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Sample records for ii collected chemical

  1. Devices for collecting chemical compounds

    SciTech Connect

    Scott, Jill R; Groenewold, Gary S

    2013-12-24

    A device for sampling chemical compounds from fixed surfaces and related methods are disclosed. The device may include a vacuum source, a chamber and a sorbent material. The device may utilize vacuum extraction to volatilize the chemical compounds from a fixed surface so that they may be sorbed by the sorbent material. The sorbent material may then be analyzed using conventional thermal desorption/gas chromatography/mass spectrometry (TD/GC/MS) instrumentation to determine presence of the chemical compounds. The methods may include detecting release and presence of one or more chemical compounds and determining the efficacy of decontamination. The device may be useful in collection and analysis of a variety of chemical compounds, such as residual chemical warfare agents, chemical attribution signatures and toxic industrial chemicals.

  2. Chemical Bonds II

    ERIC Educational Resources Information Center

    Sanderson, R. T.

    1972-01-01

    The continuation of a paper discussing chemical bonding from a bond energy viewpoint, with a number of examples of single and multiple bonds. (Part I appeared in volume 1 number 3, pages 16-23, February 1972.) (AL)

  3. Current Evaluation of the Millennium Phytomedicine— Ginseng (II): Collected Chemical Entities, Modern Pharmacology, and Clinical Applications Emanated from Traditional Chinese Medicine

    PubMed Central

    Jia, Lee; Zhao, Yuqing; Liang, Xing-Jie

    2009-01-01

    This review, a sequel to part 1 in the series, collects about 107 chemical entities separated from the roots, leaves and flower buds of Panax ginseng, quinquefolius and notoginseng, and categorizes these entities into about 18 groups based on their structural similarity. The bioactivities of these chemical entities are described. The ‘Yin and Yang’ theory and the fundamentals of the ‘five elements’ applied to the traditional Chinese medicine (TCM) are concisely introduced to help readers understand how ginseng balances the dynamic equilibrium of human physiological processes from the TCM perspectives. This paper concerns the observation and experimental investigation of biological activities of ginseng used in the TCM of past and present cultures. The current biological findings of ginseng and its medical applications are narrated and critically discussed, including 1) its antihyperglycemic effect that may benefit type II diabetics; in vitro and in vivo studies demonstrated protection of ginseng on beta-cells and obese diabetic mouse models. The related clinical trial results are stated. 2) its aphrodisiac effect and cardiovascular effect that partially attribute to ginseng’s bioactivity on nitric oxide (NO); 3) its cognitive effect and neuropharmacological effect that are intensively tested in various rat models using purified ginsenosides and show a hope to treat Parkinson’s disease (PD); 4) its uses as an adjuvant or immunotherapeutic agent to enhance immune activity, appetite and life quality of cancer patients during their chemotherapy and radiation. Although the apoptotic effect of ginsenosides, especially Rh2, Rg3 and Compound K, on various tumor cells has been shown via different pathways, their clinical effectiveness remains to be tested. This paper also updates the antioxidant, anti-inflammatory, anti-apoptotic and immune-stimulatory activities of ginseng, its ingredients and commercial products, as well as common side effects of ginseng mainly due to its overdose, and its pharmacokinetics. PMID:19689273

  4. Collective surfing of chemically active particles.

    PubMed

    Masoud, Hassan; Shelley, Michael J

    2014-03-28

    We study theoretically the collective dynamics of immotile particles bound to a 2D surface atop a 3D fluid layer. These particles are chemically active and produce a chemical concentration field that creates surface-tension gradients along the surface. The resultant Marangoni stresses create flows that carry the particles, possibly concentrating them. For a 3D diffusion-dominated concentration field and Stokesian fluid we show that the surface dynamics of active particle density can be determined using nonlocal 2D surface operators. Remarkably, we also show that for both deep or shallow fluid layers this surface dynamics reduces to the 2D Keller-Segel model for the collective chemotactic aggregation of slime mold colonies. Mathematical analysis has established that the Keller-Segel model can yield finite-time, finite-mass concentration singularities. We show that such singular behavior occurs in our finite-depth system, and study the associated 3D flow structures. PMID:24724685

  5. Collective Surfing of Chemically Active Particles

    NASA Astrophysics Data System (ADS)

    Masoud, Hassan; Shelley, Michael J.

    2014-03-01

    We study theoretically the collective dynamics of immotile particles bound to a 2D surface atop a 3D fluid layer. These particles are chemically active and produce a chemical concentration field that creates surface-tension gradients along the surface. The resultant Marangoni stresses create flows that carry the particles, possibly concentrating them. For a 3D diffusion-dominated concentration field and Stokesian fluid we show that the surface dynamics of active particle density can be determined using nonlocal 2D surface operators. Remarkably, we also show that for both deep or shallow fluid layers this surface dynamics reduces to the 2D Keller-Segel model for the collective chemotactic aggregation of slime mold colonies. Mathematical analysis has established that the Keller-Segel model can yield finite-time, finite-mass concentration singularities. We show that such singular behavior occurs in our finite-depth system, and study the associated 3D flow structures.

  6. COLLECTION OF SULFUR GASES WITH CHEMICALLY-TREATED FILTERS

    EPA Science Inventory

    Chemically treated membrane filters were evaluated to collect hydrogen sulfide and sulfur dioxide. Four chemical treatments were tested. Silver nitrate and silver nitrate-tartaric acid filters were used to collect hydrogen sulfide, and lithium hydroxide and potassium bicarbonate ...

  7. 75 FR 36067 - Agency Information Collection Activities; Proposed Collection; Comment Request; Chemical-Specific...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2010-06-24

    ..., categories of use, production volume, byproducts of chemical production, existing data on deaths and... 324110, petroleum refineries. Title: Chemical-Specific Rules, TSCA Section 8(a). ICR numbers: EPA ICR No... AGENCY Agency Information Collection Activities; Proposed Collection; Comment Request;...

  8. Collective effects in the PEP-II B-factory

    SciTech Connect

    Corlett, J.N.

    1995-10-01

    The expected major collective effects in the PEP-II B-factory are discussed and thresholds presented. Broadband and narrow band impedance values are reviewed. Instabilities not related to impedance are discussed.

  9. 40 CFR Table II-2 to Subpart II - Collection Efficiencies of Anaerobic Processes

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 22 2013-07-01 2013-07-01 false Collection Efficiencies of Anaerobic Processes II Table II-2 to Subpart II Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) AIR PROGRAMS (CONTINUED) MANDATORY GREENHOUSE GAS REPORTING Industrial Wastewater Treatment Pt....

  10. 40 CFR Table II-2 to Subpart II - Collection Efficiencies of Anaerobic Processes

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 21 2014-07-01 2014-07-01 false Collection Efficiencies of Anaerobic Processes II Table II-2 to Subpart II Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) AIR PROGRAMS (CONTINUED) MANDATORY GREENHOUSE GAS REPORTING Industrial Wastewater Treatment Pt....

  11. COLLECTION AND CHEMICAL ANALYSIS OF LICHENS FOR BIOMONITORING

    EPA Science Inventory

    This chapter discusses the interrelated aspects of biomonitoring using chemical analysis of lichens. Many unique aspects of study objectives, study design (including design tasks, considerations, and sampling schemes), sample collection, sample preparation, and sample analysis th...

  12. Device for collecting chemical compounds and related methods

    SciTech Connect

    Scott, Jill R.; Groenewold, Gary S.; Rae, Catherine

    2013-01-01

    A device for sampling chemical compounds from fixed surfaces and related methods are disclosed. The device may include a vacuum source, a chamber and a sorbent material. The device may utilize vacuum extraction to volatilize the chemical compounds from the fixed surfaces so that they may be sorbed by the sorbent material. The sorbent material may then be analyzed using conventional thermal desorption/gas chromatography/mass spectrometry (TD/GC/MS) instrumentation to determine presence of the chemical compounds. The methods may include detecting release and presence of one or more chemical compounds and determining the efficacy of decontamination. The device may be useful in collection and analysis of a variety of chemical compounds, such as residual chemical warfare agents, chemical attribution signatures and toxic industrial chemicals.

  13. Collection and chemical analysis of lichens for biomonitoring. Book chapter

    SciTech Connect

    Jackson, L.L.; Ford, J.; Schwartzman, D.

    1991-01-01

    The chapter discusses the interrelated aspects of biomonitoring using chemical analysis of lichens. Many unique aspects of study objectives, study design (including design tasks, considerations, and sampling schemes), sample collection, sample preparation, and sample analysis that are required for a successful biomonitoring program using chemical analysis are emphasized. The advantages and disadvantages of common analytical methods suitable for chemical analysis of lichens are briefly discussed. Aspects of a quality assurance program and final contract reports are highlighted. In addition, some examples of studies using chemical analysis of lichens are discussed.

  14. 76 FR 40377 - Agency Information Collection Activities; Proposed Collection; Comment Request; Class II Special...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-07-08

    ... final rule (64 FR 13254, March 17, 1999). Because the packaging requirements for condoms are similar to... Collection; Comment Request; Class II Special Controls Guidance Document: Labeling for Natural Rubber Latex... for the labeling of natural rubber latex condoms. DATES: Submit either electronic or written...

  15. [Chemical constituents of Artemisia lactiflora(II)].

