for the European refining industry. (authors)

Tree automata-based refinement with application to Horn clause verification

DEFF Research Database (Denmark)

Kafle, Bishoksan; Gallagher, John Patrick

2015-01-01

In this paper we apply tree-automata techniques to refinement of abstract interpretation in Horn clause verification. We go beyond previous work on refining trace abstractions; firstly we handle tree automata rather than string automata and thereby can capture traces in any Horn clause derivation...... compare the results with other state of the art Horn clause verification tools....

The regulations concerning refining business of nuclear source material and nuclear fuel materials

International Nuclear Information System (INIS)

1979-01-01

The regulations are provided for under the law for the regulations of nuclear source materials, nuclear fuel materials and reactors and provisions concerning refining business in the enforcement order for the law. The basic concepts and terms are defined, such as: exposure dose, accumulative dose; controlled area; inspected surrounding area and employee. Refining facilities listed in the application for designation shall be classified into clushing and leaching, thickning, refining facilities, storage facilities of nuclear source materials and nuclear fuel materials, disposal facilities of contaminated substances and building for refining, etc. Business program attached to the application shall include expected time of beginning of refining, estimated production amount of nuclear source materials or nuclear fuel materials for the first three years and funds necessary for construction, etc. Records shall be made and kept for particular periods on delivery and storage of nuclear source materials and nuclear fuel materials, control of radiation, maintenance and accidents of refining facilities. Safety securing, application of internationally regulated substances and measures in dangerous situations are stipulated respectively. Exposure dose of employees and other specified matters shall be reported by the refiner yearly to the Director General of Science and Technology Agency and the Minister of International Trade and Industry. (Okada, K.)

Catalysts in petroleum refining and petrochemical industries 1995

Energy Technology Data Exchange (ETDEWEB)

Absi-Halabi, M.; Beshara, J.; Qabazard, H.; Stanislaus, A. [eds.] [Petroleum, Petrochemicals and Materials Division, Kuwait Institute of Scientific Research, Kuwait (Kuwait)

1996-07-01

Catalysis plays an increasingly critical role in modern petroleum refining and basic petrochemical industries. The market demands for and specifications of petroleum and petrochemical products are continuously changing. They have impacted the industry significantly over the past twenty years. Numerous new refining processes have been developed and significant improvements were made on existing technologies. Catalysts have been instrumental in enabling the industry to meet the continuous challenges posed by the market. As we enter the 21st century, new challenges for catalysis science and technology are anticipated in almost every field. Particularly, better utilization of petroleum resources and demands for cleaner transportation fuels are major items on the agenda. It is against this background that the 2nd International Conference on Catalysts in Petroleum Refining and Petrochemical Industries was organized. The papers from the conference were carefully selected from around 100 submissions. They were a mix of reviews providing an overview of selected areas, original fundamental research results, and industrial experiences. The papers in the proceedings were grouped in the following sections for quick reference: Plenary Papers; Hydroprocessing of Petroleum Residues and Distillates; Fluid Catalytic Cracking; Oxidation Catalysis; Aromatization and Polymerization Catalysis; Catalyst Characterization and Performance. The plenary papers were mostly reviews covering important topics related to the objectives of the conference. The remaining sections cover various topics of major impact on modern petroleum refining and petrochemical industries. A large number of papers dealt with hydroprocessing of petroleum distillates and residues which reflects the concern over meeting future sulfur-level specifications for diesel and fuel oils

Realization of the Zone Length Measurement during Zone Refining Process via Implementation of an Infrared Camera

Directory of Open Access Journals (Sweden)

Danilo C. Curtolo

2018-05-01

Full Text Available Zone refining, as the currently most common industrial process to attain ultrapure metals, is influenced by a variety of factors. One of these parameters, the so-called “zone length”, affects not only the ultimate concentration distribution of impurities, but also the rate at which this distribution is approached. This important parameter has however neither been investigated experimentally, nor ever varied for the purpose of optimization. This lack of detections may be due to the difficult temperature measurement of a moving molten area in a vacuum system, of which the zone refining methodology is comprised. Up to now, numerical simulation as a combination of complex mathematical calculations, as well as many assumptions has been the only way to reveal it. This paper aims to propose an experimental method to accurately measure the molten zone length and to extract helpful information on the thermal gradient, temperature profile and real growth rate in the zone refining of an exemplary metal, in this case aluminum. This thermographic method is based on the measurement of the molten surface temperature via an infrared camera, as well as further data analysis through the mathematical software MATLAB. The obtained results show great correlation with the visual observations of zone length and provide helpful information to determine the thermal gradient and real growth rate during the whole process. The investigations in this paper approved the application of an infrared camera for this purpose as a promising technique to automatically control the zone length during a zone refining process.

Reform of refined oil product pricing mechanism and energy rebound effect for passenger transportation in China

International Nuclear Information System (INIS)

Lin, Boqiang; Liu, Xia

2013-01-01

Improving energy efficiency is the primary method adopted by the Chinese government in an effort to achieve energy conservation target in the transport sector. However, the offsetting effect of energy rebound would greatly reduce its real energy-saving potentials. We set up a Linear Approximation of the Almost Ideal Demand System Model (LA-AIDS model) to estimate the rebound effect for passenger transportation in China. Real energy conservation effect of improving energy efficiency can also be obtained in the process. The result shows that the rebound effect is approximately 107.2%. This figure signifies the existence of ‘backfire effect’, indicating that efficiency improvement in practice does not always lead to energy-saving. We conclude that one important factor leading to the rebound effect, is the refined oil pricing mechanism. China's refined oil pricing mechanism has been subjected to criticism in recent years. The results of simulation analysis show that the rebound could be reduced to approximately 90.7% if the refined oil pricing mechanism is reformed. In this regard, we suggest further reforms in the current refined oil pricing mechanism. - Highlights: ► We set up the LA-AIDS model to estimate traffic service demand for urban residents. ► The size of the rebound effect for passenger transportation in China is evaluated. ► The rebound effect for passenger transportation in China is 107.2%. ► Reform of oil pricing could reduced the rebound to 90.7%. ► Reform of oil pricing might be an effective method for mitigating rebound effect

Profex: a graphical user interface for the Rietveld refinement program BGMN.

Science.gov (United States)

Doebelin, Nicola; Kleeberg, Reinhard

2015-10-01

Profex is a graphical user interface for the Rietveld refinement program BGMN . Its interface focuses on preserving BGMN 's powerful and flexible scripting features by giving direct access to BGMN input files. Very efficient workflows for single or batch refinements are achieved by managing refinement control files and structure files, by providing dialogues and shortcuts for many operations, by performing operations in the background, and by providing import filters for CIF and XML crystal structure files. Refinement results can be easily exported for further processing. State-of-the-art graphical export of diffraction patterns to pixel and vector graphics formats allows the creation of publication-quality graphs with minimum effort. Profex reads and converts a variety of proprietary raw data formats and is thus largely instrument independent. Profex and BGMN are available under an open-source license for Windows, Linux and OS X operating systems.

Stable grid refinement and singular source discretization for seismic wave simulations

Energy Technology Data Exchange (ETDEWEB)

Petersson, N A; Sjogreen, B

2009-10-30

An energy conserving discretization of the elastic wave equation in second order formulation is developed for a composite grid, consisting of a set of structured rectangular component grids with hanging nodes on the grid refinement interface. Previously developed summation-by-parts properties are generalized to devise a stable second order accurate coupling of the solution across mesh refinement interfaces. The discretization of singular source terms of point force and point moment tensor type are also studied. Based on enforcing discrete moment conditions that mimic properties of the Dirac distribution and its gradient, previous single grid formulas are generalized to work in the vicinity of grid refinement interfaces. These source discretization formulas are shown to give second order accuracy in the solution, with the error being essentially independent of the distance between the source and the grid refinement boundary. Several numerical examples are given to illustrate the properties of the proposed method.

Demand, deregulation may attract more refiners to Asia

International Nuclear Information System (INIS)

Rhodes, A.K.

1995-01-01

As a result of rapidly increasing demand, major oil companies are eyeing Asian oil and gas markets more closely than ever. Higher earnings can be expected there than in the US or Europe, where product markets--especially light products--are expected to tighten long-term. Of the nations with growing requirements for refined products, China and India offer greater opportunity for foreign investors to enter downstream projects. Also offering excellent business prospects are Thailand, Malaysia, and Indonesia. The paper discusses oil demand, products, refining capacity, and capacity additions in Japan, South Korea, Taiwan, Singapore, India, Indonesia, Malaysia, and China

China's refiners face massive overhaul, expansion to meet demand growth, new crude slate

International Nuclear Information System (INIS)

Anon.

1994-01-01

China's refining industry has embarked on a massive overhaul and expansion to accommodate soaring domestic growth in refined products demand. Currently that growth in demand is being met by increasing imports of refined products, in recent years attaining triple digit growth rates and squeezing direly needed foreign exchange. The focus is on adding refining capacity of about 1.4 million b/d to the current capacity of about 3.2 million b/d by 2000. Priority for increasing capacity is being given to expanding existing refineries and participating in foreign joint venture grassroots refineries along China's booming coastal regions as well as hiking output. A major challenge for China's refineries is that country's reentry into the General Agreement on Tariffs and Trade (GATT), recently signed in Morocco by more than 100 nations. The accompanying reduction of tariffs on imported refined products will make it more difficult for China's marginal refineries to compete in the domestic market. The paper discusses imports and exports, LPG outlook, refining capacity, revamps needed, third party processing, China's first joint venture refinery, industry plans, and GATT challenges

The Refining Mechanism of Super Gravity on the Solidification Structure of Al-Cu Alloys

Directory of Open Access Journals (Sweden)

Yuhou Yang

2016-12-01

Full Text Available There is far less study of the refining effect of super gravity fields on solidification structures of metals than of the effects of electrical currents, magnetic and ultrasonic fields. Moreover, the refining mechanisms of super gravity are far from clear. This study applied a super gravity field to Al-Cu alloys to investigate its effect on refining their structures and the mechanism of interaction. The experimental results showed that the solidification structure of Al-Cu alloys can be greatly refined by a super gravity field. The major refining effect was mainly achieved when super gravity was applied at the initial solidification stage; only slight refinement could be obtained towards the end of solidification. No refinement was obtained by the super gravity treatment on pure liquid or solid stages. The effectiveness of super gravity results from its promoting the multiplication of crystal nuclei, which we call “Heavy Crystal Rain”, thereby greatly strengthening the migration of crystal nuclei within the alloy. Increasing the solute Cu content can increase nucleation density and restrict the growth of crystals, which further increases the refining effect of super gravity. Within this paper, we also discuss the motile behavior of crystals in a field of super gravity.

Effect of grain refinement on the fluidity of two commercial Al-Si foundry alloys

Science.gov (United States)

Dahle, A. K.; Tøndel, P. A.; Paradies, C. J.; Arnberg, L.

1996-08-01

The effect of grain refinement on the fluidity of AlSi7Mg and AlSi11Mg has been investigated by spiral tests. Two different types of grain refiners have been evaluated. An AlTi5Bl master alloy was added to different Ti contents. Since the commercial alloys had a high initial content of titanium, model alloys were made to investigate the fluidity at low grain refiner additions. Commercial alloys grain refined only by boron additions have also been investigated. The results from the fluidity measurements have been verified by measuring the dendrite coherency point of the different cast alloys. Although different, the two methods show similar trends. The spirals from each fraction grain refiner cast were subsequently investigated metallographically at the tip of the spirals and at a reference point a distance behind, but no obvious difference in structure was observed. For both alloys, an increase in fluidity is observed as the content of grain refiner increases above 0.12 pct Ti, while the fluidity is impaired with increased grain refinement below 0.12 pct Ti. The alloys grain refined with ~0.015 pct B show the highest fraction solid at dendrite coherency, the smallest grain size, and the best fluidity.

Processing and refinement of steel microstructure images for assisting in computerized heat treatment of plain carbon steel

Science.gov (United States)

Gupta, Shubhank; Panda, Aditi; Naskar, Ruchira; Mishra, Dinesh Kumar; Pal, Snehanshu

2017-11-01

Steels are alloys of iron and carbon, widely used in construction and other applications. The evolution of steel microstructure through various heat treatment processes is an important factor in controlling properties and performance of steel. Extensive experimentations have been performed to enhance the properties of steel by customizing heat treatment processes. However, experimental analyses are always associated with high resource requirements in terms of cost and time. As an alternative solution, we propose an image processing-based technique for refinement of raw plain carbon steel microstructure images, into a digital form, usable in experiments related to heat treatment processes of steel in diverse applications. The proposed work follows the conventional steps practiced by materials engineers in manual refinement of steel images; and it appropriately utilizes basic image processing techniques (including filtering, segmentation, opening, and clustering) to automate the whole process. The proposed refinement of steel microstructure images is aimed to enable computer-aided simulations of heat treatment of plain carbon steel, in a timely and cost-efficient manner; hence it is beneficial for the materials and metallurgy industry. Our experimental results prove the efficiency and effectiveness of the proposed technique.

Multidimensional Assessment of Spirituality/Religion in Patients with HIV: Conceptual Framework and Empirical Refinement

Science.gov (United States)

Kudel, Ian; Cotton, Sian; Leonard, Anthony C.; Tsevat, Joel; Ritchey, P. Neal

2011-01-01

A decade ago, an expert panel developed a framework for measuring spirituality/religion in health research (Brief Multidimensional Measure of Religiousness/Spirituality), but empirical testing of this framework has been limited. The purpose of this study was to determine whether responses to items across multiple measures assessing spirituality/religion by 450 patients with HIV replicate this model. We hypothesized a six-factor model underlying a collective of 56 items, but results of confirmatory factor analyses suggested eight dimensions: Meaning/Peace, Tangible Connection to the Divine, Positive Religious Coping, Love/Appreciation, Negative Religious Coping, Positive Congregational Support, Negative Congregational Support, and Cultural Practices. This study corroborates parts of the factor structure underlying the Brief Multidimensional Measure of Religiousness/Spirituality and some recent refinements of the original framework. PMID:21136166

A new concept for product refining in the Purex process

International Nuclear Information System (INIS)

Henrich, E.; Bauder, U.; Marquardt, R.

1986-01-01

In actual Purex plants the products are refined in additional solvent extraction cycles. Crystallization of uranyl and plutonyl nitrate from aqueous nitric acid solution is proposed as a potentially simpler product refining concept. Suitable crystallization conditions are being investigated in the laboratory using simulated and actual process solutions. A thorough removal of mother liquor is an essential purification step and well washed crystals usually contain less than 1% of an individual impurity. Crystallization simultaneously comprises a product concentration step. Hexavalent uranium can be separated from lower-valent plutonium. An outline of an integrated processing concept is given. Product refining by crystallization is compact; recycling of mother liquor plus wash acid prevents product loss and the generation of additional waste streams. (orig.) [de

40 CFR 80.1142 - What are the provisions for small refiners under the RFS program?

Science.gov (United States)

2010-07-01

... all of the following criteria: (i) The refiner produced gasoline at its refineries by processing crude... Standard § 80.1142 What are the provisions for small refiners under the RFS program? (a)(1) Gasoline produced by a refiner, or foreign refiner (as defined at § 80.1165(a)), is exempt from the renewable fuel...

On Syntactic and Semantic Action Refinement

NARCIS (Netherlands)

Goltz, Ursula; Gorrieri, Roberto; Rensink, Arend

1992-01-01

The semantic definition of action refinement on labelled event structures is compared with the notion of syntactic substitution,which can be used as another notion of action refiment in a process algebraic setting. This is done by studying a process algebra equipped with the ACP sequential

Quantum Geometry of Refined Topological Strings

NARCIS (Netherlands)

Aganagic, M.; Cheng, M.C.N.; Dijkgraaf, R.; Kreft, D.; Vafa, C.

2012-01-01

We consider branes in refined topological strings. We argue that their wavefunctions satisfy a Schrödinger equation depending on multiple times and prove this in the case where the topological string has a dual matrix model description. Furthermore, in the limit where one of the equivariant

Government will shape China's refining boom

International Nuclear Information System (INIS)

Wang, H.

1995-01-01

China's refining system is undergoing a major overhaul. New refineries are being built as existing ones are upgraded and expanded. The success of refineries funded completely or partially by non-chinese companies will depend in part on Chinese government policy. There will be demand for products from third-party processing facilities, but hard current is necessary for the investors to repatriate profits and for china Petrochemical Corp. (Sinopec) to bid on the products from such facilities. The limited convertibility of chinese current constitutes a major central control over the country's entire economy. This control can be affected by limiting product exchange participants and the volumes to be traded. Such a limitation, however, will reduce access of non-Chinese companies to China's markets, and is not likely to occur in the next 10 years. The paper discusses the current situation in capacity and in refining, capacity, expansion, refinery planning, construction projects, third-party processing, and the prospects for change

Multivariate refined composite multiscale entropy analysis

International Nuclear Information System (INIS)

Humeau-Heurtier, Anne

2016-01-01

Multiscale entropy (MSE) has become a prevailing method to quantify signals complexity. MSE relies on sample entropy. However, MSE may yield imprecise complexity estimation at large scales, because sample entropy does not give precise estimation of entropy when short signals are processed. A refined composite multiscale entropy (RCMSE) has therefore recently been proposed. Nevertheless, RCMSE is for univariate signals only. The simultaneous analysis of multi-channel (multivariate) data often over-performs studies based on univariate signals. We therefore introduce an extension of RCMSE to multivariate data. Applications of multivariate RCMSE to simulated processes reveal its better performances over the standard multivariate MSE. - Highlights: • Multiscale entropy quantifies data complexity but may be inaccurate at large scale. • A refined composite multiscale entropy (RCMSE) has therefore recently been proposed. • Nevertheless, RCMSE is adapted to univariate time series only. • We herein introduce an extension of RCMSE to multivariate data. • It shows better performances than the standard multivariate multiscale entropy.