    PubMed

    Lin, Fu-Di; Luo, Dang-Wei; Ye, Jing; Xiao, Mei-Tian

    2014-07-01

    To study the chemical constituents of Artemisia lactiflora. The compounds were isolated by column chromatography with silica gel, C18 reverse-phase silica gel, semi-preparative HPLC, and their structures were elucidated on the basis of spectral analysis. Twelve compounds were isolated from alcohol extracts of A. lactiflora and identified as 7-hydroxycoumarin (1), 7-methoxycoumarin (2), balanophonin (3), aurantiamide (4), aurantiamide acetate (5), isovitexin (6), kaempferol-3-O-beta-D-rutinoside (7), rutin (8), caffeic acid ethyl ester (9), quercetin (10), methyl 3, 5-di-O-caffeoyl quinate (11) and methyl 3, 4-di-O-caffeoyl quinate (12), respectively. Compounds 3-12 were obtained from this plant for the first time. PMID:25276977

  16. Featured collection introduction: contaminants of emerging concern II

    USGS Publications Warehouse

    Battaglin, William A.; Kolok, Alan

    2014-01-01

    This collection of 13 articles focuses on CECs, and each of the articles highlights a specific aspect of this broad topic. The articles were solicited from researchers who participated in the second summer specialty conference on this topic, organized by the American Water Resources Association. The title of the conference was “CECs in Water Resources II: Research, Engineering and Community Action,” and the conference, as well as the articles in this featured collection, focus on a better and more comprehensive understanding of these contaminants. The conference was held in Denver, Colorado, on June 25-27, 2012, and approximately 125 conference attendees participated in an interdisciplinary forum of more than 75 presentations including keynote or plenary presentations by Dana Kolpin, Jorg Drewes, Heiko Schoenfuss, Chris Metcalfe, Vicki Blazer, and Tyrone Hayes. The first conference was held in 2007 and also produced a featured collection of articles (Battaglin and Kolpin, 2009).

  17. Impedances and collective instabilities of the Tevatron at Run II

    SciTech Connect

    Ng, King-Yuen, FERMI

    1998-09-01

    The longitudinal and transverse coupling impedances of the Tevatron vacuum chamber are estimated and summed up. The resistive-wall impedances of the beam pipe and the laminations in the Lambertson magnets dominate below {approximately} 50 MHz. Then come the inductive parts of the bellows and BPM`s. The longitudinal and transverse collective instabilities, for both single bunch and multi bunches, are studied using Run II parameters. As expected the transverse coupled-bunch instability driven by the resistive-wall impedance is the most severe collective instability. However, it can be damped by a transverse damper designed for the correction of injection offsets. The power of such a damper has been studied.

  18. Strippable coatings for forensic collection of trace chemicals from surfaces.

    PubMed

    Beltis, Kevin J; Drennan, Paul M; Jakubowski, Michael J; Pindzola, Bradford A

    2012-12-18

    Surface sampling for chemical analysis plays a vital role in applications like environmental monitoring, industrial hygiene, homeland security, and forensics. The standard surface sampling tool is a simple cotton gauze pad, but as techniques become more sensitive and the variety of analytes increases, gauze is failing to meet the needs of the community. Here, the collection of eight small molecules from glass surfaces with three different commercial spray-on, strippable coatings was demonstrated and their collection efficiency, as measured by gas chromatography/mass spectrometry, was compared to that of a standard cotton gauze. The three coating systems recovered 87-95% of the each compound, on average, from a nominal initial surface coverage of 0.1 g/m(2) per analyte. These recoveries were 3-fold better than the cotton gauze which had an average collection efficiency of 31%. PMID:23157576

  19. Appendix C. Collection of Samples for Chemical Agent Analysis

    SciTech Connect

    Koester, C; Thompson, C; Doerr, T; Scripsick, R

    2005-09-23

    This chapter describes procedures for the collection and analysis of samples of various matrices for the purpose of determining the presence of chemical agents in a civilian setting. This appendix is intended to provide the reader with sufficient information to make informed decisions about the sampling and analysis process and to suggest analytical strategies that might be implemented by the scientists performing sampling and analysis. This appendix is not intended to be used as a standard operating procedure to provide detailed instructions as to how trained scientists should handle samples. Chemical agents can be classified by their physical and chemical properties. Table 1 lists the chemical agents considered by this report. In selecting sampling and analysis methods, we have considered procedures proposed by the Organization for Prohibition of Chemical Weapons (OPCW), the U. S. Environmental Protection Agency (EPA), and peer-reviewed scientific literature. EPA analytical methods are good resources describing issues of quality assurance with respect to chain-of-custody, sample handling, and quality control requirements.

  20. PWR steam generator chemical cleaning. Phase II. Final report

    SciTech Connect

    Not Available

    1980-01-01

    Two techniques believed capable of chemically dissolving the corrosion products in the annuli between tubes and support plates were developed in laboratory work in Phase I of this project and were pilot tested in Indian Point Unit No. 1 steam generators. In Phase II, one of the techniques was shown to be inadequate on an actual sample taken from an Indian Point Unit No. 2 steam generator. The other technique was modified slightly, and it was demonstrated that the tube/support plate annulus could be chemically cleaned effectively.

  1. Chemical Constituents of Ligularia wilsoniana Collected in Chongqing, China.

    PubMed

    Okamoto, Yasuko; Taniguchi, Mizuho; Nakashima, Katsuyuki; Gong, Xun; Hanai, Ryo; Kuroda, Chiaki; Tori, Motoo

    2016-02-01

    The chemical constituents of Ligularia wilsoniana were studied for the first time, using four samples collected in Chongqing City, China. Two new compounds, 6β-(2',3'-epoxy-2'-methylpropanoyloxy)-β,10β-epoxyfuranoeremophilane and 11αH-6β-(2'-hydroxymethylacryloyloxy)-1β,10β;7β,8β- diepoxyeremophilanolide, as well as eight known compounds, were isolated from one of the samples, while three to four known furanoeremophilanes were isolated from the other three samples. No compound was common to the two classes of the samples, demonstrating the presence of at least two chemotypes of this species. PMID:27032188

  2. 78 FR 41785 - Agency Information Collection Activities; Comment Request; Implementation of Title I/II Program...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-07-11

    ... Agency Information Collection Activities; Comment Request; Implementation of Title I/II Program... notice will be considered public records. Title of Collection: Implementation of Title I/II Program... Estimated Number of Annual Burden Hours: 6,573. Abstract: The Implementation of Title I/II...

  3. 77 FR 60743 - Proposed Collection; Comment Request for Schedule F, Part II and III (Form 1040)

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-10-04

    ... Internal Revenue Service Proposed Collection; Comment Request for Schedule F, Part II and III (Form 1040..., Part II and III (Form 1040), Profit or Loss From Farming. DATES: Written comments should be received on... Number: Schedule F, Part II and III (Form 1040). Abstract: Schedule F, Part II and III (Form 1040)...

  4. 77 FR 59891 - Proposed Information Collection; Comment Request; Chemical Weapons Convention Declaration and...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-10-01

    ... Bureau of Industry and Security Proposed Information Collection; Comment Request; Chemical Weapons...@bis.doc.gov . SUPPLEMENTARY INFORMATION: ] I. Abstract The Chemical Weapons Convention Implementation Act of 1998 and Commerce Chemical Weapons Convention Regulations (CWCR) specify the...

  5. Improved Devices for Collecting Sweat for Chemical Analysis

    NASA Technical Reports Server (NTRS)

    Feedback, Daniel L.; Clarke, Mark S. F.

    2011-01-01

    Improved devices have been proposed for collecting sweat for biochemical analysis - especially for determination of the concentration of Ca2+ ions in sweat as a measure of loss of Ca from bones. Unlike commercially available sweat-collection patches used previously in monitoring osteoporosis and in qualitative screening for some drugs, the proposed devices would not allow evaporation of the volatile chemical components (mostly water) of sweat. Moreover, the proposed devices would be designed to enable determination of the volumes of collected sweat. From these volumes and the quantities of Ca(2+) and/or other analytes as determined by other means summarized below, one could determine the concentrations of the analytes in sweat. A device according to the proposal would be flexible and would be worn like a commercial sweat-collection patch. It would be made of molded polydimethylsiloxane (silicone rubber) or other suitable material having properties that, for the purpose of analyzing sweat, are similar to those of glass. The die for molding the silicone rubber would be fabricated by a combination of lithography and electroplating. The die would reproducibly form, in the silicone rubber, a precisely defined number of capillary channels per unit area, each channel having a precisely defined volume. Optionally, electrodes for measuring the Ca(2+) content of the sweat could be incorporated into the device. The volume of sweat collected in the capillary channels of the device would be determined from (1) the amount of light or radio waves of a given wavelength absorbed by the device and (2) the known geometry of the array of capillary channels. Then, in one of two options, centrifugation would be performed to move the sweat from the capillary tubes to the region containing the electrodes, which would be used to measure the Ca(2+) content by a standard technique. In the other option, centrifugation would be performed to remove the sweat from the device to make the sweat available to other analytical instruments for measuring concentrations of substances other than Ca(2+).

  6. Improved Devices for Collecting Sweat for Chemical Analysis

    NASA Technical Reports Server (NTRS)

    Feeback, Daniel L.; Clarke, Mark S. F.

    2011-01-01

    Improved devices have been proposed for collecting sweat for biochemical analysis especially for determination of the concentration of Ca2+ ions in sweat as a measure of loss of Ca from bones. Unlike commercially available sweat-collection patches used previously in monitoring osteoporosis and in qualitative screening for some drugs, the proposed devices would not allow evaporation of the volatile chemical components (mostly water) of sweat. Moreover, the proposed devices would be designed to enable determination of the volumes of collected sweat. From these volumes and the quantities of Ca2+ and/or other analytes as determined by other means summarized below, one could determine the concentrations of the analytes in sweat. A device according to the proposal would be flexible and would be worn like a commercial sweat-collection patch. It would be made of molded polydimethylsiloxane (silicone rubber) or other suitable material having properties that, for the purpose of analyzing sweat, are similar to those of glass. The die for molding the silicone rubber would be fabricated by a combination of lithography and electroplating. The die would reproducibly form, in the silicone rubber, a precisely defined number of capillary channels per unit area, each channel having a precisely defined volume. Optionally, electrodes for measuring the Ca2+ content of the sweat could be incorporated into the device. The volume of sweat collected in the capillary channels of the device would be determined from (1) the amount of light or radio waves of a given wavelength absorbed by the device and (2) the known geometry of the array of capillary channels. Then, in one of two options, centrifugation would be performed to move the sweat from the capillary tubes to the region containing the electrodes, which would be used to measure the Ca2+ content by a standard technique. In the other option, centrifugation would be performed to remove the sweat from the device to make the sweat available to other analytical instruments for measuring concentrations of substances other than Ca2+.