Effect of Cellulases and Xylanases on Refining Process and Kraft Pulp Properties.

Directory of Open Access Journals (Sweden)

Kamila Przybysz Buzała

Full Text Available Samples of bleached kraft pine cellulosic pulp, either treated with an enzyme preparation (a Thermomyces lanuginosus xylanase, an Aspergillus sp. cellulase, and a multienzyme preparation NS-22086 containing both these activities or untreated, were refined in a laboratory PFI mill. The treatment with cellulases contained in the last two preparations significantly improved the pulp's susceptibility to refining (the target freeness value of 30°SR was achieved in a significantly shorter time, increased water retention value (WRV and fines contents while the weighted average fiber length was significantly reduced. These changes of pulp parameters caused deterioration of paper strength properties. The treatment with the xylanase, which partially hydrolyzed xylan, small amounts of which are associated with cellulose fibers, only slightly loosened the structure of fibers. These subtle changes positively affected the susceptibility of the pulp to refining (refining energy was significantly reduced and improved the static strength properties of paper. Thus, the treatment of kraft pulps with xylanases may lead to substantial savings of refining energy without negative effects on paper characteristics.

Synthesis of Al-5Ti-1B Refiner by Melt Reaction Method

Directory of Open Access Journals (Sweden)

LI He

2017-02-01

Full Text Available Al-5Ti-1B refiner was successfully prepared by melt reaction method. Through the thermodynamics calculation, the initial reaction temperature was determined. The influence of reaction temperature on microstructure and absorption rate of the alloy was investigated. The phase and microstructure of the alloy were observed by X-ray diffraction, scanning electron microscope and energy dispersive spectrometer. The Al-5Ti-1B refiner was extruded at high temperature to wire with the diameter of 9.5mm, and then the refinement experiment was carried out on pure aluminium. The results indicate that the refiner consists of TiB2, TiAl3 and α-Al, and the microstructure prepared at 850℃ is the optimum and the absorption rate of Ti and B matches the best. The TiAl3 and TiB2 phases distribute homogeneously in the matrix after extrusion. When adding 0.2%(mass fraction of Al-5Ti-1B refiner, the grain size of pure aluminium reduces from 3.99mm to 0.45mm.

Region-of-interest volumetric visual hull refinement

KAUST Repository

Knoblauch, Daniel

2010-01-01

This paper introduces a region-of-interest visual hull refinement technique, based on flexible voxel grids for volumetric visual hull reconstructions. Region-of-interest refinement is based on a multipass process, beginning with a focussed visual hull reconstruction, resulting in a first 3D approximation of the target, followed by a region-of-interest estimation, tasked with identifying features of interest, which in turn are used to locally refine the voxel grid and extract a higher-resolution surface representation for those regions. This approach is illustrated for the reconstruction of avatars for use in tele-immersion environments, where head and hand regions are of higher interest. To allow reproducability and direct comparison a publicly available data set for human visual hull reconstruction is used. This paper shows that region-of-interest reconstruction of the target is faster and visually comparable to higher resolution focused visual hull reconstructions. This approach reduces the amount of data generated through the reconstruction, allowing faster post processing, as rendering or networking of the surface voxels. Reconstruction speeds support smooth interactions between the avatar and the virtual environment, while the improved resolution of its facial region and hands creates a higher-degree of immersion and potentially impacts the perception of body language, facial expressions and eye-to-eye contact. Copyright © 2010 by the Association for Computing Machinery, Inc.

Pacific Basin Heavy Oil Refining Capacity

Directory of Open Access Journals (Sweden)

David Hackett

2013-02-01

Full Text Available The United States today is Canada’s largest customer for oil and refined oil products. However, this relationship may be strained due to physical, economic and political influences. Pipeline capacity is approaching its limits; Canadian oil is selling at substantive discounts to world market prices; and U.S. demand for crude oil and finished products (such as gasoline, has begun to flatten significantly relative to historical rates. Lower demand, combined with increased shale oil production, means U.S. demand for Canadian oil is expected to continue to decline. Under these circumstances, gaining access to new markets such as those in the Asia-Pacific region is becoming more and more important for the Canadian economy. However, expanding pipeline capacity to the Pacific via the proposed Northern Gateway pipeline and the planned Trans Mountain pipeline expansion is only feasible when there is sufficient demand and processing capacity to support Canadian crude blends. Canadian heavy oil requires more refining and produces less valuable end products than other lighter and sweeter blends. Canadian producers must compete with lighter, sweeter oils from the Middle East, and elsewhere, for a place in the Pacific Basin refineries built to handle heavy crude blends. Canadian oil sands producers are currently expanding production capacity. Once complete, the Northern Gateway pipeline and the Trans Mountain expansion are expected to deliver an additional 500,000 to 1.1 million barrels a day to tankers on the Pacific coast. Through this survey of the capacity of Pacific Basin refineries, including existing and proposed facilities, we have concluded that there is sufficient technical capacity in the Pacific Basin to refine the additional Canadian volume; however, there may be some modifications required to certain refineries to allow them to process Western Canadian crude. Any additional capacity for Canadian oil would require refinery modifications or

Development of a Refined Staff Group Trainer

National Research Council Canada - National Science Library

Quensel, Susan

1999-01-01

.... As a follow-on effort to the previous SGT project, the goal was to refine a brigade-level staff training program to more effectively and efficiently coordinate the activities within and between the...

Discontinuous Galerkin discretization and hp-refinement for the resolution of the neutron transport equation

International Nuclear Information System (INIS)

Fournier, Damien; Le-Tellier, Romain; Herbin, Raphaele

2013-01-01

This paper presents an hp-refinement method for a first order scalar transport reaction equation discretized by a discontinuous Galerkin method. First, the theoretical rates of convergence of h- and p-refinement are recalled and numerically tested. Then, in order to design some meshes, we propose two different estimators of the local error on the spatial domain. These quantities are analyzed and compared depending on the regularity of the solution so as to find the best way to lead the refinement process and the best strategy to choose between h- and p-refinement. Finally, the different possible refinement strategies are compared first on analytical examples and then on realistic applications for neutron transport in a nuclear reactor core. (authors)

Effect of zirconium addition on welding of aluminum grain refined by titanium

International Nuclear Information System (INIS)

Zaid, A.I.O.

2011-01-01

Aluminum and its alloys solidify in large grains columnar structure which tends to reduce their mechanical behaviour and surface quality. Therefore, they are industrially grain refined by titanium or titanium + boron. Furthermore, aluminum oxidizes in ordinary atmosphere which makes its weldability difficult and weak. Therefore, it is anticipated that the effect of addition of zirconium at a weight percentages of 0.1% (which proved to be an effective grain refiner on the weldability of aluminum grain refined by Ti) is worthwhile investigating. This formed the objective of this research work. In this paper, the effect of zirconium addition at a weight percentage of 0.1%, which corresponds to the peritctic limit on the aluminum-zirconium phase diagram, on the weldability of aluminum grain refined by Ti is investigated. Rolled sheets of commercially pure aluminum, Al grain refined Ti of 3 mm thickness were welded together using Gas Tungsten Arc Welding method (GTAW), formerly known as TIG. A constant air gap was maintained at a constant current level, 30 ampere AC, was used because it removes the oxides of the welding process under the same process parameters. Metallographic examination of weldments of the different combinations of aluminum and its microalloys at the heat affected zone, HAZ, and base metal was carried out and examined for width, porosity, cracks and microhardness. It was found that grain refining of commercially pure aluminum by Ti resulted in enhancement of its weldability. Similarly, addition of zirconium to Al grain refined by Ti resulted in further enhancement of the weldment. Photomicrographs of the HAZ regions are presented and discussed. (author)

Validating neural-network refinements of nuclear mass models

Science.gov (United States)

Utama, R.; Piekarewicz, J.

2018-01-01

Background: Nuclear astrophysics centers on the role of nuclear physics in the cosmos. In particular, nuclear masses at the limits of stability are critical in the development of stellar structure and the origin of the elements. Purpose: We aim to test and validate the predictions of recently refined nuclear mass models against the newly published AME2016 compilation. Methods: The basic paradigm underlining the recently refined nuclear mass models is based on existing state-of-the-art models that are subsequently refined through the training of an artificial neural network. Bayesian inference is used to determine the parameters of the neural network so that statistical uncertainties are provided for all model predictions. Results: We observe a significant improvement in the Bayesian neural network (BNN) predictions relative to the corresponding "bare" models when compared to the nearly 50 new masses reported in the AME2016 compilation. Further, AME2016 estimates for the handful of impactful isotopes in the determination of r -process abundances are found to be in fairly good agreement with our theoretical predictions. Indeed, the BNN-improved Duflo-Zuker model predicts a root-mean-square deviation relative to experiment of σrms≃400 keV. Conclusions: Given the excellent performance of the BNN refinement in confronting the recently published AME2016 compilation, we are confident of its critical role in our quest for mass models of the highest quality. Moreover, as uncertainty quantification is at the core of the BNN approach, the improved mass models are in a unique position to identify those nuclei that will have the strongest impact in resolving some of the outstanding questions in nuclear astrophysics.

Oil refining and product market developments in Europe

International Nuclear Information System (INIS)

McDonald, P.

1991-01-01

One political development in Europe that will affect the petroleum refining industry is the opening of a single market among the European Commission countries. Although the single market officially opens on January 1, 1993, a single market for energy will not happen at that time. Most European countries feel that refining is a strategic industry and adopt some form of protectionism in this sector. Environmental policy in Europe tends to be separate from energy policy, making conflicts in setting standards for emissions and fuel composition somewhat inevitable. For example, both environmental and energy policies favor a carbon tax on fuels; the EC environmental commission does not want to be seen as favoring nuclear power, so it favors penalizing all fuels about the same amount, while the energy commission says the carbon tax should be related to the fuel carbon content. A measure affecting the refining industry is the proposal for reducing sulfur in diesel fuel. By 1994 EC countries will have a common 0.2% standard and by 1996 a 0.05% standard for automotive diesel. To meet the latter standard, refineries will need upgrading at an estimated cost of US$4 billion. Another political consideration for the refining industry is whether eastern Europe should be part of the EC energy community. However, if there is a reluctance in the western European countries for a single western market, there is even less enthusiasm for an energy market that includes eastern Europe as well. In addition, there is a reluctance to accept that there should be a free flow of petroleum products from east to west

Grain refinement of Aluminium alloys using friction stir processing

International Nuclear Information System (INIS)

Khraisheh, M.

2004-01-01

Full text.Friction Stir Processing (FSP) is a new advanced material processing technique used to refine and homogenize the microstructure of sheet metals. FSP is a solid state processing technique that uses a rapidly rotating non-consumable high strength tool steel pin that extends from a cylindrical shoulder. The rotating pin is forced with a predetermined load into the work piece and moved along with the work pieces, while the rotating pin deforms and stirs the locally heated material. It is a hot working process in which a large amount of deformation is imparted to the sheet. FS processed zone is characterized by dynamic recrystallization which results in grain refinement . this promising emerging process needs further investigations to develop optimum process parameters to produce the desired microstructure. In this work, we present preliminary results on the effects of rotational and translational speeds on grain refinement of AA5052. Under certain processing conditions, sub-micron grain structure was produced using this technique

Anomalies in the refinement of isoleucine

NARCIS (Netherlands)

Berntsen, K.R.M.; Vriend, G.

2014-01-01

A study of isoleucines in protein structures solved using X-ray crystallography revealed a series of systematic trends for the two side-chain torsion angles chi1 and chi2 dependent on the resolution, secondary structure and refinement software used. The average torsion angles for the nine rotamers

Automata Learning through Counterexample Guided Abstraction Refinement

DEFF Research Database (Denmark)

Aarts, Fides; Heidarian, Faranak; Kuppens, Harco

2012-01-01

to a small set of abstract events that can be handled by automata learning tools. In this article, we show how such abstractions can be constructed fully automatically for a restricted class of extended finite state machines in which one can test for equality of data parameters, but no operations on data...... are allowed. Our approach uses counterexample-guided abstraction refinement: whenever the current abstraction is too coarse and induces nondeterministic behavior, the abstraction is refined automatically. Using Tomte, a prototype tool implementing our algorithm, we have succeeded to learn – fully......Abstraction is the key when learning behavioral models of realistic systems. Hence, in most practical applications where automata learning is used to construct models of software components, researchers manually define abstractions which, depending on the history, map a large set of concrete events...

Grain size refinement of inconel 718 thermomechanical processing

International Nuclear Information System (INIS)

Okimoto, P.C.

1988-01-01

Inconel 718 is a Ni-Fe precipitation treated superalloy. It presents good thermal fatigue properties when the material has small grain size. The aim of this work is to study the grain size refinement by thermomechanical processing, through observations of the microstructural evolution and the influence of some of the process variables in the final grain size. The results have shown that this refinement occured by static recrystallization. The presence of precipitates have influenced the final grain size if the deformations are below 60%. For greater deformations the grain size is independent of the precipitate distribution in the matrix and tends to a limit size of 5 μm. (author)

Numerical solution of plasma fluid equations using locally refined grids

International Nuclear Information System (INIS)

Colella, P.

1997-01-01

This paper describes a numerical method for the solution of plasma fluid equations on block-structured, locally refined grids. The plasma under consideration is typical of those used for the processing of semiconductors. The governing equations consist of a drift-diffusion model of the electrons and an isothermal model of the ions coupled by Poisson's equation. A discretization of the equations is given for a uniform spatial grid, and a time-split integration scheme is developed. The algorithm is then extended to accommodate locally refined grids. This extension involves the advancement of the discrete system on a hierarchy of levels, each of which represents a degree of refinement, together with synchronization steps to ensure consistency across levels. A brief discussion of a software implementation is followed by a presentation of numerical results

EXPTIME-Completeness of Thorough Refinement on Modal Transition Systems

DEFF Research Database (Denmark)

Beneš, Nikola; Křetínský, Jan; Larsen, Kim Guldstrand

2012-01-01

Modal transition systems (MTS), a specification formalism introduced more than 20 years ago, has recently received a considerable attention in several different areas. Many of the fundamental questions related to MTSs have already been answered. However, the problem of the exact computational...... complexity of thorough refinement checking between two finite MTSs remained unsolved. We settle down this question by showing EXPTIME-completeness of thorough refinement checking on finite MTSs. The upper-bound result relies on a novel algorithm running in single exponential time providing a direct goal...

National oil companies' presence to hike US refining competition

International Nuclear Information System (INIS)

Anon.

1992-01-01

This paper reports that the downstream segment of the U.S. petroleum business is virtually certain to become more competitive because of the growing presence of national oil companies in the country's refining industry. That's a forecast by New York investment firm Kidder Peabody. It cites a plan by Mexico's Petroleos Mexicanos (Pemex) to form a joint venture with Shell Oil Co. covering Shell's 225,000 b/d Deer Park, Tex., refinery as the latest example of national oil companies' movement into U.S. refining

Limit of grain refinement during ECAP process. Temperature influence

International Nuclear Information System (INIS)

Chuvil'deev, V.N.; Kopylov, V.I.; Nokhrin, A.V.; Makarov, I.M.; Lopatin, Yu.G.

2004-01-01

Experimental and theoretical study results are reported for the process of deformation grain refinement under severe plastic deformation. A generalization is made for experimental study results on deformation dispersing of unalloyed metals and aluminium and magnesium base alloys. The model is built that allows calculating the value of minimum grain size attained by the method of equal-channel angular pressing. The expressions are derived which describe the dependence of grain refinement limit on the nature of material and the temperature of severe plastic deformation [ru

Process technology for refining crude soybean oil – a product from ...

African Journals Online (AJOL)

Process technology for refining crude soybean oil – a product from soycake meal production in Ghana. ... yield of 83.3 per cent was recorded. Results of quality assessment of the final laboratory refined oil compared favourably with Ghana Standards Board's specification for edible soybean oil. Ghana Journal of Science Vol.

Robust Refinement as Implemented in TOPAS

Energy Technology Data Exchange (ETDEWEB)

Stone, K.; Stephens, P

2010-01-01

A robust refinement procedure is implemented in the program TOPAS through an iterative reweighting of the data. Examples are given of the procedure as applied to fitting partially overlapped peaks by full and partial models and also of the structures of ibuprofen and acetaminophen in the presence of unmodeled impurity contributions

Neurons refine the Caenorhabditis elegans body plan by directing axial patterning by Wnts.