  7. Chemical profile of size-fractionated soils collected in a semiarid industrial area of Argentina

    NASA Astrophysics Data System (ADS)

    Morales Del Mastro, Anabella; Pereyra, Marcelo; Londonio, Agustín; Pereyra, Victoria; Rebagliati, Raúl Jiménez; Dawidowski, Laura; Gómez, Darío; Smichowski, Patricia

    2014-12-01

    A study was undertaken to assess the chemical profile of soil collected in Bahía Blanca (Argentina). In this industrial city, semiarid soils are affected by different industrial and agricultural activities, the presence of a saltpeter extraction facility, traffic and increasing urbanization. Sixteen soil samples (superficial and sub-superficial) were collected. Samples were sieved in two fractions (A < 37 μm, and 37 < B < 50 μm) before elemental analysis. Major, minor and trace elements namely, Al, As, Ba, Ca, Cd, Cr, Cu, Fe, Mg, Mn, Mo, Ni, Pb, Sb, Ti, V and Zn were determined by inductively coupled plasma optical emission spectrometry (ICP OES). Anions (Cl-, F-, SO42-) and cations (K+, Na+ and NH4+) were determined by high performance liquid chromatography (HPLC) after an aqueous extraction. As expected, crustal elements namely, Al, Ca, Fe, Mg and Ti exhibited the highest concentrations. Mean elemental concentration ranged from <0.3 μg g-1 (Sb) to 14.6 ± 0.6% (Ca). Ions concentrations in the soluble fraction measured at mg g-1 levels were in the order Cl- > Na+ ≅ SO42- > K+ > NO3-. Three indicators, namely, (i) coefficient of variation, (ii) coefficient of divergence and (iii) ratio of elemental concentration with respect to Ca were used to assess chemical, spatial and inter-profile variability. Chloride > Ca > Na+ > Mo > SO42-, dominated the variability indicating that these are key chemical markers for future assessment of crustal contribution to airborne particles in the area. The ratios Xi/Ca allowed discriminating the soil of the semi-arid region surrounding Bahía Blanca. The chemical profiles obtained in this study, particularly those of topsoil, will be a key input to characterize soil resuspension and its contribution to airborne particulate matter in a forthcoming receptor model analysis.

  8. 77 FR 22559 - Proposed Information Collection; Comment Request; Chemical Weapons Convention Provisions of the...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-04-16

    ... Bureau of Industry and Security Proposed Information Collection; Comment Request; Chemical Weapons...) 482-4895, Lawrence.Hall@bis.doc.gov . SUPPLEMENTARY INFORMATION: I. Abstract The Chemical Weapons... weapons (CW). The CWC prohibits the use, development, production, acquisition, stockpiling, retention,...

  9. Data Availability in Vocational Education. Final Report. Volume II. Data Base of Needed and Collected Information.

    ERIC Educational Resources Information Center

    Lawrence, John E. S.; And Others

    This is the second of a four-volume report of Project EDNEED II (Empirical Determination of Nationally Essential Educational Data). (Project EDNEED II, conducted from July 1975 to September 1976, was designed to document the extent to which data currently collected by State vocational education agencies could be used to answer prioritized…

  10. Recovery of Cu(II) by chemical reduction using sodium dithionite.

    PubMed

    Chou, Yi-Hsuan; Yu, Jui-Hsuan; Liang, Yang-Min; Wang, Pin-Jan; Li, Chi-Wang; Chen, Shiao-Shing

    2015-12-01

    Wastewaters containing Cu(II) along with ligands are ubiquitous in various industrial sectors. Efficacy of treatment processes for copper removal, especially precipitation, is greatly debilitated by ligands. Chemical reduction being commonly employed for production of metal nanoparticles has also been used for removing copper. Addition of ammonia was reported to be essential for improving copper reduction efficiency by increasing copper solubility at alkaline pH values. In this study, chemical reduction was employed to treat ligand-containing wastewater, exploiting the fact that ligands and metals are coexisted in many wastewaters. Result shows that copper ions were removed by either reduction or precipitation mechanisms depending on pH, type of ligands, and mixing condition. Complete copper reduction/removal was achieved under optimal condition. The lowest removal efficiency observed at pH 9.0 for ammonia system is due to formation of nano-sized particles, which are readily to pass through 0.45μm filter used for sample pretreatment before copper analysis. Instead of producing metallic copper, cuprous and copper oxide are identified in the samples collected from ammonia system and EDTA system, respectively. Re-oxidation of metallic copper particles by atmospheric oxygen during sample handling or incomplete reduction of Cu(II) ions during reduction process might be the cause. Finally, reduction process was applied to treat real wastewater, achieving complete removal of copper but only 10% of nickel. PMID:26210323

  11. The holothuroids, echinoids and asteroids (echinodermata) collected by the Snellius-II expedition

    NASA Astrophysics Data System (ADS)

    Jangoux, Michel; De Ridder, Chantal; Massin, Claude; Darsono, Prapto

    Together the holothuroids, echinoids and asteroids collected by the Snellius-II Expedition represent 144 different species (40 species of holothuroids, 45 species of echinoids and 59 species of asteroids). The collection includes 14 species new to science. Among the remaining 130 species there are five new records for the Austro-Malayan region and 13 new records for the Indonesian seas.

  12. 77 FR 1084 - Agency Information Collection Activities Under Review; Title II of the Americans With...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-01-09

    ... From the Federal Register Online via the Government Publishing Office DEPARTMENT OF JUSTICE Agency Information Collection Activities Under Review; Title II of the Americans With Disabilities Act of 1990/Section 504 of the Rehabilitation Act of 1973 Discrimination Complaint Form ACTION: 30-Day Notice of Information Collection under review...

  13. Sustainability Indicators for Chemical Processes : II. Data Needs

    EPA Science Inventory

    In order to begin repair of the environmental quality of the planet, there is a need to embrace sustainable development at many levels of the chemical industry and society. One way that the chemical industry is responding to this need is through sustainability evaluations, retrof...

  14. Sorption and cosorption of lead (II) and methylene blue on chemically modified biomass.

    PubMed

    Ding, Zhuhong; Hu, Xin; Zimmerman, Andrew R; Gao, Bin

    2014-09-01

    Sorption and cosorption of lead (Pb(II)) and methylene blue (MB) in aqueous solutions on low-cost biosorbents made from chemically modified agricultural by-products was investigated. Modified cotton exhibited the highest adsorption capacity for Pb(II), while modified cotton and peanut hull had higher equilibrium adsorption capacity of MB than the other biosorbents. Different chemical modification methods of hickory resulted in no great variation on the equilibrium adsorption capacity of Pb(II) and MB except for the one treated with alkali. Simultaneous sorption of Pb(II) and MB on the biosorbents showed Pb(II) to be preferentially adsorbed at higher Pb(II)-to-MB molar ratios in solution except for modified peanut hull. The equilibrium Pb adsorption contents decreased with the increasing pre-loading of MB and vice versa, suggesting the competitive rather than synergistic adsorption of the two contaminants on the biosorbents. PMID:24998306

  15. 76 FR 7841 - Agency Information Collection Activities; Proposed Collections; Toxic Chemical Release Reporting...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-02-11

    ... under section 313 of EPCRA must also report pollution prevention and waste management data, including... chemical releases. Industrial facilities use the TRI data to evaluate the efficiency of their production..., transfers, and other waste management activities by covered facilities on a ] yearly basis. While...

  16. Forensic collection of trace chemicals from diverse surfaces with strippable coatings.

    PubMed

    Jakubowski, Michael J; Beltis, Kevin J; Drennan, Paul M; Pindzola, Bradford A

    2013-11-01

    Surface sampling for chemical analysis plays a vital role in environmental monitoring, industrial hygiene, homeland security and forensics. The standard surface sampling tool, a simple cotton gauze pad, is failing to meet the needs of the community as analytical techniques become more sensitive and the variety of analytes increases. In previous work, we demonstrated the efficacy of non-destructive, conformal, spray-on strippable coatings for chemical collection from simple glass surfaces. Here we expand that work by presenting chemical collection at a low spiking level (0.1 g m(-2)) from a diverse array of common surfaces - painted metal, engineering plastics, painted wallboard and concrete - using strippable coatings. The collection efficiency of the strippable coatings is compared to and far exceeds gauze pads. Collection from concrete, a particular challenge for wipes like gauze, averaged 73% over eight chemically diverse compounds for the strippable coatings whereas gauze averaged 10%. PMID:24040648

  17. METEORLOGICAL AND CHEMICAL DATA COLLECTED IN THE UNITED STATES TO INFER DRY DEPOSITION OF TRACE CONTAMINANTS

    EPA Science Inventory

    The Atmospheric Turbulence and Diffusion Division is responsible for the operation of a prototype network developed to collect meteorological and surface condition data. The network of meteorological and chemical filterpack monitoring stations has been in operation since the summ...

  18. [Chemical safety (II)--Methodologic and practical problems].

    PubMed

    Indulski, J A; Krajewski, J A; Majka, J A

    1988-01-01

    Main components of the problem of chemical safety, their role and aims as well as their mutual relations are presented. Need to create a register of chemical compounds and necessity to set up an information centre which would help functioning the whole system are justified. Risk assessment is believed to be the main aspect of cognitive activities aimed at determining the probability of occurrence of harmful consequences of exposure. Risk assessment is a set of complex legal, organizational and administrative undertakings supposed to reduce the hazards resulting from exposure to chemicals. Necessity to calculate costs and benefits coming from the undertaking and need to analyse social perception of risk which is important for preventive action are justified. What is stressed is the significance of a widespread education aimed at forming attitudes towards chemical hazards. PMID:3075253

  19. Collection, chemical analysis, and evaluation of coal samples in 1975

    USGS Publications Warehouse

    Swanson, Vernon Emanuel; Medlin, J.H.; Hatch, J.R.; Coleman, S.L.; Wood, G.H., Jr.; Woodruff, S.D.; Hildebrand, R.T.

    1976-01-01

    During 1975, the U.S. Geological Survey, in cooperation with other Federal and State agencies, university groups, and private companies, continued its program to augment and refine information on the composition of coal in the United States. This report includes all analytical data on 799 channel samples of coal beds from major operating mines and core holes in 28 States, collected mainly by State Geological Surveys under a cooperative program funded largely by the U.S. Energy Research and Development Administration. For each sample, the U.S. Geological Survey has quantitatively determined the amounts of 24 major, minor, and trace elements (including AI, As, Cd, Cu, F, Hg, Mn, Na, Pb, Se, U, and Zn), and has semiquantitatively determined the concentrations of 15 to 20 additional trace elements (including B, Be, Cr, Ge, Mo, Ni, and V). In addition, the U.S. Bureau of Mines has provided proximate and ultimate analyses, and Btu and forms-of-sulfur determinations on 488 of the samples. Statistical summaries of the data are given for all coal samples in the United States, for coal divided by rank (53 anthracite, 509 bituminous coal, 183 subbituminous coal, and 54 lignite samples), and the arithmetic means, ranges, and geometric means and deviations are given for the coal in each of seven different major coal areas in the United States. For example, the average coal in the United States contains 11.3 percent ash, 10.0 percent moisture, 2.0 percent sulfur, and has 11,180 Btu per pound; of the 10 major oxides determined on the 525?C ash, the average SiO2 content is 38 percent, Al2O3 20 percent, and Na2O 0.67 percent; the average Cd content is 7.3 ppm, Pb 114 ppm, and Zn 151 ppm (range 1 ppm to 6.0 percent). As determined on the raw coal, the average Hg content is 0.18 ppm (range <0.01 to 63.0 ppm), the Se content 4.1 ppm (range <0.1 to 150 ppm), and the U content 1.8 ppm (range <0.2 to 42.9 ppm).

  20. Thermodynamics of natural selection II: Chemical Carnot cycles.

    PubMed

    Smith, Eric

    2008-05-21

    This is the second in a series of three papers devoted to energy flow and entropy changes in chemical and biological processes, and to their relations to the thermodynamics of computation. In the first paper of the series, it was shown that a general-form dimensional argument from the second law of thermodynamics captures a number of scaling relations governing growth and development across many domains of life. It was also argued that models of physiology based on reversible transformations provide sensible approximations within which the second-law scaling is realized. This paper provides a formal basis for decomposing general cyclic, fixed-temperature chemical reactions, in terms of the chemical equivalent of Carnot's cycle for heat engines. It is shown that the second law relates the minimal chemical work required to perform a cycle to the Kullback-Leibler divergence produced in its chemical output ensemble from that of a Gibbs equilibrium. Reversible models of physiology are used to create reversible models of natural selection, which relate metabolic energy requirements to information gain under optimal conditions. When dissipation is added to models of selection, the second-law constraint is generalized to a relation between metabolic work and the combined energies of growth and maintenance. PMID:18367209

  1. Teacher's Guide to SERAPHIM Software II. Chemical Principles.

    ERIC Educational Resources Information Center

    Bogner, Donna J.

    Designed to assist chemistry teachers in selecting appropriate software programs, this publication is the second in a series of six teacher's guides from Project SERAPHIM, a program sponsored by the National Science Foundation. This guide is keyed to the chapters of the text "Chemical Principles." Program suggestions are arranged in the same order…

  2. High Throughput Pharmacokinetics for Environmental Chemicals (FutureToxII)

    EPA Science Inventory

    Pharmacokinetic (PK) models are critical to determine whether chemical exposures produce potentially hazardous tissue concentrations. For bioactivity identified in vitro (e.g. ToxCast) – hazardous or not – PK models can forecast exposure thresholds, below which no significant bio...

  3. 78 FR 74173 - Notice of Proposed Information Collection Requests: Heritage Health Index II on the State of...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-12-10

    ...; enhance learning and innovation; and support professional development. IMLS is responsible for identifying... ARTS AND THE HUMANITIES Notice of Proposed Information Collection Requests: Heritage Health Index II on the State of America's Collections (HHI II) AGENCY: Institute of Museum and Library Services,...

  4. Chemical vapor deposition of low reflective cobalt (II) oxide films

    NASA Astrophysics Data System (ADS)

    Amin-Chalhoub, Eliane; Duguet, Thomas; Samélor, Diane; Debieu, Olivier; Ungureanu, Elisabeta; Vahlas, Constantin

    2016-01-01

    Low reflective CoO coatings are processed by chemical vapor deposition from Co2(CO)8 at temperatures between 120 °C and 190 °C without additional oxygen source. The optical reflectivity in the visible and near infrared regions stems from 2 to 35% depending on deposition temperature. The combination of specific microstructural features of the coatings, namely a fractal "cauliflower" morphology and a grain size distribution more or less covering the near UV and IR wavelength ranges enhance light scattering and gives rise to a low reflectivity. In addition, the columnar morphology results in a density gradient in the vertical direction that we interpret as a refractive index gradient lowering reflectivity further down. The coating formed at 180 °C shows the lowest average reflectivity (2.9%), and presents an interesting deep black diffuse aspect.

  5. Chemical abundances in LMC stellar populations. II. The bar sample

    NASA Astrophysics Data System (ADS)

    Van der Swaelmen, M.; Hill, V.; Primas, F.; Cole, A. A.

    2013-12-01

    Aims: This paper compares the chemical evolution of the Large Magellanic Cloud (LMC) to that of the Milky Way (MW) and investigates the relation between the bar and the inner disc of the LMC in the context of the formation of the bar. Methods: We obtained high-resolution and mid signal-to-noise ratio spectra with FLAMES/GIRAFFE at ESO/VLT and performed a detailed chemical analysis of 106 and 58 LMC field red giant stars (mostly older than 1 Gyr), located in the bar and the disc of the LMC respectively. To validate our stellar parameter determinations and abundance measurement procedures, we performed thorough tests using the well-known mildly metal-poor Milky-Way thick disc giant Arcturus (HD 124897, α Boo). We measured elemental abundances for O, Mg, Si, Ca, Ti (α-elements), Na (light odd element), Sc, V, Cr, Co, Ni, Cu (iron-peak elements), Y, Zr, Ba, La, and Eu (s- and r-elements). Results: We find that the α-element ratios [Mg/Fe] and [O/Fe] are lower in the LMC than in the MW while the LMC has similar [Si/Fe], [Ca/Fe], and [Ti/Fe] to the MW. As for the heavy elements, [Ba,La/Eu] exhibit a strong increase with increasing metallicity starting from [Fe/H] ≈ -0.8 dex, and the LMC has lower [Y + Zr/Ba + La] ratios than the MW. Cu is almost constant over all metallicities and about 0.5 dex lower in the LMC than in the MW. The LMC bar and inner disc exhibit differences in their [α/ Fe] (slightly larger scatter for the bar in the metallicity range [-1, -0.5]), their Eu (the bar trend is above the disc trend for [Fe/H] ≥ -0.5 dex), their Y and Zr, their Na and their V (offset between the bar and the disc distributions). Conclusions: Our results show that the chemical history of the LMC experienced a strong contribution from type Ia supernovae as well as a strong s-process enrichment from metal-poor AGB winds. Massive stars made a smaller contribution to the chemical enrichment compared to the MW. The observed differences between the bar and the disc speak in favour of an episode of enhanced star formation a few Gyr ago, occurring in the central parts of the LMC and leading to the formation of the bar. This is in agreement with recently derived star formation histories. Proposals 072.B-0293(B) and 078.B-0323(A), P.I. Vanessa Hill.Full Tables 3, 5, 7, 9, 11 and abundances tables for the LMC bar and disc samples are only available in electronic form at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/560/A44Table 11 is also available in electronic form at http://www.aanda.org

  6. Tree Resin Composition, Collection Behavior and Selective Filters Shape Chemical Profiles of Tropical Bees (Apidae: Meliponini)

    PubMed Central

    Leonhardt, Sara D.; Schmitt, Thomas; Blüthgen, Nico

    2011-01-01

    The diversity of species is striking, but can be far exceeded by the chemical diversity of compounds collected, produced or used by them. Here, we relate the specificity of plant-consumer interactions to chemical diversity applying a comparative network analysis to both levels. Chemical diversity was explored for interactions between tropical stingless bees and plant resins, which bees collect for nest construction and to deter predators and microbes. Resins also function as an environmental source for terpenes that serve as appeasement allomones and protection against predators when accumulated on the bees' body surfaces. To unravel the origin of the bees' complex chemical profiles, we investigated resin collection and the processing of resin-derived terpenes. We therefore analyzed chemical networks of tree resins, foraging networks of resin collecting bees, and their acquired chemical networks. We revealed that 113 terpenes in nests of six bee species and 83 on their body surfaces comprised a subset of the 1,117 compounds found in resins from seven tree species. Sesquiterpenes were the most variable class of terpenes. Albeit widely present in tree resins, they were only found on the body surface of some species, but entirely lacking in others. Moreover, whereas the nest profile of Tetragonula melanocephala contained sesquiterpenes, its surface profile did not. Stingless bees showed a generalized collecting behavior among resin sources, and only a hitherto undescribed species-specific “filtering” of resin-derived terpenes can explain the variation in chemical profiles of nests and body surfaces from different species. The tight relationship between bees and tree resins of a large variety of species elucidates why the bees' surfaces contain a much higher chemodiversity than other hymenopterans. PMID:21858119

  7. Chemical warfare agents: their past and continuing threat and evolving therapies. Part II of II.

    PubMed

    Smith, Kathleen J; Skelton, Henry

    2003-01-01

    Chemical warfare agents are ideal weapons for terrorists and for use in military operations against both civilian populations and troops. Thus, there have been efforts by the United States in cooperation with other concerned nations to develop animal models to understand the pathophysiology of the injuries induced by these agents, and to develop suitable animal models for testing of pre-and post-exposure protectants and therapies. Sulfur mustard remains the most significant chemical warfare agent that produces cutaneous injuries. Institution of standard recommendations prior to threatened exposure or after exposure are something that we need to be aware of in the world we live in. In addition, pre-and post-exposure therapies now being studied offer hope for moderating the mortality and morbidity that can result from chemical exposure. PMID:14673262

  8. Multiplicity among chemically peculiar stars. II. Cool magnetic Ap stars

    NASA Astrophysics Data System (ADS)

    Carrier, F.; North, P.; Udry, S.; Babel, J.