Directory of Open Access Journals (Sweden)

Katarzyna Modzelewska

Full Text Available Metazoans display remarkable conservation of gene families, including growth factors, yet somehow these genes are used in different ways to generate tremendous morphological diversity. While variations in the magnitude and spatio-temporal aspects of signaling by a growth factor can generate different body patterns, how these signaling variations are organized and coordinated during development is unclear. Basic body plans are organized by the end of gastrulation and are refined as limbs, organs, and nervous systems co-develop. Despite their proximity to developing tissues, neurons are primarily thought to act after development, on behavior. Here, we show that in Caenorhabditis elegans, the axonal projections of neurons regulate tissue progenitor responses to Wnts so that certain organs develop with the correct morphology at the right axial positions. We find that foreshortening of the posteriorly directed axons of the two canal-associated neurons (CANs disrupts mid-body vulval morphology, and produces ectopic vulval tissue in the posterior epidermis, in a Wnt-dependent manner. We also provide evidence that suggests that the posterior CAN axons modulate the location and strength of Wnt signaling along the anterior-posterior axis by employing a Ror family Wnt receptor to bind posteriorly derived Wnts, and hence, refine their distributions. Surprisingly, despite high levels of Ror expression in many other cells, these cells cannot substitute for the CAN axons in patterning the epidermis, nor can cells expressing a secreted Wnt inhibitor, SFRP-1. Thus, unmyelinated axon tracts are critical for patterning the C. elegans body. Our findings suggest that the evolution of neurons not only improved metazoans by increasing behavioral complexity, but also by expanding the diversity of developmental patterns generated by growth factors such as Wnts.

A simple nodal force distribution method in refined finite element meshes

Energy Technology Data Exchange (ETDEWEB)

Park, Jai Hak [Chungbuk National University, Chungju (Korea, Republic of); Shin, Kyu In [Gentec Co., Daejeon (Korea, Republic of); Lee, Dong Won [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of); Cho, Seungyon [National Fusion Research Institute, Daejeon (Korea, Republic of)

2017-05-15

In finite element analyses, mesh refinement is frequently performed to obtain accurate stress or strain values or to accurately define the geometry. After mesh refinement, equivalent nodal forces should be calculated at the nodes in the refined mesh. If field variables and material properties are available at the integration points in each element, then the accurate equivalent nodal forces can be calculated using an adequate numerical integration. However, in certain circumstances, equivalent nodal forces cannot be calculated because field variable data are not available. In this study, a very simple nodal force distribution method was proposed. Nodal forces of the original finite element mesh are distributed to the nodes of refined meshes to satisfy the equilibrium conditions. The effect of element size should also be considered in determining the magnitude of the distributing nodal forces. A program was developed based on the proposed method, and several example problems were solved to verify the accuracy and effectiveness of the proposed method. From the results, accurate stress field can be recognized to be obtained from refined meshes using the proposed nodal force distribution method. In example problems, the difference between the obtained maximum stress and target stress value was less than 6 % in models with 8-node hexahedral elements and less than 1 % in models with 20-node hexahedral elements or 10-node tetrahedral elements.

3Drefine: an interactive web server for efficient protein structure refinement.

Science.gov (United States)

Bhattacharya, Debswapna; Nowotny, Jackson; Cao, Renzhi; Cheng, Jianlin

2016-07-08

3Drefine is an interactive web server for consistent and computationally efficient protein structure refinement with the capability to perform web-based statistical and visual analysis. The 3Drefine refinement protocol utilizes iterative optimization of hydrogen bonding network combined with atomic-level energy minimization on the optimized model using a composite physics and knowledge-based force fields for efficient protein structure refinement. The method has been extensively evaluated on blind CASP experiments as well as on large-scale and diverse benchmark datasets and exhibits consistent improvement over the initial structure in both global and local structural quality measures. The 3Drefine web server allows for convenient protein structure refinement through a text or file input submission, email notification, provided example submission and is freely available without any registration requirement. The server also provides comprehensive analysis of submissions through various energy and statistical feedback and interactive visualization of multiple refined models through the JSmol applet that is equipped with numerous protein model analysis tools. The web server has been extensively tested and used by many users. As a result, the 3Drefine web server conveniently provides a useful tool easily accessible to the community. The 3Drefine web server has been made publicly available at the URL: http://sysbio.rnet.missouri.edu/3Drefine/. © The Author(s) 2016. Published by Oxford University Press on behalf of Nucleic Acids Research.

An adaptive grid refinement strategy for the simulation of negative streamers

International Nuclear Information System (INIS)

Montijn, C.; Hundsdorfer, W.; Ebert, U.

2006-01-01

The evolution of negative streamers during electric breakdown of a non-attaching gas can be described by a two-fluid model for electrons and positive ions. It consists of continuity equations for the charged particles including drift, diffusion and reaction in the local electric field, coupled to the Poisson equation for the electric potential. The model generates field enhancement and steep propagating ionization fronts at the tip of growing ionized filaments. An adaptive grid refinement method for the simulation of these structures is presented. It uses finite volume spatial discretizations and explicit time stepping, which allows the decoupling of the grids for the continuity equations from those for the Poisson equation. Standard refinement methods in which the refinement criterion is based on local error monitors fail due to the pulled character of the streamer front that propagates into a linearly unstable state. We present a refinement method which deals with all these features. Tests on one-dimensional streamer fronts as well as on three-dimensional streamers with cylindrical symmetry (hence effectively 2D for numerical purposes) are carried out successfully. Results on fine grids are presented, they show that such an adaptive grid method is needed to capture the streamer characteristics well. This refinement strategy enables us to adequately compute negative streamers in pure gases in the parameter regime where a physical instability appears: branching streamers

Assessment of Energy Efficiency Improvement in the United States Petroleum Refining Industry

Energy Technology Data Exchange (ETDEWEB)

Morrow, William R. [Ernest Orlando Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States); Marano, John [JM Energy Consulting, Inc.; Sathaye, Jayant [Ernest Orlando Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States); Hasanbeigi, Ali [Ernest Orlando Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States); Xu, Tengfang [Ernest Orlando Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

2013-02-01

-effective given U.S. DOE fuel price forecasts. This represents roughly 70 million metric tonnes of CO₂ emission reductions assuming 2010 emissions factor for grid electricity. Energy efficiency measures resulting in an additional 400 PJ per year of primary fuels savings and close to 1,700 GWh per year of electricity savings, and an associated 24 million metric tonnes of CO₂ emission reductions are not cost-effective given the same assumption with respect to fuel prices and electricity emissions factors. Compared to the modeled energy requirements for the U.S. petroleum refining sector, the cost effective potential represents a 40% reduction in fuel consumption and a 2% reduction in electricity consumption. The non-cost-effective potential represents an additional 13% reduction in fuel consumption and an additional 7% reduction in electricity consumption. The relative energy reduction potentials are mu ch higher for fuel consumption than electricity consumption largely in part because fuel is the primary energy consumption type in the refineries. Moreover, many cost effective fuel savings measures would increase electricity consumption. The model also has the potential to be used to examine the costs and benefits of the other CO₂ mitigation options, such as combined heat and power (CHP), carbon capture, and the potential introduction of biomass feedstocks. However, these options are not addressed in this report as this report is focused on developing the modeling methodology and assessing fuels savings measures. These opportunities to further reduce refinery sector CO₂ emissions and are recommended for further research and analysis.

Process for refining naphthalene, etc

Energy Technology Data Exchange (ETDEWEB)

Petroff, G

1922-05-13

A process is described for the refining of naphthalene, its distillates, and mineral oils by the use of dilute sulfuric acid, characterized in that the oils are oxidized with oxygen of the air and thereafter are treated with 65 to 75 percent sulfuric acid to separate the unsaturated hydrocarbons in the form of polymerized products whereby, if necessary, heating and application of usual or higher pressure can take place.

Bauxite Mining and Alumina Refining

OpenAIRE

Donoghue, A. Michael; Frisch, Neale; Olney, David

2014-01-01

Objective: To describe bauxite mining and alumina refining processes and to outline the relevant physical, chemical, biological, ergonomic, and psychosocial health risks. Methods: Review article. Results: The most important risks relate to noise, ergonomics, trauma, and caustic soda splashes of the skin/eyes. Other risks of note relate to fatigue, heat, and solar ultraviolet and for some operations tropical diseases, venomous/dangerous animals, and remote locations. Exposures to bauxite dust,...

Separation of CsCl and SrCl_2 from a ternary CsCl-SrCl_2-LiCl via a zone refining process for waste salt minimization of pyroprocessing

International Nuclear Information System (INIS)

Shim, Moonsoo; Choi, Ho Gil; Yi, Kyung Woo; Hwang, Il Soon; Lee, Jong Hyeon

2016-01-01

The purification of LiCl salt mixture has traditionally been carried out by a melt crystallization process. To improve the throughput of zone refining, three heaters were installed in the zone refiner. The zone refining method was used to grow pure LiCl salt ingots from LiCl-CsCl-SrCl_2 salt mixture. The main investigated parameters were the heater speed and the number of passes. A change in the LiCl crystal grain size was observed according to the horizontal direction. From each zone refined salt ingot, samples were collected horizontally. To analyze the concentrations of Sr and Cs, an inductively coupled plasma optical emission spectrometer and inductively coupled plasma mass spectrometer were used, respectively. The experimental results show that Sr and Cs concentrations at the initial region of the ingot were low and reached their peak at the final freezing region of the salt ingot. Concentration results of zone refined salt were compared with theoretical results yielded by the proposed model to validate its predictions. The k_e_f_f of Sr and Cs were 0.13 and 0.11, respectively. The decontamination factors of Sr and Cs were 450 and 1650, respectively. - Highlights: • The LiCl-CsCl-SrCl_2 salt ingot was purified by zone refining technique to minimize waste salt. • The concentration distribution of Cs and Sr were analyzed by mass transfer equation. • The decontamination factors of Cs and Sr were 1600 and 450 respectively in case of 60% of recovery yield.

SFESA: a web server for pairwise alignment refinement by secondary structure shifts.

Science.gov (United States)

Tong, Jing; Pei, Jimin; Grishin, Nick V

2015-09-03

Protein sequence alignment is essential for a variety of tasks such as homology modeling and active site prediction. Alignment errors remain the main cause of low-quality structure models. A bioinformatics tool to refine alignments is needed to make protein alignments more accurate. We developed the SFESA web server to refine pairwise protein sequence alignments. Compared to the previous version of SFESA, which required a set of 3D coordinates for a protein, the new server will search a sequence database for the closest homolog with an available 3D structure to be used as a template. For each alignment block defined by secondary structure elements in the template, SFESA evaluates alignment variants generated by local shifts and selects the best-scoring alignment variant. A scoring function that combines the sequence score of profile-profile comparison and the structure score of template-derived contact energy is used for evaluation of alignments. PROMALS pairwise alignments refined by SFESA are more accurate than those produced by current advanced alignment methods such as HHpred and CNFpred. In addition, SFESA also improves alignments generated by other software. SFESA is a web-based tool for alignment refinement, designed for researchers to compute, refine, and evaluate pairwise alignments with a combined sequence and structure scoring of alignment blocks. To our knowledge, the SFESA web server is the only tool that refines alignments by evaluating local shifts of secondary structure elements. The SFESA web server is available at http://prodata.swmed.edu/sfesa.

Reintroducing electrostatics into macromolecular crystallographic refinement: application to neutron crystallography and DNA hydration.

Science.gov (United States)

Fenn, Timothy D; Schnieders, Michael J; Mustyakimov, Marat; Wu, Chuanjie; Langan, Paul; Pande, Vijay S; Brunger, Axel T

2011-04-13

Most current crystallographic structure refinements augment the diffraction data with a priori information consisting of bond, angle, dihedral, planarity restraints, and atomic repulsion based on the Pauli exclusion principle. Yet, electrostatics and van der Waals attraction are physical forces that provide additional a priori information. Here, we assess the inclusion of electrostatics for the force field used for all-atom (including hydrogen) joint neutron/X-ray refinement. Two DNA and a protein crystal structure were refined against joint neutron/X-ray diffraction data sets using force fields without electrostatics or with electrostatics. Hydrogen-bond orientation/geometry favors the inclusion of electrostatics. Refinement of Z-DNA with electrostatics leads to a hypothesis for the entropic stabilization of Z-DNA that may partly explain the thermodynamics of converting the B form of DNA to its Z form. Thus, inclusion of electrostatics assists joint neutron/X-ray refinements, especially for placing and orienting hydrogen atoms. Copyright © 2011 Elsevier Ltd. All rights reserved.

Excessive Refined Carbohydrates and Scarce Micronutrients Intakes Increase Inflammatory Mediators and Insulin Resistance in Prepubertal and Pubertal Obese Children Independently of Obesity

Directory of Open Access Journals (Sweden)

Mardia López-Alarcón

2014-01-01

Full Text Available Background. Low-grade inflammation is the link between obesity and insulin resistance. Because physiologic insulin resistance occurs at puberty, obese pubertal children are at higher risk for insulin resistance. Excessive diets in refined carbohydrates and saturated fats are risk factors for insulin resistance, but calcium, magnesium, vitamin-D, and the omega-3 fatty acids likely protect against inflammation and insulin resistance. Objective. To analyze interactions among dietary saturated fat, refined carbohydrates, calcium, magnesium, vitamin D, and omega-3 fatty acids on the risk of inflammation and insulin resistance in a sample of prepubertal and pubertal children. Methods. A sample of 229 children from Mexico City was analyzed in a cross-sectional design. Anthropometric measurements, 24 h recall questionnaires, and blood samples were obtained. Serum insulin, glucose, calcium, magnesium, 25-OHD3, C-reactive protein, leptin, adiponectin, and erythrocytes fatty acids were measured. Parametric and nonparametric statistics were used for analysis. Results. While mean macronutrients intake was excessive, micronutrients intake was deficient (P<0.01. Inflammation determinants were central obesity and magnesium-deficient diets. Determinants of insulin resistance were carbohydrates intake and circulating magnesium and adiponectin. Conclusions. Magnesium-deficient diets are determinants of inflammation, while high intake of refined carbohydrates is a risk factor for insulin resistance, independently of central adiposity.

40 CFR 80.245 - How does a small refiner apply for a sulfur baseline?

Science.gov (United States)

2010-07-01

... sulfur baseline? 80.245 Section 80.245 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY... Provisions § 80.245 How does a small refiner apply for a sulfur baseline? (a) Any refiner seeking small refiner status must apply for a refinery sulfur baseline by the deadline under § 80.235 for each of the...

Influences of binding to dissolved organic matter on hydrophobic organic compounds in a multi-contaminant system: Coefficients, mechanisms and ecological risks

International Nuclear Information System (INIS)

Li, Yi-Long; He, Wei; Liu, Wen-Xiu; Kong, Xiang-Zhen; Yang, Bin; Yang, Chen; Xu, Fu-Liu

2015-01-01

The complexation flocculation (CF) method was successfully employed to identify binding coefficients (K_d_o_c) of specific organic contaminants to dissolved organic matter (DOM, often indicated by dissolved organic carbon, DOC) in a multi-contaminant hydrophobic organic contaminant (HOC) system. K_d_o_c values were obtained for most of the evaluated 33 HOCs, indicating the feasibility and applicability of the CF method in a multi-contaminant system. Significant positive correlations were observed between binding coefficients and octanol–water partition coefficients (K_o_w) for organic halogen compounds, such as polybrominated diphenyl ethers (PBDEs) (R"2 = 0.95, p < 0.05) and organic chlorine pesticides (OCPs) (methoxychlor excluded, R"2 = 0.82, p < 0.05). The positive correlations identified between the lgK_d_o_c and lgBCF (bioconcentration factor) for PBDEs and OCPs, as well as the negative correlation observed for polycyclic aromatic hydrocarbons (PAHs), indicated that different binding or partition mechanisms between PAHs and organic halogen compounds exist. These differences further result in discriminative competition partitions of HOCs between DOM and organisms. Assuming that only freely dissolved HOCs are bioconcentrative, the results of DOM-influenced bioconcentration factor (BCF_D_O_M) and DOM-influenced lowest observed effect level (LOEL_D_O_M) indicate that the ecological risk of HOCs is decreased by DOM. - Highlights: • Complexing-flocculation is viable in measuring K_d_o_c in a multi-polluted system. • The binding mechanisms between PAHs and organic halogens were different. • DOM should be considered when assessing ecological risk of HOCs in natural ecosystem. - Assuming only freely dissolved HOCs are effective, bioconcentration factors and ecological risks of HOCs are decreased by dissolved organic matter via binding.

Refining of fossil resin flotation concentrate from western coal. Final report

Energy Technology Data Exchange (ETDEWEB)

Jensen, G.F.; Miller, J.D.

1995-02-16

During the past several years, significant research efforts have been made to develop process technology for the selective flotation of fossil resin from western coals. As a result of these efforts, several new flotation technologies have been developed. Operation of a proof-of-concept continuous flotation circuit showed the selective flotation process to be sufficiently profitable to justify the development of a fossil resin industry. However, little attention has been given to the refining of the fossil resin flotation concentrate although solvent refining is a critical step for the fossil resin to become a marketable product. In view of this situation, DOE funded this two-year project to evaluate the following aspects of the fossil resin refining technology: 1) Characterization of the fossil resin flotation concentrate and its refined products; 2) Kinetics of fossil resin extraction; 3) Effects of operating variables on solvent extraction; 4) Extraction solvents; 5) Proof-of-concept continuous refining tests; and 6) Technical and economic analysis. The results from this research effort have led to the following conclusions: Hexane- or heptane-refined fossil resin has a light-yellow color, a melting point of 140 - 142{degrees}C, a density of 1.034 gram/cm, and good solubility in nonpolar solvents. Among the four solvents evaluated (hexane, heptane, toluene and ethyl acetate), hexane is the most appropriate solvent based on overall technical and economic considerations. Batch extraction tests and kinetic studies suggest that the main interaction between the resin and the solvent is expected to be the forces associated with solvation phenomena. Temperature has the most significant effect on extraction rate. With hexane as the solvent, a recovery of 90% cam be achieved at 50{degrees}C and 10% solids concentration with moderate agitation for 1 hour.

Refined reservoir description to maximize oil recovery

International Nuclear Information System (INIS)

Flewitt, W.E.

1975-01-01

To assure maximized oil recovery from older pools, reservoir description has been advanced by fully integrating original open-hole logs and the recently introduced interpretive techniques made available through cased-hole wireline saturation logs. A refined reservoir description utilizing normalized original wireline porosity logs has been completed in the Judy Creek Beaverhill Lake ''A'' Pool, a reefal carbonate pool with current potential productivity of 100,000 BOPD and 188 active wells. Continuous porosity was documented within a reef rim and cap while discontinuous porous lenses characterized an interior lagoon. With the use of pulsed neutron logs and production data a separate water front and pressure response was recognized within discrete environmental units. The refined reservoir description aided in reservoir simulation model studies and quantifying pool performance. A pattern water flood has now replaced the original peripheral bottom water drive to maximize oil recovery

Refined open intersection numbers and the Kontsevich-Penner matrix model

Energy Technology Data Exchange (ETDEWEB)

Alexandrov, Alexander [Center for Geometry and Physics, Institute for Basic Science (IBS),Pohang 37673 (Korea, Republic of); Centre de Recherches Mathématiques (CRM), Université de Montréal,Montréal (Canada); Department of Mathematics and Statistics, Concordia University,Montréal (Canada); Institute for Theoretical and Experimental Physics (ITEP),Moscow (Russian Federation); Buryak, Alexandr [Department of Mathematics, ETH Zurich, Zurich (Switzerland); Tessler, Ran J. [Institute for Theoretical Studies, ETH Zurich,Zurich (Switzerland)

2017-03-23

A study of the intersection theory on the moduli space of Riemann surfaces with boundary was recently initiated in a work of R. Pandharipande, J.P. Solomon and the third author, where they introduced open intersection numbers in genus 0. Their construction was later generalized to all genera by J.P. Solomon and the third author. In this paper we consider a refinement of the open intersection numbers by distinguishing contributions from surfaces with different numbers of boundary components, and we calculate all these numbers. We then construct a matrix model for the generating series of the refined open intersection numbers and conjecture that it is equivalent to the Kontsevich-Penner matrix model. An evidence for the conjecture is presented. Another refinement of the open intersection numbers, which describes the distribution of the boundary marked points on the boundary components, is also discussed.

Refined open intersection numbers and the Kontsevich-Penner matrix model

International Nuclear Information System (INIS)

Alexandrov, Alexander; Buryak, Alexandr; Tessler, Ran J.

2017-01-01

A study of the intersection theory on the moduli space of Riemann surfaces with boundary was recently initiated in a work of R. Pandharipande, J.P. Solomon and the third author, where they introduced open intersection numbers in genus 0. Their construction was later generalized to all genera by J.P. Solomon and the third author. In this paper we consider a refinement of the open intersection numbers by distinguishing contributions from surfaces with different numbers of boundary components, and we calculate all these numbers. We then construct a matrix model for the generating series of the refined open intersection numbers and conjecture that it is equivalent to the Kontsevich-Penner matrix model. An evidence for the conjecture is presented. Another refinement of the open intersection numbers, which describes the distribution of the boundary marked points on the boundary components, is also discussed.

State of European refining industry is less bleak than reported

International Nuclear Information System (INIS)

Jenkins, J.H.

1997-01-01

It is difficult to pick up a trade publication without reading of the imminent demise of the European refining industry. Major oil companies are combining operations to minimize costs. Refineries are being shuttered, and analysts are calling for the immediate closure of many more plants. There is little doubt that European cracking margins have fallen since the early 1990s, in step with the rest of the world. However, the refining industry in Europe does not, in the opinion of Pace Consultants Inc., suffer from some overriding fundamental flaw that dooms it to low margins forever. The intent of this article is to put some of the industry's recent events in perspective, to discuss some of the fundamental differences between American and European operations, and to perhaps lay to rest the idea that refining is somehow dead in Europe

Automating crystallographic structure solution and refinement of protein–ligand complexes

International Nuclear Information System (INIS)

Echols, Nathaniel; Moriarty, Nigel W.; Klei, Herbert E.; Afonine, Pavel V.; Bunkóczi, Gábor; Headd, Jeffrey J.; McCoy, Airlie J.; Oeffner, Robert D.; Read, Randy J.; Terwilliger, Thomas C.; Adams, Paul D.

2013-01-01

A software system for automated protein–ligand crystallography has been implemented in the Phenix suite. This significantly reduces the manual effort required in high-throughput crystallographic studies. High-throughput drug-discovery and mechanistic studies often require the determination of multiple related crystal structures that only differ in the bound ligands, point mutations in the protein sequence and minor conformational changes. If performed manually, solution and refinement requires extensive repetition of the same tasks for each structure. To accelerate this process and minimize manual effort, a pipeline encompassing all stages of ligand building and refinement, starting from integrated and scaled diffraction intensities, has been implemented in Phenix. The resulting system is able to successfully solve and refine large collections of structures in parallel without extensive user intervention prior to the final stages of model completion and validation

Error sensitivity to refinement: a criterion for optimal grid adaptation

Science.gov (United States)

Luchini, Paolo; Giannetti, Flavio; Citro, Vincenzo

2017-12-01

Most indicators used for automatic grid refinement are suboptimal, in the sense that they do not really minimize the global solution error. This paper concerns with a new indicator, related to the sensitivity map of global stability problems, suitable for an optimal grid refinement that minimizes the global solution error. The new criterion is derived from the properties of the adjoint operator and provides a map of the sensitivity of the global error (or its estimate) to a local mesh refinement. Examples are presented for both a scalar partial differential equation and for the system of Navier-Stokes equations. In the last case, we also present a grid-adaptation algorithm based on the new estimator and on the FreeFem++ software that improves the accuracy of the solution of almost two order of magnitude by redistributing the nodes of the initial computational mesh.

Architectural Refinement for the Design of Survivable Systems

National Research Council Canada - National Science Library

Ellison, Robert

2001-01-01

This paper describes a process for systematically refining an enterprise system architecture to resist recognize and recover from deliberate, malicious attacks by applying reusable design primitives...

Financial optimisation and risk management in refining activities

International Nuclear Information System (INIS)

Fiorenzani, S.

2006-01-01

The real options approach has become a benchmark in real assets evaluation and optimal management problems, especially in liberalised and competitive markets such as the oil and hydrocarbon markets. This paper describes how the same approach can be a useful tool for both risk management decisions and the financial optimisation problem. Refineries are black boxes, which can be used for the transformation of crude oil into more refined hydrocarbon products. These black boxes are characterised by operational flexibilities and constraints, which should be optimally managed in order to maximise the refiner's economic goals. Stochastic dynamic programming represents the right mathematical instrument employed to solve the decision-making problem in such an economic environment. (author)

Pushing the dinosaurs[Competition in the refining industry

Energy Technology Data Exchange (ETDEWEB)

Cobb, C B [Ernst and Young/Wright Killen (United States)

1999-03-01

The need for change in the business of oil refining is expressed. Since 1981, only three years have yielded high profit margins. The future is said to be in maximising performance from existing assets. In the past, the industry focused on the asset-based strategy of refining crude and getting it into the pipelines as early as possible but apparently the future lies in identifying customer needs and satisfying those needs as quickly as possible. In other words, selling the most product at the highest price. The strategy and tactics for achieving these goals are itemised and discussed. In short, it is essential that oil and gas companies make the transformation from asset focus to customer focus. (UK)

R and D status of oxide electro-refining reprocessing technology

International Nuclear Information System (INIS)

Myochin, Munetaka

2005-01-01

The oxide electro-refining pyrochemical reprocessing is excellent in the resistivity against nuclear material diversion and in the suitability for oxide fuel cycle and has an excellent affinity for the technology of fuel production using the vibropac method. The oxide electro-refining pyrochemical reprocessing system has therefore been examined as a part of studies of commercialization of FBR cycle. This report outlines the examination results of fundamental data acquired for the system design. (M.H.)

Structure refinement of polycrystalline orthorhombic yttrium ...

Indian Academy of Sciences (India)

The perovskite ceramic phases with composition Ca1−YTiO3+ (where = 0.1, 0.2 and 0.3; hereafter CYT-10, CYT-20 and CYT-30) have been synthesized by solid state reaction at 1050°C. The structure refinement using general structure analysis system (GSAS) software converges to satisfactory profile indicators ...

40 CFR 80.551 - How does a refiner obtain approval as a small refiner under this subpart?

Science.gov (United States)

2010-07-01

...) Applications for motor vehicle diesel fuel small refiner status must be submitted to EPA by December 31, 2001...-operational between January 1, 1999, and January 1, 2000, the application for motor vehicle diesel fuel small...: (1) For motor vehicle diesel fuel small refiners— (i) A listing of the name and address of each...

Uranium refining by solvent extraction

International Nuclear Information System (INIS)

Kraikaew, J.

1996-01-01

The yellow cake refining was studied in both laboratory and semi-pilot scales. The process units mainly consist of dissolution and filtration, solvent extraction, and precipitation and filtration. Effect of flow ratio (organic flow rate/ aqueous flow rate) on working efficiencies of solvent extraction process was studied. Detailed studies were carried out on extraction, scrubbing and stripping processes. Purity of yellow cake product obtained is high as 90.32% U 3 O 8

Preparation of refined oils, etc

Energy Technology Data Exchange (ETDEWEB)

1931-02-03

A process is disclosed for the preparation of refined sulfur-containing oils from sulfur-containing crude oils obtained by distillation of bituminous limestone, characterized by this crude oil being first subjected to a purification by distillation with steam in the known way, then treated with lime and chloride of lime and distilled preferably in the presence of zinc powder, whereby in this purification a rectification can be added for the purpose of recovering definite fractions.

Refinements in the Los Alamos model of the prompt fission neutron spectrum

Energy Technology Data Exchange (ETDEWEB)

Madland, D.G., E-mail: dgm@lanl.gov; Kahler, A.C.

2017-01-15

This paper presents a number of refinements to the original Los Alamos model of the prompt fission neutron spectrum and average prompt neutron multiplicity as derived in 1982. The four refinements are due to new measurements of the spectrum and related fission observables many of which were not available in 1982. They are also due to a number of detailed studies and comparisons of the model with previous and present experimental results including not only the differential spectrum, but also integral cross sections measured in the field of the differential spectrum. The four refinements are (a) separate neutron contributions in binary fission, (b) departure from statistical equilibrium at scission, (c) fission-fragment nuclear level-density models, and (d) center-of-mass anisotropy. With these refinements, for the first time, good agreement has been obtained for both differential and integral measurements using the same Los Alamos model spectrum.

Structural refinement and coarsening in deformed metals

DEFF Research Database (Denmark)

Hansen, N.; Huang, X.; Xing, Q.

2005-01-01

The microstructural refinement by plastic deformation is analysed in terms of key parameters, the spacing between and the misorientation angle across the boundaries subdividing the structure. Coarsening of such structures by annealing is also characterised. For both deformed and annealed structur...

Refinement from a control problem to program

DEFF Research Database (Denmark)

Schenke, Michael; Ravn, Anders P.

1996-01-01

The distinguishing feature of the presented refinement approach is that it links formalisms from a top level requirements notation down to programs together in a mathematically coherent development trajectory. The approach uses Duration Calculus, a real-time interval logic, to specifyrequirements...

Refinement of NMR structures using implicit solvent and advanced sampling techniques.

Science.gov (United States)

Chen, Jianhan; Im, Wonpil; Brooks, Charles L

2004-12-15

NMR biomolecular structure calculations exploit simulated annealing methods for conformational sampling and require a relatively high level of redundancy in the experimental restraints to determine quality three-dimensional structures. Recent advances in generalized Born (GB) implicit solvent models should make it possible to combine information from both experimental measurements and accurate empirical force fields to improve the quality of NMR-derived structures. In this paper, we study the influence of implicit solvent on the refinement of protein NMR structures and identify an optimal protocol of utilizing these improved force fields. To do so, we carry out structure refinement experiments for model proteins with published NMR structures using full NMR restraints and subsets of them. We also investigate the application of advanced sampling techniques to NMR structure refinement. Similar to the observations of Xia et al. (J.Biomol. NMR 2002, 22, 317-331), we find that the impact of implicit solvent is rather small when there is a sufficient number of experimental restraints (such as in the final stage of NMR structure determination), whether implicit solvent is used throughout the calculation or only in the final refinement step. The application of advanced sampling techniques also seems to have minimal impact in this case. However, when the experimental data are limited, we demonstrate that refinement with implicit solvent can substantially improve the quality of the structures. In particular, when combined with an advanced sampling technique, the replica exchange (REX) method, near-native structures can be rapidly moved toward the native basin. The REX method provides both enhanced sampling and automatic selection of the most native-like (lowest energy) structures. An optimal protocol based on our studies first generates an ensemble of initial structures that maximally satisfy the available experimental data with conventional NMR software using a simplified

The energy efficiency of crude oil refining in Brazil: A Brazilian refinery plant case

International Nuclear Information System (INIS)

Lima, Romulo S. de; Schaeffer, Roberto

2011-01-01

This article evaluates energy efficiency in Brazilian crude oil refining in comparison with the crude oil refining in the United States between 1930 and 2008. It aims to show that increased refinery complexity reduces the energy consumption of products of high value added. Moreover, the article shows that improvements in energy efficiency result in higher quality products and increased processing of oil. A Brazilian refinery with a capacity of 157,000 barrels per day (kbpd) was modernized in 2008 at a cost of US $1.3 billion. As a result, its capacity increased by 17%, from 157 to 189 kbpd. Its complexity index also rose from 3.2 to 6.8, allowing an improvement in the EII (energy intensity index) from 110% to 93%. In relation to the crude oil processed before being modernized, energy consumption fell from 0.75 to 0.52 MBtu (million British thermal units) per barrel processed. These proceedings show that increases in complexity reduce the energy consumed in the production of final products with high value added, such as gasoline, diesel and jet fuel. -- Highlights: → Increased refinery complexity reduces the energy consumption of products of high value added. → Improvements in refinery energy efficiency result in higher quality products and increased processing of oil. → Brazilian refineries were not affected significantly in the 2008 crisis, such as the US refineries, due to many factors. → The EII of Brazilian refining presents real opportunities for gains through changes in the profile of energy consumed.

Effect of Duration on Ti Grain Refinement of A356 and Melt Quality

Science.gov (United States)

Gürsoy, Özen; Erzi, Eray; Yüksel, Çağlar; Dispinar, Derya

Grain refinement of aluminium alloys increases fluidity and feedability; and thus higher mechanical properties and decreased porosity is achieved. Typically, various ratios of Ti-B is used as grain refiner. It is well known that due to the sedimentation, the effectiveness of the grain refinement decreases which is called the fading effect. In this work, this effect has been investigated by means of melt quality. Two different melting temperatures were selected (725 and 750C) and samples were cast into die and sand mould. After the addition of grain refiners, samples were collected at 10 minutes of interval. Metallographic examinations were carried out where microstructural change and porosity distribution were investigated. The results were correlated with bifilm index (i.e. melt quality).

Effects of grain refinement on the rheological behaviors of semisolid hypoeutectic Al-Si alloys

International Nuclear Information System (INIS)

Yan, M.; Luo, W.