    2002-10-01

    We present new orbits for sixteen Ap spectroscopic binaries, four of which might in fact be Am stars, and give their orbital elements. Four of them are SB2 systems: HD 5550, HD 22128, HD 56495 and HD 98088. The twelve other stars are: HD 9996, HD 12288, HD 40711, HD 54908, HD 65339, HD 73709, HD 105680, HD 138426, HD 184471, HD 188854, HD 200405 and HD 216533. Rough estimates of the individual masses of the components of HD 65339 (53 Cam) are given, combining our radial velocities with the results of speckle interferometry and with Hipparcos parallaxes. Considering the mass functions of 74 spectroscopic binaries from this work and from the literature, we conclude that the distribution of the mass ratio is the same for cool Ap stars and for normal G dwarfs. Therefore, the only differences between binaries with normal stars and those hosting an Ap star lie in the period distribution: except for the case of HD 200405, all orbital periods are longer than (or equal to) 3 days. A consequence of this peculiar distribution is a deficit of null eccentricities. There is no indication that the secondary has a special nature, like e.g. a white dwarf. Based on observations collected at the Observatoire de Haute-Provence (CNRS), France. Tables 1 to 3 are only available in electronic form at the CDS via anonymous ftp to cdsarc.u-strasbg.fr (130.79.128.5) or via http://cdsweb.u-strasbg.fr/cgi-bin/qcat?J/A+A/394/151 Appendix B is only available in electronic form at http://www.edpsciences.org

  9. Synthesis, characterization and quantum chemical ab initio calculations of new dimeric aminocyclodiphosph(V)azane and its Co(II), Ni(II) and Cu(II) complexes.

    PubMed

    Alaghaz, Abdel-Nasser M A; Al-Sehemi, Abdullah G; El-Gogary, Tarek M

    2012-09-01

    The complexes of type [M(2)LCl(2)] in which M=Co(II), Ni(II) and Cu(II) ions and L are 1,3-o-pyridyl-2,4-dioxo-2',4'-bis(3-benzo[d]thiazol-2-yl-2-iminothiophene) cyclodiphosph(V)azane, were prepared and their structures were characterized by different physical techniques (IR, UV-Vis, (1)H NMR, (31)P NMR, mass, TGA, DTA, XRD, SEM, magnetic moment and electrical conductance measurements). Ab initio calculations at the level of DFT B3LYP/6-31G(d) were utilized to find the optimum geometry of the ligand. Spectral characterization of the ligand was simulated using DT-DFT method. Infrared spectra of the complexes indicate deprotonation and coordination of the imine NH. It also confirms that nitrogen atoms of the pyridine group and thiazole group contribute to the complexation. NBO natural charges were computed and discussed in the light of coordination centers. Electronic spectra and magnetic susceptibility measurements as well as quantum chemical calculations reveal square planar geometry for Cu(II) and Ni(II) complexes and tetrahedral geometry for Co(II) complex. The elemental analyses and mass spectral data have justified the M(2)LCl(2) composition of complexes. PMID:22608292

  10. Mineral aerosol particles collected in Dunhuang, China, and their comparison with chemically modified particles collected over Japan

    NASA Astrophysics Data System (ADS)

    Trochkine, D.; Iwasaka, Y.; Matsuki, A.; Yamada, M.; Kim, Y.-S.; Nagatani, T.; Zhang, D.; Shi, G.-Y.; Shen, Z.

    2003-12-01

    Continental China has been recognized as one of the most important sources of atmospheric mineral dust particles (called Kosa in Japan, which literally means yellow sand). Many investigators have pointed out the importance of study of the long-range transport of mineral dust particles and their modifications in this process even during the nondust storm periods. Because of these modifications, particles can change their radiative properties and their ability to be a condensation nucleus. Therefore it is important to examine the composition of individual mineral particles in their source region and compare these particles with those after long-range transport. A number of investigations have been carried out on the subject; however, the amount of data is still insufficient. Samples of aerosol particles were collected in Dunhuang, China, in different seasons in 2001 and 2002 during the ACE-Asia campaign. The collected particles were examined using a scanning electron microscope equipped with an energy dispersive X-ray analyzer. The particles in all the samples were mainly mineral particles. Similar types of mineral particles were found in the free troposphere over Japan. A number of differences were found between the particles collected in China and those collected over Japan, and these differences can be explained by chemical modifications that occurred in the particles during their transport from China to Japan. Approximately 40-45% of mineral particles mixed internally with sulphate during their transport in the troposphere. Also, the particles collected over Japan were found to be different from those obtained in ground-based measurements in Nagasaki, Nagoya, and Fukuoka, Japan (reported by other research groups). The portion of mineral particles that mixed internally with sea salt and sulphates was considerably smaller than for the samples obtained in Japan near the ground. It is important to take this fact into account while investigating the impact of mineral particles on the biogeochemical cycle and climate.

  11. Students' Chemical Information Project, October 1967 - September 1968. Final Report: Part II.

    ERIC Educational Resources Information Center

    Callaghan, A.; And Others

    Part II of the Students' Chemical Information Project (SCIP), designed to spread the use of computer-based information services among research scientists and technologists, contains details of the project operations, statistics, results of questionnaires and research reports from liaison scientists (See LI 002 562 for Part I). Chapter I: Operation

  12. Insights into collective cell behaviour from populations of coupled chemical oscillators.

    PubMed

    Taylor, Annette F; Tinsley, Mark R; Showalter, Kenneth

    2015-08-21

    Biological systems such as yeast show coordinated activity driven by chemical communication between cells. Here, we show how experiments with coupled chemical oscillators can provide insights into collective behaviour in cellular systems. Two methods of coupling the oscillators are described: exchange of chemical species with the surrounding solution and computer-controlled illumination of a light-sensitive catalyst. The collective behaviour observed includes synchronisation, dynamical quorum sensing (a density dependent transition to population-wide oscillations), and chimera states, where oscillators spontaneously split into coherent and incoherent groups. At the core of the different types of behaviour lies an intracellular autocatalytic signal and an intercellular communication mechanism that influences the autocatalytic growth. PMID:26195263

  13. Chemical and immunological characterization of lipopolysaccharides from phase I and phase II Coxiella burnetii.

    PubMed Central

    Amano, K; Williams, J C

    1984-01-01

    Lipopolysaccharides (LPSs) isolated from phase I and phase II Coxiella burnetii (LPS I and LPS II, respectively) were analyzed for chemical compositions, molecular heterogeneity by sodium dodecyl sulfate-polyacrylamide gel electrophoresis, and immunological properties. The yields of crude phenol-water extracts from phase I cells were roughly three to six times higher than those from phase II cells. Purification of LPSs by ultracentrifugation gave similar yields for both LPS I and LPS II. Purified LPS I and LPS II contained roughly 0.8 and 0.6% protein, respectively. The fatty acid constituents of the LPSs were different in composition and content, with branched-chain fatty acids representing about 15% of the total. beta-Hydroxymyristic acid was not detected in either LPS I or LPS II. A thiobarbituric acid-periodate-positive compound was evident in the LPSs; however, this component was not identified as 3-deoxy-D-mannooctulosonic acid by gas and paper chromatographies. LPS II contained D-mannose, D-glucose, D-glyceromannoheptose, glucosamine, ethanolamine, 3-deoxy-D-mannooctulosonic acid-like material, phosphate, and fatty acids. LPS I contained the unique disaccharide galactosaminuronyl glucosamine and nine unidentified components in addition to the components of LPS II. The hydrophobic, putative lipid A fraction of LPS I and LPS II contained the above constituents, but the hydrophilic fraction was devoid of ethanolamine. The LPS I disaccharide galactosaminuronyl glucosamine was found in both fractions of the acetic acid hydrolysates. Analysis of LPSs by sodium dodecyl sulfate-polyacrylamide gel electrophoresis followed by silver staining indicated that LPS II was composed of only one band, whereas LPS I consisted of six or more bands with irregular spacing. Ouchterlony immunodiffusion tests demonstrated that LPS I reacted with phase I but not with phase II whole-cell hyperimmune antibody, and LPS II reacted neither with phase I nor phase II hyperimmune antibody. From these results, it was concluded that the chemical structures of LPSs from C. burnetii were different from those of the LPSs of gram-negative bacteria; however, the LPS structural variation in C. burnetii may be similar to the smooth-to-rough mutational variation of saccharide chain length in gram-negative bacteria. Images PMID:6438066

  14. Biotechnology for producing fuels and chemicals from biomass. Volume II. Fermentation chemicals from biomass

    SciTech Connect

    Villet, R.