2007-01-01

The paper experimentally investigated the effects of grain refinement on the rheological response of Al and hypoeutectic Al-Si alloys. Selected refiners included K 2 TiF 6 , K 2 TiF 6 plus graphite and Al-5Ti-B. The apparent viscosity of semisolid Al alloys was measured during solidification. Samples at different solid fractions were quenched to observe the microstructure. It was found that grain refinement drastically lowered the apparent viscosity of Al-Si alloys. Among selected refiners, the effect of Al-5Ti-B was the best. The effect of K 2 TiF 6 plus graphite was better than that of K 2 TiF 6 . Silicon contents in Al alloys affected the apparent viscosity. With increasing silicon content the apparent viscosity decreased, resulted from promotion of silicon to both refining effects of titanium and boron

Effect of B/Ti mass ratio on grain refining of low-titanium aluminum produced by electrolysis

International Nuclear Information System (INIS)

Wang Mingxing; Wang Sanjun; Liu Zhiyong; Liu Zhongxia; Song Tianfu; Zuo Xiurong

2006-01-01

The effect of B/Ti mass ratio on grain refining of the low-titanium aluminum produced by electrolysis was investigated by adding AlB master alloy to the melt of the low-titanium aluminum. The results show that the addition of titanium by electrolysis is an effective way of grain refining of aluminum, and addition of boron to the melt of the low-titanium aluminum can further increase the grain refining efficiency. And the best grain refining efficiency is obtained when the B/Ti mass ratio is 1:10. However, when the B/Ti mass ratio is 1:2.22 (the stoichiometric value for TiB 2 ), the grain refining efficiency vanishes almost completely. It means that all of the solute titanium atoms in the melt of the low-titanium aluminum react with boron atoms that come from AlB master alloy to form TiB 2 particles, and TiB 2 particles have not grain refining ability. The grain refining efficiency seems to increase with addition of more boron to the melt after the B/Ti mass ratio exceeds 1:2.22. But the grain refining efficiency is very poor, and similar to that of pure Al refined by AlB master alloy. It further shows that TiB 2 particles do not participate in grain refining, and that the excess boron atoms in the melt also cannot turn TiB 2 particles into the effective nuclei for aluminum as the solute titanium atoms do

Decadal climate prediction with a refined anomaly initialisation approach

Science.gov (United States)

Volpi, Danila; Guemas, Virginie; Doblas-Reyes, Francisco J.; Hawkins, Ed; Nichols, Nancy K.

2017-03-01

In decadal prediction, the objective is to exploit both the sources of predictability from the external radiative forcings and from the internal variability to provide the best possible climate information for the next decade. Predicting the climate system internal variability relies on initialising the climate model from observational estimates. We present a refined method of anomaly initialisation (AI) applied to the ocean and sea ice components of the global climate forecast model EC-Earth, with the following key innovations: (1) the use of a weight applied to the observed anomalies, in order to avoid the risk of introducing anomalies recorded in the observed climate, whose amplitude does not fit in the range of the internal variability generated by the model; (2) the AI of the ocean density, instead of calculating it from the anomaly initialised state of temperature and salinity. An experiment initialised with this refined AI method has been compared with a full field and standard AI experiment. Results show that the use of such refinements enhances the surface temperature skill over part of the North and South Atlantic, part of the South Pacific and the Mediterranean Sea for the first forecast year. However, part of such improvement is lost in the following forecast years. For the tropical Pacific surface temperature, the full field initialised experiment performs the best. The prediction of the Arctic sea-ice volume is improved by the refined AI method for the first three forecast years and the skill of the Atlantic multidecadal oscillation is significantly increased compared to a non-initialised forecast, along the whole forecast time.

The Effect of Grain-refinement on Zn-10Al Alloy Damping Properties

Directory of Open Access Journals (Sweden)

Piwowarski G.

2014-12-01

Full Text Available The paper is devoted to grain-refinement of the medium-aluminium zinc based alloys (MAl-Zn. The system examined was sand cast Zn- 10 wt. %. Al binary alloy (Zn-10Al doped with commercial Al-3 wt. % Ti - 0.15 wt. % C grain refiner (Al-3Ti-0.15C GR. Basing on the measured attenuation coefficient of ultrasonic wave it was stated that together with significantly increased structure fineness damping decreases only by about 10 - 20%. The following examinations should establish the influence of the mentioned grain-refinement on strength and ductility of MAl-Zn cast alloys.

NOMAD-Ref: visualization, deformation and refinement of macromolecular structures based on all-atom normal mode analysis.

Science.gov (United States)

Lindahl, Erik; Azuara, Cyril; Koehl, Patrice; Delarue, Marc

2006-07-01

Normal mode analysis (NMA) is an efficient way to study collective motions in biomolecules that bypasses the computational costs and many limitations associated with full dynamics simulations. The NOMAD-Ref web server presented here provides tools for online calculation of the normal modes of large molecules (up to 100,000 atoms) maintaining a full all-atom representation of their structures, as well as access to a number of programs that utilize these collective motions for deformation and refinement of biomolecular structures. Applications include the generation of sets of decoys with correct stereochemistry but arbitrary large amplitude movements, the quantification of the overlap between alternative conformations of a molecule, refinement of structures against experimental data, such as X-ray diffraction structure factors or Cryo-EM maps and optimization of docked complexes by modeling receptor/ligand flexibility through normal mode motions. The server can be accessed at the URL http://lorentz.immstr.pasteur.fr/nomad-ref.php.

Adaptive mesh refinement with spectral accuracy for magnetohydrodynamics in two space dimensions

International Nuclear Information System (INIS)

Rosenberg, D; Pouquet, A; Mininni, P D

2007-01-01

We examine the effect of accuracy of high-order spectral element methods, with or without adaptive mesh refinement (AMR), in the context of a classical configuration of magnetic reconnection in two space dimensions, the so-called Orszag-Tang (OT) vortex made up of a magnetic X-point centred on a stagnation point of the velocity. A recently developed spectral-element adaptive refinement incompressible magnetohydrodynamic (MHD) code is applied to simulate this problem. The MHD solver is explicit, and uses the Elsaesser formulation on high-order elements. It automatically takes advantage of the adaptive grid mechanics that have been described elsewhere in the fluid context (Rosenberg et al 2006 J. Comput. Phys. 215 59-80); the code allows both statically refined and dynamically refined grids. Tests of the algorithm using analytic solutions are described, and comparisons of the OT solutions with pseudo-spectral computations are performed. We demonstrate for moderate Reynolds numbers that the algorithms using both static and refined grids reproduce the pseudo-spectral solutions quite well. We show that low-order truncation-even with a comparable number of global degrees of freedom-fails to correctly model some strong (sup-norm) quantities in this problem, even though it satisfies adequately the weak (integrated) balance diagnostics

Adaptive local surface refinement based on LR NURBS and its application to contact

Science.gov (United States)

Zimmermann, Christopher; Sauer, Roger A.

2017-12-01

A novel adaptive local surface refinement technique based on Locally Refined Non-Uniform Rational B-Splines (LR NURBS) is presented. LR NURBS can model complex geometries exactly and are the rational extension of LR B-splines. The local representation of the parameter space overcomes the drawback of non-existent local refinement in standard NURBS-based isogeometric analysis. For a convenient embedding into general finite element codes, the Bézier extraction operator for LR NURBS is formulated. An automatic remeshing technique is presented that allows adaptive local refinement and coarsening of LR NURBS. In this work, LR NURBS are applied to contact computations of 3D solids and membranes. For solids, LR NURBS-enriched finite elements are used to discretize the contact surfaces with LR NURBS finite elements, while the rest of the body is discretized by linear Lagrange finite elements. For membranes, the entire surface is discretized by LR NURBS. Various numerical examples are shown, and they demonstrate the benefit of using LR NURBS: Compared to uniform refinement, LR NURBS can achieve high accuracy at lower computational cost.

Computing Refined Buneman Trees in Cubic Time

DEFF Research Database (Denmark)

Brodal, G.S.; Fagerberg, R.; Östlin, A.

2003-01-01

Reconstructing the evolutionary tree for a set of n species based on pairwise distances between the species is a fundamental problem in bioinformatics. Neighbor joining is a popular distance based tree reconstruction method. It always proposes fully resolved binary trees despite missing evidence...... in the underlying distance data. Distance based methods based on the theory of Buneman trees and refined Buneman trees avoid this problem by only proposing evolutionary trees whose edges satisfy a number of constraints. These trees might not be fully resolved but there is strong combinatorial evidence for each...... proposed edge. The currently best algorithm for computing the refined Buneman tree from a given distance measure has a running time of O(n 5) and a space consumption of O(n 4). In this paper, we present an algorithm with running time O(n 3) and space consumption O(n 2). The improved complexity of our...

Former Soviet Union's refining sector faces big shakeout

International Nuclear Information System (INIS)

Anon.

1993-01-01

The crisis gripping the refining sector in the former Soviet Union (FSU) is deepening as that industry faces massive rationalization and restructuring. Refinery runs in FSU republics have been on the decline for a number of years. Peak throughput occurred in 1987 at 9.69 million b/d. In Russia, however, the peak came in 1980 at 6.5 million b/d. Given current operable refining capacity in the FSU, now down to about 9.27 million b/d distributed among 48 refineries, capacity utilization will average only about 65% this year. The paper discusses worsening conditions, a comparison of the FSU declines, the financial crisis, energy consumption, and the focus of FSU refineries on secondary capacity to upgrade the product mix

Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2.

Science.gov (United States)

Fugel, Malte; Jayatilaka, Dylan; Hupf, Emanuel; Overgaard, Jacob; Hathwar, Venkatesha R; Macchi, Piero; Turner, Michael J; Howard, Judith A K; Dolomanov, Oleg V; Puschmann, Horst; Iversen, Bo B; Bürgi, Hans-Beat; Grabowsky, Simon

2018-01-01

Hirshfeld atom refinement (HAR) is a novel X-ray structure refinement technique that employs aspherical atomic scattering factors obtained from stockholder partitioning of a theoretically determined tailor-made static electron density. HAR overcomes many of the known limitations of independent atom modelling (IAM), such as too short element-hydrogen distances, r ( X -H), or too large atomic displacement parameters (ADPs). This study probes the accuracy and precision of anisotropic hydrogen and non-hydrogen ADPs and of r ( X -H) values obtained from HAR. These quantities are compared and found to agree with those obtained from (i) accurate neutron diffraction data measured at the same temperatures as the X-ray data and (ii) multipole modelling (MM), an established alternative method for interpreting X-ray diffraction data with the help of aspherical atomic scattering factors. Results are presented for three chemically different systems: the aromatic hydro-carbon rubrene (orthorhombic 5,6,11,12-tetra-phenyl-tetracene), a co-crystal of zwitterionic betaine, imidazolium cations and picrate anions (BIPa), and the salt potassium hydrogen oxalate (KHOx). The non-hydrogen HAR-ADPs are as accurate and precise as the MM-ADPs. Both show excellent agreement with the neutron-based values and are superior to IAM-ADPs. The anisotropic hydrogen HAR-ADPs show a somewhat larger deviation from neutron-based values than the hydrogen SHADE-ADPs used in MM. Element-hydrogen bond lengths from HAR are in excellent agreement with those obtained from neutron diffraction experiments, although they are somewhat less precise. The residual density contour maps after HAR show fewer features than those after MM. Calculating the static electron density with the def2-TZVP basis set instead of the simpler def2-SVP one does not improve the refinement results significantly. All HARs were performed within the recently introduced HARt option implemented in the Olex2 program. They are easily launched

Probing the accuracy and precision of Hirshfeld atom refinement with HARt interfaced with Olex2

Directory of Open Access Journals (Sweden)

Malte Fugel

2018-01-01

Full Text Available Hirshfeld atom refinement (HAR is a novel X-ray structure refinement technique that employs aspherical atomic scattering factors obtained from stockholder partitioning of a theoretically determined tailor-made static electron density. HAR overcomes many of the known limitations of independent atom modelling (IAM, such as too short element–hydrogen distances, r(X—H, or too large atomic displacement parameters (ADPs. This study probes the accuracy and precision of anisotropic hydrogen and non-hydrogen ADPs and of r(X—H values obtained from HAR. These quantities are compared and found to agree with those obtained from (i accurate neutron diffraction data measured at the same temperatures as the X-ray data and (ii multipole modelling (MM, an established alternative method for interpreting X-ray diffraction data with the help of aspherical atomic scattering factors. Results are presented for three chemically different systems: the aromatic hydrocarbon rubrene (orthorhombic 5,6,11,12-tetraphenyltetracene, a co-crystal of zwitterionic betaine, imidazolium cations and picrate anions (BIPa, and the salt potassium hydrogen oxalate (KHOx. The non-hydrogen HAR-ADPs are as accurate and precise as the MM-ADPs. Both show excellent agreement with the neutron-based values and are superior to IAM-ADPs. The anisotropic hydrogen HAR-ADPs show a somewhat larger deviation from neutron-based values than the hydrogen SHADE-ADPs used in MM. Element–hydrogen bond lengths from HAR are in excellent agreement with those obtained from neutron diffraction experiments, although they are somewhat less precise. The residual density contour maps after HAR show fewer features than those after MM. Calculating the static electron density with the def2-TZVP basis set instead of the simpler def2-SVP one does not improve the refinement results significantly. All HARs were performed within the recently introduced HARt option implemented in the Olex2 program. They are easily

Mathematical aspects of Rietveld refinement and crystal structure ...

Indian Academy of Sciences (India)

Administrator

The core mathematics, goodness-of-fit parameters of Rietveld refinement technique is introduced for structural ... transducers in medical and solar applications (Obmann ..... Prince 1985 in Structure and statistics in crystallography (ed.).

Architectural Refinement for the Design of Survivable Systems

National Research Council Canada - National Science Library

Ellison, Robert

2001-01-01

...; that is, have no central administration and no unified security policy. The survivable architecture refinement is an iterative risk-driven process which adopts the structure of Boehm's Spiral Model Boehm 88...

Melt refining of uranium contaminated copper, nickel, and mild steel

International Nuclear Information System (INIS)

Ren Xinwen; Liu Wencang; Zhang Yuan

1993-01-01

This paper presents the experiment results on melt refining of uranium contaminated metallic discards such as copper, nickel, and mild steel. Based on recommended processes, uranium contents in ingots shall decrease below 1 ppm; metal recovery is higher than 96%; and slag production is below 5% in weight of the metal to be refined. The uranium in the slag is homogeneously distributed. The slag seems to be hard ceramics, insoluble in water, and can be directly disposed of after proper packaging

A State Space Model for the Wood Chip Refining Model

Directory of Open Access Journals (Sweden)

David Di Ruscio

1997-07-01

Full Text Available A detailed dynamic model of the fibre size distribution between the refiner discs, distributed along the refiner radius, is presented. Both one- and two-dimensional descriptions for the fibre or shive geometry are given. It is shown that this model may be simplified and that analytic solutions exist under non-restrictive assumptions. A direct method for the recursive estimation of unknown parameters is presented. This method is applicable to linear or linearized systems which have a triangular structure.

Reverse mechanical after effect during hydrogenation of zone refined iron

Energy Technology Data Exchange (ETDEWEB)

Spivak, L.V.; Skryabina, N.E.; Kurmaeva, L.D.; Smirnov, L.V. (Permskij Gosudarstvennyj Univ. (USSR); AN SSSR, Sverdlovsk. Inst. Fiziki Metallov)

1984-12-01

The relationship between the process of hydrogenation and the reverse mechanical after effect (RMA) microplastic deformation in the zone refined iron has been studied. Metallographic investigations and mechanical testing of the samples hydrogenated under torsional strain have been performed. It is shown that in the zone refined iron the formation of voids responsible for irreversible hydrogen embrittlement does not occur, but the hydrogen-initiated RMA strain is conserved, i. e. the RMA effects are independent of the presence of discontinuities.

Risk as economic category: systematics scientific approach and refinement contents

OpenAIRE

V.G. Vygovskyy

2015-01-01

The paper studies the categorical-conceptual apparatus of risk and its refinement based on a critical analysis of existing systematic scientific approaches. Determined that in the refinement of the economic nature of the risk of a number of controversial issues: the definition of the objective or subjective nature of risk; matching of concepts such as «risk», «danger», «loss», «probability of loss»; definition of negative or positive consequences of risk; identification of risk with its conse...

Separation of CsCl and SrCl{sub 2} from a ternary CsCl-SrCl{sub 2}-LiCl via a zone refining process for waste salt minimization of pyroprocessing

Energy Technology Data Exchange (ETDEWEB)

Shim, Moonsoo [Graduate School of Energy Science and Technology, Chungnam National University, 99 Daehak-ro, Yuseong-gu, Daejeon, 34134 (Korea, Republic of); Choi, Ho Gil; Yi, Kyung Woo; Hwang, Il Soon [Graduate School of Seoul National University, 1 Gwanak-ro, Gwanak-gu, Seoul 08826 (Korea, Republic of); Lee, Jong Hyeon, E-mail: jonglee@cnu.ac.kr [Graduate School of Energy Science and Technology, Chungnam National University, 99 Daehak-ro, Yuseong-gu, Daejeon, 34134 (Korea, Republic of); Graduate School of Department of Advanced Materials Engineering, Chungnam National University, 99 Daehak-ro, Yuseong-gu, Daejeon, 34134 (Korea, Republic of); Rapid Solidified Materials Research Center, Chungnam National University, 99 Daehak-ro, Yuseong-gu, Daejeon, 34134 (Korea, Republic of)

2016-11-15

The purification of LiCl salt mixture has traditionally been carried out by a melt crystallization process. To improve the throughput of zone refining, three heaters were installed in the zone refiner. The zone refining method was used to grow pure LiCl salt ingots from LiCl-CsCl-SrCl{sub 2} salt mixture. The main investigated parameters were the heater speed and the number of passes. A change in the LiCl crystal grain size was observed according to the horizontal direction. From each zone refined salt ingot, samples were collected horizontally. To analyze the concentrations of Sr and Cs, an inductively coupled plasma optical emission spectrometer and inductively coupled plasma mass spectrometer were used, respectively. The experimental results show that Sr and Cs concentrations at the initial region of the ingot were low and reached their peak at the final freezing region of the salt ingot. Concentration results of zone refined salt were compared with theoretical results yielded by the proposed model to validate its predictions. The k{sub eff} of Sr and Cs were 0.13 and 0.11, respectively. The decontamination factors of Sr and Cs were 450 and 1650, respectively. - Highlights: • The LiCl-CsCl-SrCl{sub 2} salt ingot was purified by zone refining technique to minimize waste salt. • The concentration distribution of Cs and Sr were analyzed by mass transfer equation. • The decontamination factors of Cs and Sr were 1600 and 450 respectively in case of 60% of recovery yield.