    1981-02-01

    The technological and economic feasibility of producing some selected chemicals by fermentation is discussed: acetone, butanol, acetic acid, citric acid, 2,3-butanediol, and propionic acid. The demand for acetone and butanol has grown considerably. They have not been produced fermentatively for three decades, but instead by the oxo and aldol processes. Improved cost of fermentative production will hinge on improving yields and using cellulosic feedstocks. The market for acetic acid is likely to grow 5% to 7%/yr. A potential process for production is the fermentation of hydrolyzed cellulosic material to ethanol followed by chemical conversion to acetic acid. For about 50 years fermentation has been the chief process for citric acid production. The feedstock cost is 15% to 20% of the overall cost of production. The anticipated 5%/yr growth in demand for citric acid could be enhanced by using it to displace phosphates in detergent manufacture. A number of useful chemicals can be derived from 2,3-butanediol, which has not been produced commercially on a large scale. R and D are needed to establish a viable commercial process. The commercial fermentative production of propionic acid has not yet been developed. Recovery and purification of the product require considerable improvement. Other chemicals such as lactic acid, isopropanol, maleic anhydride, fumarate, and glycerol merit evaluation for commercial fermentative production in the near future.

  15. A Chemical Confirmation of the Faint Boötes II Dwarf Spheroidal Galaxy

    NASA Astrophysics Data System (ADS)

    Koch, Andreas; Rich, R. Michael

    2014-10-01

    We present a chemical abundance study of the brightest confirmed member star of the ultra-faint dwarf galaxy Boötes II from Keck/HIRES high-resolution spectroscopy at moderate signal-to-noise ratios. At [Fe/H] = -2.93 ± 0.03(stat.) ± 0.17(sys.), this star chemically resembles metal-poor halo field stars and the signatures of other faint dwarf spheroidal galaxies at the same metallicities in that it shows enhanced [α/Fe] ratios, Solar Fe-peak element abundances, and low upper limits on the neutron-capture element Ba. Moreover, this star shows no chemical peculiarities in any of the eight elements we were able to measure. This implies that the chemical outliers found in other systems remain outliers pertaining to the unusual enrichment histories of the respective environments, while Boo II appears to have experienced an enrichment history typical of its very low mass. We also re-calibrated previous measurements of the galaxy's metallicity from the calcium triplet (CaT) and find a much lower value than reported before. The resulting broad metallicity spread, in excess of one dex, the very metal-poor mean, and the chemical abundance patterns of the present star imply that Boötes II is a low-mass, old, metal-poor dwarf galaxy and not an overdensity associated with the Sagittarius Stream as has been previously suggested based on its sky position and kinematics. The low, mean CaT metallicity of -2.7 dex falls right on the luminosity-metallicity relation delineated over four orders of magnitude from the more luminous to the faintest galaxies. Thus Boötes II's chemical enrichment appears representative of the galaxy's original mass, while tidal stripping and other mass loss mechanisms were probably not significant as for other low-mass satellites.

  16. A chemical confirmation of the faint Boötes II dwarf spheroidal galaxy

    SciTech Connect

    Koch, Andreas; Rich, R. Michael

    2014-10-10

    We present a chemical abundance study of the brightest confirmed member star of the ultra-faint dwarf galaxy Boötes II from Keck/HIRES high-resolution spectroscopy at moderate signal-to-noise ratios. At [Fe/H] = –2.93 ± 0.03(stat.) ± 0.17(sys.), this star chemically resembles metal-poor halo field stars and the signatures of other faint dwarf spheroidal galaxies at the same metallicities in that it shows enhanced [α/Fe] ratios, Solar Fe-peak element abundances, and low upper limits on the neutron-capture element Ba. Moreover, this star shows no chemical peculiarities in any of the eight elements we were able to measure. This implies that the chemical outliers found in other systems remain outliers pertaining to the unusual enrichment histories of the respective environments, while Boo II appears to have experienced an enrichment history typical of its very low mass. We also re-calibrated previous measurements of the galaxy's metallicity from the calcium triplet (CaT) and find a much lower value than reported before. The resulting broad metallicity spread, in excess of one dex, the very metal-poor mean, and the chemical abundance patterns of the present star imply that Boötes II is a low-mass, old, metal-poor dwarf galaxy and not an overdensity associated with the Sagittarius Stream as has been previously suggested based on its sky position and kinematics. The low, mean CaT metallicity of –2.7 dex falls right on the luminosity-metallicity relation delineated over four orders of magnitude from the more luminous to the faintest galaxies. Thus Boötes II's chemical enrichment appears representative of the galaxy's original mass, while tidal stripping and other mass loss mechanisms were probably not significant as for other low-mass satellites.

  17. Chemical characteristics of negative-tone chemically amplified resist for advanced mask making: II

    NASA Astrophysics Data System (ADS)

    Takeshi, Kazumasa; Tanabe, Masahito; Inokuchi, Daisuke; Fukushima, Yuichi; Okumoto, Yasuhiro; Okuda, Yoshimitsu

    2004-12-01

    We investigated the film property and the lithographic performance of five commercialized NCARs. This report focused on Cr effect and PCD stability which are critical issues on advanced mask making. Results confirmed to solve the Cr effect by controlled dissolution rate of resist film. Furthermore, PCD was occurred by PAG moving and unsuitable reaction in the resist film standing delay time. This report suggests the strategy that was design of chemical structure for the next generation NCARs.

  18. Meeting report: eGenomics: Cataloguing our Complete Genome Collection II.

    PubMed

    Field, Dawn; Morrison, Norman; Selengut, Jeremy; Sterk, Peter

    2006-01-01

    This article summarizes the proceedings of the "eGenomics: Cataloguing our Complete Genome Collection II" workshop held November 10-11, 2005, at the European Bioinformatics Institute. This exploratory workshop, organized by members of the Genomic Standards Consortium (GSC), brought together researchers from the genomic, functional OMICS, and computational biology communities to discuss standardization activities across a range of projects. The workshop proceedings and outcomes are set to help guide the development of the GSC's Minimal Information about a Genome Sequence (MIGS) specification. PMID:16901213

  19. Equilibrium and thermodynamic studies of Cd (II) biosorption by chemically modified orange peel.

    PubMed

    Kumar, Arbind; Kumar, Vipin

    2016-03-01

    Agricultural wastes have great potential of removing heavy metal ions from aqueous solution. Removal of Cd (II) from aqueous solutions onto chemically modified orange peel was studied at different pH, contact time, initial metal concentrations, adsorbent doses and temperature. Batch experiments were carried out under optimized conditions to evaluate the adsorption capacity of orange peel chemically modified with NaOH. The results showed that maximum adsorption capacity of modified orange peel, approximately 97.0%, was observed 3 mg 1⁻¹ of initial Cd(II) concentration pH 6 for 4 g 1⁻¹ adsorbent dosage, 200 min contact time and 298 K temperature. Adsorption efficiency of modified orange peel decreased with increase in temperature indicated exothermic nature of adsorption. A negative value of ΔG⁰(-8.59 kJ mol⁻¹) confirmed the feasibility of adsorption process and spontaneous nature of adsorption. A negative value of ΔH⁰ (-28.08 kJ mol⁻¹) indicated exothermic nature while a negative ΔS⁰ (-66.86 J K⁻¹ mol⁻¹) value suggested decrease in degree of freedom of the adsorbed species. The results showed that biosorption process of Cd(II) ions by chemically modified orange peel is feasible, spontaneous and exothermic under studied conditions. Chemically by modified orange peel investigated in the present study showed good potential for the removal of cadmium from aqueous solutions. PMID:27097438

  20. Analysis of the Noble Metals on Silicon Wafers by Chemical Collection and ICPMS

    NASA Astrophysics Data System (ADS)

    Fontaine, H.; Hureau, D.; Groz, M.; Despois, D.; Louis, C.

    2011-11-01

    The measurement of Ag, Pt and Au on wafer surfaces was addressed by a liquid phase chemical collection coupled to ICPMS analysis. Three chemistries were evaluated from intentionally contaminated wafers in the E12 to E15 at/cm2 concentration range. Different modes of voluntary wafer contamination allowed us to consider both the chemical form of the contaminant (i.e. ionic and metal forms) and its localization (i.e. on the surface and included in the oxide layer). Diluted HNO3 was used for Ag collection on the wafer surface allowing a collection efficiency (CE) higher than 90%. Regarding Pt and Au, diluted aqua regia and diluted HF/aqua regia were used. The first solution leads to a good collection of Au and Pt on the wafer surface (CE >90%) and is inefficient for contamination included in the oxide layer while the second one addresses the two cases with collection rates higher than 94%. Finally, detection limits of few E10 at/cm2 were determined showing the relevance of the technique implemented.

  1. EXPERIMENTAL EVALUATION OF CHEMICAL SEQUESTRATION OF CARBON DIOXIDE IN DEEP AQUIFER MEDIA - PHASE II

    SciTech Connect

    Neeraj Gupta; Bruce Sass; Jennifer Ickes

    2000-11-28

    In 1998 Battelle was selected by the U.S. Department of Energy's (DOE) National Energy Technology Laboratory (NETL) under a Novel Concepts project grant to continue Phase II research on the feasibility of carbon dioxide (CO{sub 2}) sequestration in deep saline formations. The focus of this investigation is to conduct detailed laboratory experiments to examine factors that may affect chemical sequestration of CO{sub 2} in deep saline formations. Reactions between sandstone and other geologic media from potential host reservoirs, brine solutions, and CO{sub 2} are being investigated under high-pressure conditions. Some experiments also include sulfur dioxide (SO{sub 2}) gases to evaluate the potential for co-injection of CO{sub 2} and SO{sub 2} related gases in the deep formations. In addition, an assessment of engineering and economic aspects is being conducted. This current Technical Progress Report describes the status of the project as of September 2000. The major activities undertaken during the quarter included several experiments conducted to investigate the effects of pressure, temperature, time, and brine composition on rock samples from potential host reservoirs. Samples (both powder and slab) were taken from the Mt. Simon Sandstone, a potential CO{sub 2} host formation in the Ohio, the Eau Claire Shale, and Rome Dolomite samples that form the caprock for Mt. Simon Sandstone. Also, a sample with high calcium plagioclase content from Frio Formation in Texas was used. In addition, mineral samples for relatively pure Anorthite and glauconite were experimented on with and without the presence of additional clay minerals such as kaolinite and montmorillonite. The experiments were run for one to two months at pressures similar to deep reservoirs and temperatures set at 50 C or 150 C. Several enhancements were made to the experimental equipment to allow for mixing of reactants and to improve sample collection methods. The resulting fluids (gases and liquids) as well as the rock samples were characterized to evaluate the geochemical changes over the experimental period. Preliminary results from the analysis are presented in the report. More detailed interpretation of the results will be presented in the technical report at the end of Phase II.