76 FR 61074 - USDA Increases the Fiscal Year 2011 Tariff-Rate Quota for Refined Sugar

Science.gov (United States)

2011-10-03

... Quota for Refined Sugar AGENCY: Office of the Secretary, USDA. ACTION: Notice. SUMMARY: The Secretary of Agriculture today announced an increase in the fiscal year (FY) 2011 refined sugar tariff-rate quota (TRQ) of... INFORMATION: A quantity of 22,000 MTRV for sugars, syrups, and molasses (collectively referred to as refined...

PREFMD: a web server for protein structure refinement via molecular dynamics simulations.

Science.gov (United States)

Heo, Lim; Feig, Michael

2018-03-15

Refinement of protein structure models is a long-standing problem in structural bioinformatics. Molecular dynamics-based methods have emerged as an avenue to achieve consistent refinement. The PREFMD web server implements an optimized protocol based on the method successfully tested in CASP11. Validation with recent CASP refinement targets shows consistent and more significant improvement in global structure accuracy over other state-of-the-art servers. PREFMD is freely available as a web server at http://feiglab.org/prefmd. Scripts for running PREFMD as a stand-alone package are available at https://github.com/feiglab/prefmd.git. feig@msu.edu. Supplementary data are available at Bioinformatics online.

A quality-refinement process for medical imaging applications.

Science.gov (United States)

Neuhaus, J; Maleike, D; Nolden, M; Kenngott, H-G; Meinzer, H-P; Wolf, I

2009-01-01

To introduce and evaluate a process for refinement of software quality that is suitable to research groups. In order to avoid constraining researchers too much, the quality improvement process has to be designed carefully. The scope of this paper is to present and evaluate a process to advance quality aspects of existing research prototypes in order to make them ready for initial clinical studies. The proposed process is tailored for research environments and therefore more lightweight than traditional quality management processes. Focus on quality criteria that are important at the given stage of the software life cycle. Usage of tools that automate aspects of the process is emphasized. To evaluate the additional effort that comes along with the process, it was exemplarily applied for eight prototypical software modules for medical image processing. The introduced process has been applied to improve the quality of all prototypes so that they could be successfully used in clinical studies. The quality refinement yielded an average of 13 person days of additional effort per project. Overall, 107 bugs were found and resolved by applying the process. Careful selection of quality criteria and the usage of automated process tools lead to a lightweight quality refinement process suitable for scientific research groups that can be applied to ensure a successful transfer of technical software prototypes into clinical research workflows.

Superior refining performance beyond 2000 -- Breaking traditional paradigms

International Nuclear Information System (INIS)

Tassel, B. van

1995-01-01

Over the last 5 years, refining companies have not performed well financially, generating returns below the cost of capital. Environmental regulations have caused the industry to invest significant amounts of capital, and while new regulations will cause the shutdown of between 500 thousand and 1.2 million barrels per day of capacity, the industry structure will remain poor and financial returns for the average player will likely be volatile, cyclical, and below the cost of capital. Based on this industry outlook, refining companies seeking superior performance will have to break the traditional paradigms and adopt world-class practices used in other industries. Changes required to significantly improve financial returns will include shifts in business strategy to accommodate growth, and development of nontraditional services, as well as initiates to dramatically reshape cost structure and improve profitability. Making the changes to become a superior performer in the refining business will require a clear vision and strong leadership at multiple levels in the organization. The transformation will also require changes in company culture and incentive plans that encourage managers to act as owners. In addition, superior performers will push accountability for results to low levels in the organization. Given the herd mentality of the oil industry, superior performers must take decisive, preemptive action to generate a substantial, competitive advantage

Mesh refinement for uncertainty quantification through model reduction

International Nuclear Information System (INIS)

Li, Jing; Stinis, Panos

2015-01-01

We present a novel way of deciding when and where to refine a mesh in probability space in order to facilitate uncertainty quantification in the presence of discontinuities in random space. A discontinuity in random space makes the application of generalized polynomial chaos expansion techniques prohibitively expensive. The reason is that for discontinuous problems, the expansion converges very slowly. An alternative to using higher terms in the expansion is to divide the random space in smaller elements where a lower degree polynomial is adequate to describe the randomness. In general, the partition of the random space is a dynamic process since some areas of the random space, particularly around the discontinuity, need more refinement than others as time evolves. In the current work we propose a way to decide when and where to refine the random space mesh based on the use of a reduced model. The idea is that a good reduced model can monitor accurately, within a random space element, the cascade of activity to higher degree terms in the chaos expansion. In turn, this facilitates the efficient allocation of computational sources to the areas of random space where they are more needed. For the Kraichnan–Orszag system, the prototypical system to study discontinuities in random space, we present theoretical results which show why the proposed method is sound and numerical results which corroborate the theory

Superior refining performance beyond 2000 -- Breaking traditional paradigms

Energy Technology Data Exchange (ETDEWEB)

Tassel, B. van [McKinsey and Co., Inc., Houston, TX (United States)

1995-09-01

Over the last 5 years, refining companies have not performed well financially, generating returns below the cost of capital. Environmental regulations have caused the industry to invest significant amounts of capital, and while new regulations will cause the shutdown of between 500 thousand and 1.2 million barrels per day of capacity, the industry structure will remain poor and financial returns for the average player will likely be volatile, cyclical, and below the cost of capital. Based on this industry outlook, refining companies seeking superior performance will have to break the traditional paradigms and adopt world-class practices used in other industries. Changes required to significantly improve financial returns will include shifts in business strategy to accommodate growth, and development of nontraditional services, as well as initiates to dramatically reshape cost structure and improve profitability. Making the changes to become a superior performer in the refining business will require a clear vision and strong leadership at multiple levels in the organization. The transformation will also require changes in company culture and incentive plans that encourage managers to act as owners. In addition, superior performers will push accountability for results to low levels in the organization. Given the herd mentality of the oil industry, superior performers must take decisive, preemptive action to generate a substantial, competitive advantage.

Bauxite mining and alumina refining: process description and occupational health risks.

Science.gov (United States)

Donoghue, A Michael; Frisch, Neale; Olney, David

2014-05-01

To describe bauxite mining and alumina refining processes and to outline the relevant physical, chemical, biological, ergonomic, and psychosocial health risks. Review article. The most important risks relate to noise, ergonomics, trauma, and caustic soda splashes of the skin/eyes. Other risks of note relate to fatigue, heat, and solar ultraviolet and for some operations tropical diseases, venomous/dangerous animals, and remote locations. Exposures to bauxite dust, alumina dust, and caustic mist in contemporary best-practice bauxite mining and alumina refining operations have not been demonstrated to be associated with clinically significant decrements in lung function. Exposures to bauxite dust and alumina dust at such operations are also not associated with the incidence of cancer. A range of occupational health risks in bauxite mining and alumina refining require the maintenance of effective control measures.

Development of interface technology between unit processes in E-Refining process

Energy Technology Data Exchange (ETDEWEB)

Lee, S. H.; Lee, H. S.; Kim, J. G. [Korea Atomic Energy Research Institute, Daejeon (Korea, Republic of)

2010-10-15

The pyroprocessing is composed mainly four subprocesses, such as an electrolytic reduction, an electrorefining, an electrowinning, and waste salt regeneration/ solidification processes. The electrorefining process, one of main processes which are composed of pyroprocess to recover the useful elements from spent fuel, is under development by Korea Atomic Energy Research Institute as a sub process of pyrochemical treatment of spent PWR fuel. The CERS(Continuous ElectroRefining System) is composed of some unit processes such as an electrorefiner, a salt distiller, a melting furnace for the U-ingot and U-chlorinator (UCl{sub 3} making equipment) as shown in Fig. 1. In this study, the interfaces technology between unit processes in E-Refining system is investigated and developed for the establishment of integrated E-Refining operation system as a part of integrated pyroprocessing

Cleaning Data with OpenRefine

OpenAIRE

Seth van Hooland; Ruben Verborgh; Max De Wilde

2013-01-01

Duplicate records, empty values and inconsistent formats are phenomena we should be prepared to deal with when using historical data sets. This lesson will teach you how to discover inconsistencies in data contained within a spreadsheet or a database. As we increasingly share, aggregate and reuse data on the web, historians will need to respond to data quality issues which inevitably pop up. Using a program called OpenRefine, you will be able to easily identify systematic errors such as blank...

Thermal-chemical Mantle Convection Models With Adaptive Mesh Refinement

Science.gov (United States)

Leng, W.; Zhong, S.

2008-12-01

In numerical modeling of mantle convection, resolution is often crucial for resolving small-scale features. New techniques, adaptive mesh refinement (AMR), allow local mesh refinement wherever high resolution is needed, while leaving other regions with relatively low resolution. Both computational efficiency for large- scale simulation and accuracy for small-scale features can thus be achieved with AMR. Based on the octree data structure [Tu et al. 2005], we implement the AMR techniques into the 2-D mantle convection models. For pure thermal convection models, benchmark tests show that our code can achieve high accuracy with relatively small number of elements both for isoviscous cases (i.e. 7492 AMR elements v.s. 65536 uniform elements) and for temperature-dependent viscosity cases (i.e. 14620 AMR elements v.s. 65536 uniform elements). We further implement tracer-method into the models for simulating thermal-chemical convection. By appropriately adding and removing tracers according to the refinement of the meshes, our code successfully reproduces the benchmark results in van Keken et al. [1997] with much fewer elements and tracers compared with uniform-mesh models (i.e. 7552 AMR elements v.s. 16384 uniform elements, and ~83000 tracers v.s. ~410000 tracers). The boundaries of the chemical piles in our AMR code can be easily refined to the scales of a few kilometers for the Earth's mantle and the tracers are concentrated near the chemical boundaries to precisely trace the evolvement of the boundaries. It is thus very suitable for our AMR code to study the thermal-chemical convection problems which need high resolution to resolve the evolvement of chemical boundaries, such as the entrainment problems [Sleep, 1988].

Modelling Embedded Systems by Non-Monotonic Refinement

NARCIS (Netherlands)

Mader, Angelika H.; Marincic, J.; Wupper, H.

2008-01-01

This paper addresses the process of modelling embedded sys- tems for formal verification. We propose a modelling process built on non-monotonic refinement and a number of guidelines. The outcome of the modelling process is a model, together with a correctness argument that justifies our modelling

Modelling of the Effectiveness of Al-Ti-B Refiners in Commercial Purity Aluminium

Science.gov (United States)

Bunn, A. M.; Evans, P. V.; Bristow, D. J.; Greer, A. L.

Al-5Ti-1B (wt.%) alloys are effective grain refiners for DC-cast aluminium although as few as 1% of the TiB2 particles added to the melt nucleate grains. The aim of this work is to develop quantitative modelling for prediction of grain sizes in commercial purity aluminium. In this way the low efficiency of refiners can be understood, ultimately to clarify the design rules for a more effective refiner. The modelling focuses on the role of particle size distribution. This is in conjunction with measurements (by scanning electron microscopy and image analysis) of the particle size distributions in commercial Al-5Ti-1B refiners known to have differing performances. The undercooling required for heterogeneous nucleation of oc-Al on the surface of potent TiB2 particles is extremely low. Accordingly, the modelling is based on the assumption that the critical step for a particle to behave as an active growth centre is that required to initiate free growth from the particle surface, rather than the initial heterogeneous nucleation event. It is considered that further initiation of free growth of crystals is stopped by the onset of recalescence in the melt during solidification. Only those particles which are active growth centres at the point of recalescence will contribute towards the final grain size. Negligible interference between particles and spherical growth up to the point of recalescence are assumed; these assumptions are rigorously tested. The model tests the effect of varying the particle size distribution by using measured distributions from `good' and `poor' refiners. The variation of grain size with addition rate of refiner is examined. The model predicts an effective saturation, beyond which further addition has little effect. In general, good agreement is found between the grain-size predictions and conventional grain-refining tests.

The regulations concerning refining business of nuclear source material and nuclear fuel materials

International Nuclear Information System (INIS)

1981-01-01

This rule is established under the provisions concerning refining business in the law concerning the regulation of nuclear raw materials, nuclear fuel materials and nuclear reactors and the ordinance for the execution of this law, and to enforce them. Basic terms are defined, such as: exposure radiation dose, cumulative dose, control area, surrounding monitoring area and worker. The application for the designation for refining business under the law shall be classified into the facilities for crushing and leaching-filtration, thikening, and refining, the storage facilities for nuclear raw materials and nuclear fuel materials, and the disposal facilities for radioactive wastes, etc. To the application, shall be attached business plans, the explanations concerning the technical abilities of applicants and the prevention of hazards by nuclear raw materials and nuclear fuel materials regarding refining facilities, etc. Records shall be made on the accept, delivery and stock of each kind of nuclear raw materials and nuclear fuel materials, radiation control, the maintenance of and accidents in refining facilities, and kept for specified periods, respectively. Security regulations shall be enacted for each works or enterprise on the functions and organizations of persons engaged in the control of refining facilities, the operation of the apparatuses which must be controlled for the prevention of accidents, and the establishment of control area and surrounding monitoring area, etc. The report on the usage of internationally regulated goods and the measures taken at the time of danger are defined particularly. (Okada, K.)

Refining Automatically Extracted Knowledge Bases Using Crowdsourcing.

Science.gov (United States)

Li, Chunhua; Zhao, Pengpeng; Sheng, Victor S; Xian, Xuefeng; Wu, Jian; Cui, Zhiming

2017-01-01

Machine-constructed knowledge bases often contain noisy and inaccurate facts. There exists significant work in developing automated algorithms for knowledge base refinement. Automated approaches improve the quality of knowledge bases but are far from perfect. In this paper, we leverage crowdsourcing to improve the quality of automatically extracted knowledge bases. As human labelling is costly, an important research challenge is how we can use limited human resources to maximize the quality improvement for a knowledge base. To address this problem, we first introduce a concept of semantic constraints that can be used to detect potential errors and do inference among candidate facts. Then, based on semantic constraints, we propose rank-based and graph-based algorithms for crowdsourced knowledge refining, which judiciously select the most beneficial candidate facts to conduct crowdsourcing and prune unnecessary questions. Our experiments show that our method improves the quality of knowledge bases significantly and outperforms state-of-the-art automatic methods under a reasonable crowdsourcing cost.

Refining Automatically Extracted Knowledge Bases Using Crowdsourcing

Directory of Open Access Journals (Sweden)

Chunhua Li

2017-01-01

Full Text Available Machine-constructed knowledge bases often contain noisy and inaccurate facts. There exists significant work in developing automated algorithms for knowledge base refinement. Automated approaches improve the quality of knowledge bases but are far from perfect. In this paper, we leverage crowdsourcing to improve the quality of automatically extracted knowledge bases. As human labelling is costly, an important research challenge is how we can use limited human resources to maximize the quality improvement for a knowledge base. To address this problem, we first introduce a concept of semantic constraints that can be used to detect potential errors and do inference among candidate facts. Then, based on semantic constraints, we propose rank-based and graph-based algorithms for crowdsourced knowledge refining, which judiciously select the most beneficial candidate facts to conduct crowdsourcing and prune unnecessary questions. Our experiments show that our method improves the quality of knowledge bases significantly and outperforms state-of-the-art automatic methods under a reasonable crowdsourcing cost.