  2. Chemical modification of photosystem II core complex pigments with sodium borohydride.

    PubMed

    Vishnev, M I; Zabelin, A A; Shkuropatova, V A; Yanyushin, M F; Shuvalov, V A; Shkuropatov, A Ya

    2013-04-01

    The reaction of the irreversible chemical reduction of the 13(1)-keto C=O group of pheophytin a (Pheo a) with sodium borohydride in reaction centers (RCs) of functionally active spinach photosystem II (PS II) core complexes was studied. Stable, chromatographically purified PS II core complex preparations with altered chromophore composition are obtained in which ~25% of Pheo a molecules are modified to 13(1)-deoxo-13(1)-hydroxy-Pheo a. Some of the chlorophyll a molecules in the complexes were also irreversibly reduced with borohydride to 13(1)-deoxo-13(1)-hydroxy-chlorophyll a. Based on the results of comparative study of spectral, biochemical, and photochemical properties of NaBH4-treated and control preparations, it was concluded that: (i) the borohydride treatment did not result in significant dissociation of the PS II core complex protein ensemble; (ii) the modified complexes retained the ability to photoaccumulate the radical anion of the pheophytin electron acceptor in the presence of exogenous electron donor; (iii) only the photochemically inactive pheophytin PheoD2 is subjected to the borohydride treatment; (iv) the Qx optical transition of the PheoD2 molecule in the RC of PS II core complexes is located at 543 nm; (v) in the Qy spectral region, PheoD2 probably absorbs at ~680 nm. PMID:23590440

  3. Intracellular angiotensin II disrupts chemical communication and impairs metabolic cooperation between cardiac myocytes.

    PubMed

    De Mello, Walmor C

    2015-10-01

    The influence of intracellular angiotensin II (Ang II) on the process of chemical communication and metabolic cooperation between cardiac cells is discussed. Emphasis is given to the influence of pathological conditions like heart failure, myocardial ischemia or hyperglycemia on the activation of the intracrine renin angiotensin aldosterone system (RAAS) and its consequence for the metabolic cooperation between heart cells. Furthermore, the influence of high glucose on the process of chemical communication was described as well as its implication for the failing and diabetic heart. The major conclusion is that the activation of the intracrine renin angiotensin induced by heart failure, hyperglycemia, aldosterone or myocardial ischemia generates metabolic imbalance in the heart with serious consequences for the cardiac function. PMID:25882009

  4. Evolution of chemical diversity by coordinated gene swaps in type II polyketide gene clusters.

    PubMed

    Hillenmeyer, Maureen E; Vandova, Gergana A; Berlew, Erin E; Charkoudian, Louise K

    2015-11-10

    Natural product biosynthetic pathways generate molecules of enormous structural complexity and exquisitely tuned biological activities. Studies of natural products have led to the discovery of many pharmaceutical agents, particularly antibiotics. Attempts to harness the catalytic prowess of biosynthetic enzyme systems, for both compound discovery and engineering, have been limited by a poor understanding of the evolution of the underlying gene clusters. We developed an approach to study the evolution of biosynthetic genes on a cluster-wide scale, integrating pairwise gene coevolution information with large-scale phylogenetic analysis. We used this method to infer the evolution of type II polyketide gene clusters, tracing the path of evolution from the single ancestor to those gene clusters surviving today. We identified 10 key gene types in these clusters, most of which were swapped in from existing cellular processes and subsequently specialized. The ancestral type II polyketide gene cluster likely comprised a core set of five genes, a roster that expanded and contracted throughout evolution. A key C24 ancestor diversified into major classes of longer and shorter chain length systems, from which a C20 ancestor gave rise to the majority of characterized type II polyketide antibiotics. Our findings reveal that (i) type II polyketide structure is predictable from its gene roster, (ii) only certain gene combinations are compatible, and (iii) gene swaps were likely a key to evolution of chemical diversity. The lessons learned about how natural selection drives polyketide chemical innovation can be applied to the rational design and guided discovery of chemicals with desired structures and properties. PMID:26499248

  5. Evolution of chemical diversity by coordinated gene swaps in type II polyketide gene clusters

    PubMed Central

    Hillenmeyer, Maureen E.; Vandova, Gergana A.; Berlew, Erin E.; Charkoudian, Louise K.

    2015-01-01

    Natural product biosynthetic pathways generate molecules of enormous structural complexity and exquisitely tuned biological activities. Studies of natural products have led to the discovery of many pharmaceutical agents, particularly antibiotics. Attempts to harness the catalytic prowess of biosynthetic enzyme systems, for both compound discovery and engineering, have been limited by a poor understanding of the evolution of the underlying gene clusters. We developed an approach to study the evolution of biosynthetic genes on a cluster-wide scale, integrating pairwise gene coevolution information with large-scale phylogenetic analysis. We used this method to infer the evolution of type II polyketide gene clusters, tracing the path of evolution from the single ancestor to those gene clusters surviving today. We identified 10 key gene types in these clusters, most of which were swapped in from existing cellular processes and subsequently specialized. The ancestral type II polyketide gene cluster likely comprised a core set of five genes, a roster that expanded and contracted throughout evolution. A key C24 ancestor diversified into major classes of longer and shorter chain length systems, from which a C20 ancestor gave rise to the majority of characterized type II polyketide antibiotics. Our findings reveal that (i) type II polyketide structure is predictable from its gene roster, (ii) only certain gene combinations are compatible, and (iii) gene swaps were likely a key to evolution of chemical diversity. The lessons learned about how natural selection drives polyketide chemical innovation can be applied to the rational design and guided discovery of chemicals with desired structures and properties. PMID:26499248

  6. An intelligent data collection tool for chemical safety/risk assessment.

    PubMed

    Verdonck, Frederik A M; Van Sprang, Patrick A; Vanrolleghem, Peter A

    2008-02-01

    REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) is the new European chemical legislation which aims to assess risk or safety of tens of thousands of chemicals to improve the protection of human health and the environment. The chemical safety assessment process is of an iterative nature. First, an initial, worst-case assessment is conducted after which refinements are made until no risk has been estimated or the risk is adequately controlled. Wasting time and resources on additional testing and implementing risk management measures with low effect on risk conclusions should be avoided as much as possible. This paper demonstrates the usefulness of an intelligent data collection strategy based on a sensitivity (and uncertainty) analysis on the risk assessment model EUSES to identify and order the most important "within-EU-TGD-reducible" input parameters influencing the local and regional risk characterisation ratios. The ordering can be adjusted for the costs involved in additional testing (e.g. ecotoxicity, physico-chemical properties, emission estimates, etc.). The risk refinement tool therefore reduces the resources needed to obtain a realistic risk estimate (both less conservative and less uncertain) as efficient as possible. PMID:17959222

  7. Interview-based Qualitative Research in Emergency Care Part II: Data Collection, Analysis and Results Reporting.

    PubMed

    Ranney, Megan L; Meisel, Zachary F; Choo, Esther K; Garro, Aris C; Sasson, Comilla; Morrow Guthrie, Kate

    2015-09-01

    Qualitative methods are increasingly being used in emergency care research. Rigorous qualitative methods can play a critical role in advancing the emergency care research agenda by allowing investigators to generate hypotheses, gain an in-depth understanding of health problems or specific populations, create expert consensus, and develop new intervention and dissemination strategies. In Part I of this two-article series, we provided an introduction to general principles of applied qualitative health research and examples of its common use in emergency care research, describing study designs and data collection methods most relevant to our field (observation, individual interviews, and focus groups). Here in Part II of this series, we outline the specific steps necessary to conduct a valid and reliable qualitative research project, with a focus on interview-based studies. These elements include building the research team, preparing data collection guides, defining and obtaining an adequate sample, collecting and organizing qualitative data, and coding and analyzing the data. We also discuss potential ethical considerations unique to qualitative research as it relates to emergency care research. PMID:26284572

  8. Binding of Co(II) and Cu(II) cations to chemically modified wool fibres: an IR investigation

    NASA Astrophysics Data System (ADS)

    Taddei, Paola; Monti, Patrizia; Freddi, Giuliano; Arai, Takayuki; Tsukada, Masuhiro

    2003-05-01

    Wool fibres were modified by treatment with tannic acid (TA) solution or by acylation with ethylenediaminetetraacetic (EDTA) dianhydride. The unmodified and modified fibres were subsequently treated with Cu 2+ and Co 2+ solutions, at alkaline pH, and analysed by Attenuated Total Reflectance, ATR/IR spectroscopy to evaluate the changes induced in the structure of the fibre by metal binding. The spectral changes were correlated to metal adsorption results obtained by Inductive Coupled Plasma-Atomic Emission Spectrometry (ICP-AES). The IR results were discussed in relation to our previous findings on the metal binding mode of Bombyx mori and Tussah silk fibres; the changes observed in the spectra were explained by considering the different affinity of the fibres for the modifying reagent and the amount of the metal absorbed. More relevant spectral changes were observed upon Cu 2+ complexation rather than Co 2+ complexation, according to the metal absorption results. The most relevant changes were observed for the EDTA-modified wool sample treated with Cu 2+, according to the higher affinity of wool for EDTA. The IR spectra were quantitatively evaluated by the intensity ratio between the Amide I and Amide II bands (I AmideI/I AmideII) and its trend as a function of metal absorption was reported. The present investigation demonstrated that the interaction between fibre and metal and the subsequent fibre modification depend on the chemical nature of the fibre, the metal cation and the modifying reagent.