Investment in exploration-production and refining 2013

International Nuclear Information System (INIS)

Hureau, Geoffroy; Serbutoviez, Sylvain; Silva, Constancio; Maisonnier, Guy

2013-10-01

IFPEN analyses in this study the 2013 evolution of global investment in the field of exploration-production and refining. 1 - Changes in oil and gas prices; 2 - Exploration production: a new year of growth: the increase in investments continues into 2013, exploration - Discoveries in 2013, 1978 - 2012: Investments - Production - Price; 3 - Main markets in the upstream oil equipment and services sector: introduction, drilling (Drilling activity, Number of wells drilled throughout the world, Number of onshore wells, Number of offshore wells, Drilling markets, equipment and services for wells, Onshore drilling market, Offshore drilling market, Fracking market); Geophysical market (Geophysical activity, Geophysical market); Offshore construction (Offshore construction activities, Fixed platforms (Jack-ups), Floating Platform Systems (FPS), Sub-sea constructions, Offshore construction market); Conclusion; 4 - Refining: looking for new equilibriums: falling excess capacity and regional disparities, recovery in capital spending in emerging countries, Asia is still the eldorado for investment in the downstream oil Sector (Continuing overcapacity in the medium-term, Differing investment strategies)

Checking Thorough Refinement on Modal Transition Systems Is EXPTIME-Complete

DEFF Research Database (Denmark)

Benes, Nikola; Kretinsky, Jan; Larsen, Kim Guldstrand

2009-01-01

Modal transition systems (MTS), a specification formalism introduced more than 20 years ago, has recently received a considerable attention in several different areas. Many of the fundamental questions related to MTSs have already been answered. However, the problem of the exact computational...... complexity of thorough refinement checking between two finite MTSs remained unsolved. We settle down this question by showing EXPTIME-completeness of thorough refinement checking on finite MTSs. The upper-bound result relies on a novel algorithm running in single exponential time providing a direct goal...

Phytoremediation of heavy metals from fly ash pond by Azolla caroliniana.

Science.gov (United States)

Pandey, Vimal Chandra

2012-08-01

Abundance of naturally growing Azolla caroliniana (water fern) on the surface of metal enriched fly ash (FA) pond reflects its toxitolerant characteristics. Results indicate the efficiency of A. caroliniana for phytoremediation of FA pond because of its higher bioconcentration factor. The metal concentration ranged from 175 to 538 and 86 to 753mgkg(-1) in roots and fronds, respectively. Bioconcentration factor (BCF) values of all metals in root and frond ranged from 1.7 to18.6 and 1.8 to 11.0, respectively, which were greater than one and indicates the metal accumulation potential of A. caroliniana. Translocation factor (TF) ranged from 0.37 to 1.4 for various heavy metals. The field result proved that A. caroliniana is a potential accumulator for the examined heavy metals and can be used for phytoremediation of FA pond. Copyright © 2012 Elsevier Inc. All rights reserved.

Adaptive temporal refinement in injection molding

Science.gov (United States)

Karyofylli, Violeta; Schmitz, Mauritius; Hopmann, Christian; Behr, Marek

2018-05-01

Mold filling is an injection molding stage of great significance, because many defects of the plastic components (e.g. weld lines, burrs or insufficient filling) can occur during this process step. Therefore, it plays an important role in determining the quality of the produced parts. Our goal is the temporal refinement in the vicinity of the evolving melt front, in the context of 4D simplex-type space-time grids [1, 2]. This novel discretization method has an inherent flexibility to employ completely unstructured meshes with varying levels of resolution both in spatial dimensions and in the time dimension, thus allowing the use of local time-stepping during the simulations. This can lead to a higher simulation precision, while preserving calculation efficiency. A 3D benchmark case, which concerns the filling of a plate-shaped geometry, is used for verifying our numerical approach [3]. The simulation results obtained with the fully unstructured space-time discretization are compared to those obtained with the standard space-time method and to Moldflow simulation results. This example also serves for providing reliable timing measurements and the efficiency aspects of the filling simulation of complex 3D molds while applying adaptive temporal refinement.

Significance of Kaduna River to Kaduna Refining and ...

African Journals Online (AJOL)

User

River through the Kaduna Refining and Petrochemicals Company (KRPC) plants and .... Other less-common process involves filtering heated crude using diatomaceous earth ..... Water is polluted by the fallout from air pollution and by refinery.

KABAM Version 1.0 User's Guide and Technical Documentation - Appendix F -Description of Equations Used to Calculate the BCF, BAF, BMF, and BSAF Values

Science.gov (United States)

Describes equations for bioconcentration, bioaccumulation, biomagnification and biota-sediment accumulation factors used in KABAM V1.0. KABAM is a simulation model used to predict pesticide concentrations in aquatic regions for use in exposure assessments.

Production and refining. Increase of Chinese petroleum imports

International Nuclear Information System (INIS)

Anon.

1997-01-01

China produced 156.5 Mt of petroleum in 1996, from which 56 Mt were extracted from the Daqing oil field, exploited since 1960. About 10% of the crude oil comes from offshore fields. Over the 100 Mt refined in 1996, 20 Mt were imported. The Chinese petroleum products demand should increase to 200 Mt/y by the end of the century with respect to 150 Mt/y in 1997. The Dalian refinery, the first Chinese-foreign joint venture, started to work in November 1996 and should reached its full capacity of 100000 b/day in the first quarter of 1997. The Chinese refining activity has now an excess capacity of 206 Mt/y. Several other joint venture projects in petrochemistry are planned in China. Short paper. (J.S.)

Comparison of lab, pilot, and industrial scale low consistency mechanical refining for improvements in enzymatic digestibility of pretreated hardwood.

Science.gov (United States)

Jones, Brandon W; Venditti, Richard; Park, Sunkyu; Jameel, Hasan

2014-09-01

Mechanical refining has been shown to improve biomass enzymatic digestibility. In this study industrial high-yield sodium carbonate hardwood pulp was subjected to lab, pilot and industrial refining to determine if the mechanical refining improves the enzymatic hydrolysis sugar conversion efficiency differently at different refining scales. Lab, pilot and industrial refining increased the biomass digestibility for lignocellulosic biomass relative to the unrefined material. The sugar conversion was increased from 36% to 65% at 5 FPU/g of biomass with industrial refining at 67.0 kWh/t, which was more energy efficient than lab and pilot scale refining. There is a maximum in the sugar conversion with respect to the amount of refining energy. Water retention value is a good predictor of improvements in sugar conversion for a given fiber source and composition. Improvements in biomass digestibility with refining due to lab, pilot plant and industrial refining were similar with respect to water retention value. Published by Elsevier Ltd.

Numerical analysis of impurity separation from waste salt by investigating the change of concentration at the interface during zone refining process

Science.gov (United States)

Choi, Ho-Gil; Shim, Moonsoo; Lee, Jong-Hyeon; Yi, Kyung-Woo

2017-09-01

The waste salt treatment process is required for the reuse of purified salts, and for the disposal of the fission products contained in waste salt during pyroprocessing. As an alternative to existing fission product separation methods, the horizontal zone refining process is used in this study for the purification of waste salt. In order to evaluate the purification ability of the process, three-dimensional simulation is conducted, considering heat transfer, melt flow, and mass transfer. Impurity distributions and decontamination factors are calculated as a function of the heater traverse rate, by applying a subroutine and the equilibrium segregation coefficient derived from the effective segregation coefficients. For multipass cases, 1d solutions and the effective segregation coefficient obtained from three-dimensional simulation are used. In the present study, the topic is not dealing with crystal growth, but the numerical technique used is nearly the same since the zone refining technique was just introduced in the treatment of waste salt from nuclear power industry because of its merit of simplicity and refining ability. So this study can show a new application of single crystal growth techniques to other fields, by taking advantage of the zone refining multipass possibility. The final goal is to achieve the same high degree of decontamination in the waste salt as in zone freezing (or reverse Bridgman) method.

The limit of grain refinement on equal channel angular deformation

International Nuclear Information System (INIS)

Kopylov, V.I.; Chuvil'deev, V.N.

2004-01-01

Experimental and theoretical study results on the process of strain-induced grain refinement under severe plastic deformation are described. A generalization is made for experimental results on deformation dispersing of copper, magnesium and aluminium base alloys as well as unalloyed metals. The model is developed which allows calculating the minimal grain size being able to result from equal channel angular pressing. The expressions describing the dependence of the limit of grain refinement on the nature of the material and severe plastic deformation rate and temperature are obtained [ru

i3Drefine software for protein 3D structure refinement and its assessment in CASP10.

Science.gov (United States)

Bhattacharya, Debswapna; Cheng, Jianlin

2013-01-01

Protein structure refinement refers to the process of improving the qualities of protein structures during structure modeling processes to bring them closer to their native states. Structure refinement has been drawing increasing attention in the community-wide Critical Assessment of techniques for Protein Structure prediction (CASP) experiments since its addition in 8(th) CASP experiment. During the 9(th) and recently concluded 10(th) CASP experiments, a consistent growth in number of refinement targets and participating groups has been witnessed. Yet, protein structure refinement still remains a largely unsolved problem with majority of participating groups in CASP refinement category failed to consistently improve the quality of structures issued for refinement. In order to alleviate this need, we developed a completely automated and computationally efficient protein 3D structure refinement method, i3Drefine, based on an iterative and highly convergent energy minimization algorithm with a powerful all-atom composite physics and knowledge-based force fields and hydrogen bonding (HB) network optimization technique. In the recent community-wide blind experiment, CASP10, i3Drefine (as 'MULTICOM-CONSTRUCT') was ranked as the best method in the server section as per the official assessment of CASP10 experiment. Here we provide the community with free access to i3Drefine software and systematically analyse the performance of i3Drefine in strict blind mode on the refinement targets issued in CASP10 refinement category and compare with other state-of-the-art refinement methods participating in CASP10. Our analysis demonstrates that i3Drefine is only fully-automated server participating in CASP10 exhibiting consistent improvement over the initial structures in both global and local structural quality metrics. Executable version of i3Drefine is freely available at http://protein.rnet.missouri.edu/i3drefine/.

i3Drefine Software for Protein 3D Structure Refinement and Its Assessment in CASP10

Science.gov (United States)

Bhattacharya, Debswapna; Cheng, Jianlin

2013-01-01

Protein structure refinement refers to the process of improving the qualities of protein structures during structure modeling processes to bring them closer to their native states. Structure refinement has been drawing increasing attention in the community-wide Critical Assessment of techniques for Protein Structure prediction (CASP) experiments since its addition in 8th CASP experiment. During the 9th and recently concluded 10th CASP experiments, a consistent growth in number of refinement targets and participating groups has been witnessed. Yet, protein structure refinement still remains a largely unsolved problem with majority of participating groups in CASP refinement category failed to consistently improve the quality of structures issued for refinement. In order to alleviate this need, we developed a completely automated and computationally efficient protein 3D structure refinement method, i3Drefine, based on an iterative and highly convergent energy minimization algorithm with a powerful all-atom composite physics and knowledge-based force fields and hydrogen bonding (HB) network optimization technique. In the recent community-wide blind experiment, CASP10, i3Drefine (as ‘MULTICOM-CONSTRUCT’) was ranked as the best method in the server section as per the official assessment of CASP10 experiment. Here we provide the community with free access to i3Drefine software and systematically analyse the performance of i3Drefine in strict blind mode on the refinement targets issued in CASP10 refinement category and compare with other state-of-the-art refinement methods participating in CASP10. Our analysis demonstrates that i3Drefine is only fully-automated server participating in CASP10 exhibiting consistent improvement over the initial structures in both global and local structural quality metrics. Executable version of i3Drefine is freely available at http://protein.rnet.missouri.edu/i3drefine/. PMID:23894517

Declarative event based models of concurrency and refinement in psi-calculi

DEFF Research Database (Denmark)

Normann, Håkon; Johansen, Christian; Hildebrandt, Thomas

2015-01-01

Psi-calculi constitute a parametric framework for nominal process calculi, where constraint based process calculi and process calculi for mobility can be defined as instances. We apply here the framework of psi-calculi to provide a foundation for the exploration of declarative event-based process...... calculi with support for run-time refinement. We first provide a representation of the model of finite prime event structures as an instance of psi-calculi and prove that the representation respects the semantics up to concurrency diamonds and action refinement. We then proceed to give a psi......-calculi representation of Dynamic Condition Response Graphs, which conservatively extends prime event structures to allow finite representations of (omega) regular finite (and infinite) behaviours and have been shown to support run-time adaptation and refinement. We end by outlining the final aim of this research, which...

A novel high-temperature commensurate superstructure in a natural bariopyrochlore: A structural study by means of a multiphase crystal structure refinement

Czech Academy of Sciences Publication Activity Database

Bindi, L.; Petříček, Václav; Withers, R. L.; Zoppi, M.; Bonazzi, P.

2006-01-01

Roč. 179, - (2006), s. 716-725 ISSN 0022-4596 R&D Projects: GA ČR(CZ) GA202/03/0430 Institutional research plan: CEZ:AV0Z10100521 Keywords : pyrochlore * superstructure * X-ray data * multiphase structure refinement * TEM study Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.107, year: 2006

40 CFR 80.240 - What are the small refiner gasoline sulfur standards?

Science.gov (United States)

2010-07-01

... volume of gasoline produced by a small refiner's refinery up to the lesser of: (i) 105% of the baseline gasoline volume as determined under § 80.250(a)(1); or (ii) The volume of gasoline produced at that... 40 Protection of Environment 16 2010-07-01 2010-07-01 false What are the small refiner gasoline...

Refining the Eye: Dermatology and Visual Literacy

Science.gov (United States)

Zimmermann, Corinne; Huang, Jennifer T.; Buzney, Elizabeth A.

2016-01-01

In 2014 the Museum of Fine Arts Boston and Harvard Medical School began a partnership focused on building visual literacy skills for dermatology residents in the Harvard Combined Dermatology Residency Program. "Refining the Eye: Art and Dermatology", a four session workshop, took place in the museum's galleries and utilized the Visual…

Summary of uranium refining and conversion pilot plant at Ningyo-toge works

International Nuclear Information System (INIS)

Iwata, Ichiro

1981-01-01

In the Ningyo-toge works, Power Reactor and Nuclear Fuel Development Corp., the construction of the uranium refining and conversion pilot plant was completed, and the operation will be started after the various tests based on the related laws. As for the uranium refining in Japan, the PNC process by wet refining method has been developed since 1958. The history of the development is described. It was decided to construct the refining and conversion pilot plant with 200 t uranium/year capacity as the comprehensive result of the development. This is the amount sufficient to supply UF 6 to the uranium enrichment pilot plant in Ningyo-toge. The building for the refining and conversion pilot plant is a three-story ferro-concrete building with the total floor area of about 13,000 m 2 . The raw materials are the uranium ore produced in Ningyo-toge and the yellow cakes from abroad. Uranyl sulfate solution is obtained by solvent extraction using an extraction tower or a mixer-settler. The following processes are electrolytic reduction, precipitation of uranium tetrafluoride, filtration, drying, dehydration and UF 6 conversion. The fluorine for UF 6 conversion is produced by the facility in the plant. The operation of the pilot plant will be started in the latter half of the fiscal year 1981, the batch operation is carrried out in 1982, and the continuous operation from 1983. (Kako, I.)

Creativity: a refinement of the concept for nursing practice.

Science.gov (United States)

Fasnacht, Patsy H

2003-01-01

This paper seeks to remove some of the ambiguity surrounding the conceptual meaning of creativity using techniques of concept refinement to advance the concept. Creativity is an essential component of nursing practice that occurs daily in nurse's interactions with clients, families and other nurses. Failure to acknowledge and encourage creativity in beginning nurses may hinder future development and innovations in nursing practice and in nursing science. In order to promote the development of creativity it is first necessary to clarify and refine the concept as it applies to nursing. A comprehensive review of a variety of computer and online databases resulted in thousands of articles on creativity between the years 1966 and 1999. The final sample (n = 48) was obtained using both stratified random and purposive sampling techniques. A content analysis of the literature was conducted using methods identified by Morse and illustrated in the work of Hupcey et al. Having determined the concept to be partially mature, the concept was advanced using techniques of concept refinement. Content analysis of the literature yielded three differing definitions for creativity: revelation, birth and reincarnation. Creativity occurs in the presence of intrinsic motivation and a nurturing environment. While value is often used to identify whether a product is creative, the value of the product cannot determine whether the process has occurred. The product produced determines evidence of the process of creativity. Limitations of this investigation are the use of secondary sources and the relatively small sample size (n = 48). Refinement of the concept of creativity indicates that it is a process that may be developed and influenced by the environment and is recognized by the product produced. Further investigation is needed to explore methods and techniques for developing creativity in nursing.

Verifying large modular systems using iterative abstraction refinement

International Nuclear Information System (INIS)

Lahtinen, Jussi; Kuismin, Tuomas; Heljanko, Keijo

2015-01-01

Digital instrumentation and control (I&C) systems are increasingly used in the nuclear engineering domain. The exhaustive verification of these systems is challenging, and the usual verification methods such as testing and simulation are typically insufficient. Model checking is a formal method that is able to exhaustively analyse the behaviour of a model against a formally written specification. If the model checking tool detects a violation of the specification, it will give out a counter-example that demonstrates how the specification is violated in the system. Unfortunately, sometimes real life system designs are too big to be directly analysed by traditional model checking techniques. We have developed an iterative technique for model checking large modular systems. The technique uses abstraction based over-approximations of the model behaviour, combined with iterative refinement. The main contribution of the work is the concrete abstraction refinement technique based on the modular structure of the model, the dependency graph of the model, and a refinement sampling heuristic similar to delta debugging. The technique is geared towards proving properties, and outperforms BDD-based model checking, the k-induction technique, and the property directed reachability algorithm (PDR) in our experiments. - Highlights: • We have developed an iterative technique for model checking large modular systems. • The technique uses BDD-based model checking, k-induction, and PDR in parallel. • We have tested our algorithm by verifying two models with it. • The technique outperforms classical model checking methods in our experiments

Russian refining shows signs of revival, needs investment

International Nuclear Information System (INIS)

Plotnikov, V.S.; Avgerinos, G.F.; Dvorets, N.L.; Tyukov, V.M.

1996-01-01

The Russian refining industry appears ready for a comeback but needs investment from abroad. After 7 years of annual decline, output of petroleum products in the former Soviet Union (FSU), most of it from Russian refineries, is estimated to have dropped marginally last year. And an increase is possible this year. In 1994, Russia's refineries, which account for two thirds of total FSU distillation capacity, yielded 176.2 million metric tons of oil products, compared with 214.1 million tons in 1993. Despite the precipitous decline in refinery production, net FSU exports oil refined products were down only 5% in 1994 at about 51.3 million tons. This occurred despite the decline in refinery production because of sizable contraction in oil consumption in Russian and the other republics. Russia, like the rest of the FSU, needs more than loans to produce oil or restore wells. According to the Ministries of Economics and Fuels and Energy, 90% of Russian enterprises need foreign capital. Investments to rebuild refining, gas processing, and petrochemicals are necessary, as are funds for modern technologies and equipment. Capital also is needed for extraction of resources that are remotely located or difficult to produce. In addition to providing a legal structure that provides a solid basis for investment, Russian must promote competition, change its tax system to raise revenue but allow companies to retain profits, and remove disincentives to investment for domestic and foreign enterprises

Influence of Alloy and Solidification Parameters on Grain Refinement in Aluminum Weld Metal due to Inoculation

Energy Technology Data Exchange (ETDEWEB)

Schempp, Philipp [BAM, Germany; Tang, Z. [BIAS, Germany; Cross, Carl E. [Los Alamos National Laboratory; Seefeld, T. [BIAS, Germany; Pittner, A. [BAM, Germany; Rethmeier, M. [BAM, Germany

2012-06-28

The goals are: (1) Establish how much Ti/B grain refiner is need to completely refine aluminum weld metal for different alloys and different welding conditions; (2) Characterize how alloy composition and solidification parameters affect weld metal grain refinement; and (3) Apply relevant theory to understand observed behavior. Conclusions are: (1) additions of Ti/B grain refiner to weld metal in Alloys 1050, 5083, and 6082 resulted in significant grain refinement; (2) grain refinement was more effective in GTAW than LBW, resulting in finer grains at lower Ti content - reason is limited time available for equiaxed grain growth in LBW (inability to occlude columnar grain growth); (3) welding travel speed did not markedly affect grain size within GTAW and LBW clusters; and (4) application of Hunt CET analysis showed experimental G to be on the order of the critical G{sub CET}; G{sub CET} was consistently higher for GTAW than for LBW.

Spatially adaptive hp refinement approach for PN neutron transport equation using spectral element method

International Nuclear Information System (INIS)

Nahavandi, N.; Minuchehr, A.; Zolfaghari, A.; Abbasi, M.

2015-01-01

Highlights: • Powerful hp-SEM refinement approach for P N neutron transport equation has been presented. • The method provides great geometrical flexibility and lower computational cost. • There is a capability of using arbitrary high order and non uniform meshes. • Both posteriori and priori local error estimation approaches have been employed. • High accurate results are compared against other common adaptive and uniform grids. - Abstract: In this work we presented the adaptive hp-SEM approach which is obtained from the incorporation of Spectral Element Method (SEM) and adaptive hp refinement. The SEM nodal discretization and hp adaptive grid-refinement for even-parity Boltzmann neutron transport equation creates powerful grid refinement approach with high accuracy solutions. In this regard a computer code has been developed to solve multi-group neutron transport equation in one-dimensional geometry using even-parity transport theory. The spatial dependence of flux has been developed via SEM method with Lobatto orthogonal polynomial. Two commonly error estimation approaches, the posteriori and the priori has been implemented. The incorporation of SEM nodal discretization method and adaptive hp grid refinement leads to high accurate solutions. Coarser meshes efficiency and significant reduction of computer program runtime in comparison with other common refining methods and uniform meshing approaches is tested along several well-known transport benchmarks

Petroleum movements and investments in the refining industry: The impact of worldwide environmental regulations

International Nuclear Information System (INIS)

Guariguata U., G.

1995-01-01

Since the enactment of the US Clean Air Act Amendments of 1990, the worldwide refining industry has aligned itself to become increasing attuned to the future well-being of the environment. Refiners must now develop strategies which address careful selection of crude slates, significant increases and changes in product movements, and upgrading of facilities to meet growing demand--in short, strategies which allow them to make substantial increases in capital investments. The objective of this paper is to determine the regional capital investments refiners must make in order to comply with environmental legislation. The methodology in making this determination was founded on a comprehensive analysis of worldwide petroleum supply/demand and distribution patterns for the coming five years, and included evaluation of a set of linear programming (LP) models based on forecasts for regional product demands and projections of regional specifications. The models considered two scenarios, in which either (1) refinery expansion occurs chiefly in the market consuming regions, or (2) crude producers take control of incremental crude volumes and further expand their planned refining projects and the marketing of refined products. The results of these models, coupled with an understanding of geopolitical situations and economic analyses, provided estimates for capital expenditures for the coming decade. In specific, the following issues were addressed, and are discussed in this paper: refined product trade outlook; crude supply; crude quality; shipping; and capital investments

The petroleum refining industry and the implications for the environment

International Nuclear Information System (INIS)

Saraiva, Gerardo Jose de Pontes

2000-01-01

The petroleum refining industry is basically concerned with the production of oil, lubricants and intermediate petrochemical products, utilizing crude oil as its main raw material. Petroleum refining, a distillation process that breaks hydrocarbons into fractions, eliminating undesired impurities, generates irreducible residues. Until the industrial revolution, the residues were essentially organic, susceptible to the attack of agents of destruction and transformation (bacterium, fungi, etc). Suddenly, due to the intensification of human activities of modern man, nature scattered across the planet more resistant products, many of them with long life times, that produce a deeper impact in the environment. Almost entirely marine is the pollution that results from increasing quantity of hydrocarbons dumped into the sea, a problem that is aggravated by the development of manufacturing and transportation of petroleum products. The expansion of the petroleum commerce, using essentially maritime transportation, has increased considerably the probability of accidents increasing the risks of environment pollution. This work presents suggestions and possible solutions to minimize the problem of environment pollution, caused by refining and transportation of this combustible, essential to present time industry. (author)

Kinetics of Sub-Micron Grain Size Refinement in 9310 Steel

Science.gov (United States)

Kozmel, Thomas; Chen, Edward Y.; Chen, Charlie C.; Tin, Sammy

2014-05-01

Recent efforts have focused on the development of novel manufacturing processes capable of producing microstructures dominated by sub-micron grains. For structural applications, grain refinement has been shown to enhance mechanical properties such as strength, fatigue resistance, and fracture toughness. Through control of the thermo-mechanical processing parameters, dynamic recrystallization mechanisms were used to produce microstructures consisting of sub-micron grains in 9310 steel. Starting with initial bainitic grain sizes of 40 to 50 μm, various levels of grain refinement were observed following hot deformation of 9310 steel samples at temperatures and strain rates ranging from 755 K to 922 K (482 °C and 649 °C) and 1 to 0.001/s, respectively. The resulting deformation microstructures were characterized using scanning electron microscopy and electron backscatter diffraction techniques to quantify the extent of carbide coarsening and grain refinement occurring during deformation. Microstructural models based on the Zener-Holloman parameter were developed and modified to include the effect of the ferrite/carbide interactions within the system. These models were shown to effectively correlate microstructural attributes to the thermal mechanical processing parameters.

CONSTRAINED-TRANSPORT MAGNETOHYDRODYNAMICS WITH ADAPTIVE MESH REFINEMENT IN CHARM

International Nuclear Information System (INIS)

Miniati, Francesco; Martin, Daniel F.

2011-01-01

We present the implementation of a three-dimensional, second-order accurate Godunov-type algorithm for magnetohydrodynamics (MHD) in the adaptive-mesh-refinement (AMR) cosmological code CHARM. The algorithm is based on the full 12-solve spatially unsplit corner-transport-upwind (CTU) scheme. The fluid quantities are cell-centered and are updated using the piecewise-parabolic method (PPM), while the magnetic field variables are face-centered and are evolved through application of the Stokes theorem on cell edges via a constrained-transport (CT) method. The so-called multidimensional MHD source terms required in the predictor step for high-order accuracy are applied in a simplified form which reduces their complexity in three dimensions without loss of accuracy or robustness. The algorithm is implemented on an AMR framework which requires specific synchronization steps across refinement levels. These include face-centered restriction and prolongation operations and a reflux-curl operation, which maintains a solenoidal magnetic field across refinement boundaries. The code is tested against a large suite of test problems, including convergence tests in smooth flows, shock-tube tests, classical two- and three-dimensional MHD tests, a three-dimensional shock-cloud interaction problem, and the formation of a cluster of galaxies in a fully cosmological context. The magnetic field divergence is shown to remain negligible throughout.

Decontamination of steel by melt refining: A literature review

International Nuclear Information System (INIS)

Ozturk, B.; Fruehan, R.J.

1994-01-01

It has been reported that a large amount of metal waste is produced annually by nuclear fuel processing and nuclear power plants. These metal wastes are contaminated with radioactive elements, such as uranium and plutonium. Current Department of Energy guidelines require retrievable storage of all metallic wastes containing transuranic elements above a certain level. Because of high cost, it is important to develop an effective decontamination and volume reduction method for low level contaminated metals. It has been shown by some investigators that a melt refining technique can be used for the processing of the contaminated metal wastes. In this process, contaminated metal is melted wit a suitable flux. The radioactive elements are oxidized and transferred to a slag phase. In order to develop a commercial process it is important to have information on the thermodynamics and kinetics of the removal. Therefore, a literature search was carried out to evaluate the available information on the decontamination uranium and transuranic-contaminated plain steel, copper and stainless steel by melt a refining technique. Emphasis was given to the thermodynamics and kinetics of the removal. Data published in the literature indicate that it is possible to reduce the concentration of radioactive elements to a very low level by the melt refining method. 20 refs

Side-stream products of edible oil refining as feedstocks in biodiesel production

Directory of Open Access Journals (Sweden)

Cvetković Bojan S.

2016-01-01

Full Text Available Biodiesel, a diesel fuel alternative, is produced from vegetable oils and animal fats by the transesterification reaction of triacylglycerols and lower aliphatic alcohols. Beside number advantages related to fossil fuels, the main barrier to biodiesel wider commercial use is the high price of edible oils. Recently, the special attention was given to side-stream products of edible oil refining as low-cost triacylglycerol sources for biodiesel production because of their positive economic and ecological effects. In this paper, the different procedures for biodiesel production from side-stream refining products such as soapstock, spent bleaching earth and deodorizer distillate were analyzed. The main goal of this paper is to analyze the possibilities for reusing the by-products of edible oil refinement in the biodiesel production.

Application of Al-2La-1B Grain Refiner to Al-10Si-0.3Mg Casting Alloy

Science.gov (United States)

Jing, Lijun; Pan, Ye; Lu, Tao; Li, Chenlin; Pi, Jinhong; Sheng, Ningyue

2018-05-01

This paper reports the application and microstructure refining effect of an Al-2La-1B grain refiner in Al-10Si-0.3Mg casting alloy. Compared with the traditional Al-5Ti-1B refiner, Al-2La-1B refiner shows better performances on the grain refinement of Al-10Si-0.3Mg alloy. Transmission electron microscopy analysis suggests that the crystallite structure features of LaB6 are beneficial to the heterogeneous nucleation of α-Al grains. Regarding the mechanical performances, tensile properties of Al-10Si-0.3Mg casting alloy are prominently improved, due to the refined microstructures.

Cold pressed versus refined winterized corn oils: quality, composition and aroma

International Nuclear Information System (INIS)

Aydeniz Güneşer, B.; Yılmaz, E.; Ok, S.

2017-01-01

The aims of this study were to characterize and compare cold pressed and fully refined winterized corn oils. Free fatty acidity (FFA), peroxide (PV) and p-anisidin (p-AV) values, saponification number, total carotenoid and phenolic contents of cold pressed corn oils were higher than that of the refined winterized corn oils. Linoleic and oleic acids (approximately 53-54% and 30-31%, respectively) were detected as the major fatty acids in both oil samples. Fifteen different sterols with a majority of β-sitosterol, campesterol, and stigmasterol were quantified in both oil samples. Although phenolic compounds were not quantified in the refined winterized oil samples, some flavonoids (hesperidin, rutin) and phenolic acids (gallic, syringic, rosmaniric and trans-ferulic) were detected in the cold pressed oil samples. This study concludes that cold pressed corn oils could be superior in terms of bioactive compounds but still need some quality improvements for sensory attributes. [es

Hybrid direct and iterative solvers for h refined grids with singularities

KAUST Repository

Paszyński, Maciej R.

2015-04-27

This paper describes a hybrid direct and iterative solver for two and three dimensional h adaptive grids with point singularities. The point singularities are eliminated by using a sequential linear computational cost solver O(N) on CPU [1]. The remaining Schur complements are submitted to incomplete LU preconditioned conjugated gradient (ILUPCG) iterative solver. The approach is compared to the standard algorithm performing static condensation over the entire mesh and executing the ILUPCG algorithm on top of it. The hybrid solver is applied for two or three dimensional grids automatically h refined towards point or edge singularities. The automatic refinement is based on the relative error estimations between the coarse and fine mesh solutions [2], and the optimal refinements are selected using the projection based interpolation. The computational mesh is partitioned into sub-meshes with local point and edge singularities separated. This is done by using the following greedy algorithm.

Refinements to calandria tube - liquid injection nozzle (CT-LIN) contact assessments

International Nuclear Information System (INIS)

Sedran, P.J.

2012-01-01

In recent years, the issue of CT-LIN contact, which first gained attention in 1989, has been addressed through CT-LIN gap measurements, followed by analytical predictions of time-to-contact. CT-LIN time-to-contact predictions have been preformed independently by CPUS Limited for Point Lepreau and Gentilly-2 and by AECL Sheridan Park (now Candu Energy Inc.) for Bruce Power and Gentilly-2. Both companies used the CDEPTH code in combination with CT-LIN gap measurements. Subsequent to the assessments for Point Lepreau and Gentilly-2, a recommended approach for future assessments was presented at the 2008 CANDU maintenance conference. Since that time, a number of refinements to the overall strategy for predicting CT-LIN time-to-contact have been developed and are outlined in this paper. The refinements include: 1. The use of ultrasonic LIN elevation measurements to confirm LIN creep sag behaviour 2. The development of a non-linear empirical CT Creep Sag Model 3. The development of a rationale for discrepancies observed in repeated optical CT-LIN gap measurements and a discussion of alternative CT-LIN gap measurements With these refinements, more accurate CT-LIN time-to-contact predictions can be obtained. For stations that plan to refurbish by 210,000 EFPH, the improvement in time-to-contact predictions resulting from the fore mentioned refinements will not be of any real benefit.. However, for stations that are planning life extensions in order to operate beyond 210,000 EFPH, CT-LIN contact will be an issue. For these stations, improvements in CT-LIN contact time predictions would be beneficial. This paper presents a summary of the proposed refinements and demonstrates how they would impact CT-LIN time-to-contact predictions. (author)

A refined methodology for modeling volume quantification performance in CT

Science.gov (United States)

Chen, Baiyu; Wilson, Joshua; Samei, Ehsan

2014-03-01

The utility of CT lung nodule volume quantification technique depends on the precision of the quantification. To enable the evaluation of quantification precision, we previously developed a mathematical model that related precision to image resolution and noise properties in uniform backgrounds in terms of an estimability index (e'). The e' was shown to predict empirical precision across 54 imaging and reconstruction protocols, but with different correlation qualities for FBP and iterative reconstruction (IR) due to the non-linearity of IR impacted by anatomical structure. To better account for the non-linearity of IR, this study aimed to refine the noise characterization of the model in the presence of textured backgrounds. Repeated scans of an anthropomorphic lung phantom were acquired. Subtracted images were used to measure the image quantum noise, which was then used to adjust the noise component of the e' calculation measured from a uniform region. In addition to the model refinement, the validation of the model was further extended to 2 nodule sizes (5 and 10 mm) and 2 segmentation algorithms. Results showed that the magnitude of IR's quantum noise was significantly higher in structured backgrounds than in uniform backgrounds (ASiR, 30-50%; MBIR, 100-200%). With the refined model, the correlation between e' values and empirical precision no longer depended on reconstruction algorithm. In conclusion, the model with refined noise characterization relfected the nonlinearity of iterative reconstruction in structured background, and further showed successful prediction of quantification precision across a variety of nodule sizes, dose levels, slice thickness, reconstruction algorithms, and segmentation software.