  9. CHAOS I. Direct Chemical Abundances for H II Regions in NGC 628

    NASA Astrophysics Data System (ADS)

    Berg, Danielle A.; Skillman, Evan D.; Croxall, Kevin V.; Pogge, Richard W.; Moustakas, John; Johnson-Groh, Mara

    2015-06-01

    The CHemical Abundances of Spirals (CHAOS) project leverages the combined power of the Large Binocular Telescope (LBT) with the broad spectral range and sensitivity of the Multi Object Double Spectrograph (MODS) to measure direct abundances (based on observations of the temperature-sensitive auroral lines) in large samples of H ii regions in spiral galaxies. We present LBT MODS observations of 62 H ii regions in the nearby spiral galaxy NGC 628, with an unprecedentedly large number of auroral lines measurements (18 [O iii] ?4363, 29 [N ii] ?5755, 40 [S iii]?6312, and 40 [O ii] ??7320, 7330 detections) in 45 H ii regions. Comparing derived temperatures from multiple auroral line measurements, we find: (1) a strong correlation between temperatures based on [S iii] ?6312 and [N ii] ?5755 and (2) large discrepancies for some temperatures based on [O ii] ??7320, 7330 and [O iii] ?4363. Both of these trends are consistent with other observations in the literature, yet, given the widespread use and acceptance of [O iii] ?4363 as a temperature determinant, the magnitude of the T[O iii] discrepancies still came as a surprise. Based on these results, we conduct a uniform abundance analysis prioritizing the temperatures derived from [S iii] ?6312 and [N ii] ?5755, and report the gas-phase abundance gradients for NGC 628. Relative abundances of S/O, Ne/O, and Ar/O are constant across the galaxy, consistent with no systematic change in the upper IMF over the sampled range in metallicity. These alpha-element ratios, along with N/O, all show small dispersions (? ? 0.1 dex) over 70% of the azimuthally averaged radius. We interpret these results as an indication that, at a given radius, the interstellar medium in NGC 628 is chemically well-mixed. Unlike the gradients in the nearly temperature-independent relative abundances, O/H abundances have a larger intrinsic dispersion of ?0.165 dex. We posit that this dispersion represents an upper limit to the true dispersion in O/H at a given radius and that some of that dispersion is due to systematic uncertainties arising from temperature measurements.

  10. Occurrence of classes I and II integrons in Enterobacteriaceae collected from Zagazig University Hospitals, Egypt

    PubMed Central

    Malek, Mai M.; Amer, Fatma A.; Allam, Ayman A.; El-Sokkary, Rehab H.; Gheith, Tarek; Arafa, Mohamed A.

    2015-01-01

    Integrons are genetic units characterized by the ability to capture and incorporate gene cassettes, thus can contribute to the emergence and transfer of antibiotic resistance. The objectives of this study were: (1) to investigate the presence and distribution of class I and class II integrons and the characteristics of the gene cassettes they carry in Enterobacteriaceae isolated from nosocomial infections at Zagzig University Hospital in Egypt, (2) to determine their impact on resistance, and (3) to identify risk factors for the existence of integrons. Relevant samples and full clinical history were collected from 118 inpatients. Samples were processed; isolated microbes were identified and tested for antibiotic susceptibilities. Integrons were detected by polymerase chain reaction (PCR) and were characterized into class I or II by restriction fragment length polymorphism (RFLP). Integron-positive isolates were subjected to another PCR to detect gene cassette, followed by gene cassette sequencing. Risk factors were analyzed by logistic regression analysis. Seventy-six Enterobacteriaceae isolates were recognized, 41 of them (53.9%) were integron-positive; 39 strains carried class I and 2 strains carried class II integrons. Integrons had gene cassettes encoding different combinations and types of resistance determinants. Interestingly, blaOXA129 gene was found and ereA gene was carried on class I integrons. The same determinants were carried within isolates of the same species as well as isolates of different species. The presence of integrons was significantly associated with multidrug resistance (MDR). No risk factors were associated for integron carriage. We conclude that integrons carrying gene cassettes encoding antibiotic resistance are significantly present among Enterobacteriaceae causing nosocomial infection in our hospital. Risk factors for acquisition remain to be identified. PMID:26157425

  11. An automated system for use in collecting volatile chemicals released from plants.

    PubMed

    Heath, R R; Manukian, A

    1994-03-01

    A system is described for the collection of volatiles produced by plants that minimizes stress on the plant in an environment that is free from chemical impurities. Air entering a volatile collection chamber containing a plant is purified using a nonwoven fabric media infused with charcoal. A multitasking, computer-automated system is described that can simultaneously collect volatilized chemicals from plants as well as monitor and record environmental conditions associated with those collections. Collection of up to 16 samples can be made in varying sampling order, flow rates, and user-specified time periods, without disturbing the sampling environment. During the same time period, this system is capable of simultaneously monitoring up to eight environmental parameters using any type of sensor with electrical signal outputs. A multiport base assembly was designed to fit around the base of the plant permitting air samples to be collected at the bottom of the chamber. The chamber can pass ambient light so the plant may follow its natural photocycles. The entire system can be configured for continuous laboratory duty or portable field use by utilizing components that run on DC voltages. For the purpose of testing the system's performance, we determined the periodicity of the release of volatiles from red and yellow flowering four o'clock plants,Mirabilis jalaba (Nyctaginaceae). The major chemical released from four o'clocks was identified as ocimene. The onset of release occurred between 1400 and 1600 hr and increased with time with maximum amount of ocimene released during 1800-2000 hr, followed by a decrease in emission. No ocimene was detected after 2400 hr. Determination of the amount of ocimene released per flower was calculated for the 1800- to 2000-hr time period. Based on the number of open flowers during the 1800- to 2000-hr period, yellow four o'clock's released 80.9 (±7.3 SD) ng/hr/flower, while the red flowers released 51.9 (±7.0 SD) ng/hr/flower. PMID:24242114

  12. Chemical weathering on Mars. Collection of papers. LPI-MSATT Workshop on Chemical Weathering on Mars, Cocoa Beach, FL (USA), 10 - 12 Sep 1992.

    NASA Astrophysics Data System (ADS)

    Burns, R. G.; Banin, A.

    1993-10-01

    The Workshop on Chemical Weathering on Mars consisted of thirty papers, extended abstracts of which were published in the LPI Technical Report, No. 92-04. The collection of seven papers in this issue report new data and interpretations about the chemical evolution of the Martian surface.

  13. DOE SBIR Phase II Final Report: Distributed Relevance Ranking in Heterogeneous Document Collections

    SciTech Connect

    Abe Lederman

    2007-01-08

    This report contains the comprehensive summary of the work performed on the SBIR Phase II project (“Distributed Relevance Ranking in Heterogeneous Document Collections”) at Deep Web Technologies (http://www.deepwebtech.com). We have successfully completed all of the tasks defined in our SBIR Proposal work plan (See Table 1 - Phase II Tasks Status). The project was completed on schedule and we have successfully deployed an initial production release of the software architecture at DOE-OSTI for the Science.gov Alliance's search portal (http://www.science.gov). We have implemented a set of grid services that supports the extraction, filtering, aggregation, and presentation of search results from numerous heterogeneous document collections. Illustration 3 depicts the services required to perform QuickRank™ filtering of content as defined in our architecture documentation. Functionality that has been implemented is indicated by the services highlighted in green. We have successfully tested our implementation in a multi-node grid deployment both within the Deep Web Technologies offices, and in a heterogeneous geographically distributed grid environment. We have performed a series of load tests in which we successfully simulated 100 concurrent users submitting search requests to the system. This testing was performed on deployments of one, two, and three node grids with services distributed in a number of different configurations. The preliminary results from these tests indicate that our architecture will scale well across multi-node grid deployments, but more work will be needed, beyond the scope of this project, to perform testing and experimentation to determine scalability and resiliency requirements. We are pleased to report that a production quality version (1.4) of the science.gov Alliance's search portal based on our grid architecture was released in June of 2006. This demonstration portal is currently available at http://science.gov/search30 . The portal allows the user to select from a number of collections grouped by category and enter a query expression (See Illustration 1 - Science.gov 3.0 Search Page). After the user clicks “search” a results page is displayed that provides a list of results from the selected collections ordered by relevance based on the query expression the user provided. Our grid based solution to deep web search and document ranking has already gained attention within DOE, other Government Agencies and a fortune 50 company. We are committed to the continued development of grid based solutions to large scale data access, filtering, and presentation problems within the domain of Information Retrieval and the more general categories of content management, data mining and data analysis.

  14. Angiotensin II increases fibronectin and collagen I through the ?-catenin-dependent signaling in mouse collecting duct cells.

    PubMed

    Cuevas, Catherina A; Gonzalez, Alexis A; Inestrosa, Nibaldo C; Vio, Carlos P; Prieto, Minolfa C

    2015-02-15

    The contribution of angiotensin II (ANG II) to renal and tubular fibrosis has been widely reported. Recent studies have shown that collecting duct cells can undergo mesenchymal transition suggesting that collecting duct cells are involved in interstitial fibrosis. The Wnt/?-catenin signaling pathway plays an essential role in development, organogenesis, and tissue homeostasis; however, the dysregulation of this pathway has been linked to fibrosis. In this study, we investigated whether AT1 receptor activation induces the expression of fibronectin and collagen I via the ?-catenin pathway in mouse collecting duct cell line M-1. ANG II (10(-7) M) treatment in M-1 cells increased mRNA, protein levels of fibronectin and collagen I, the ?-catenin target genes (cyclin D1 and c-myc), and the myofibroblast phenotype. These effects were prevented by candesartan, an AT1 receptor blocker. Inhibition of the ?-catenin degradation with pyrvinium pamoate (pyr; 10(-9) M) prevented the ANG II-induced expression of fibronectin, collagen I, and ?-catenin target genes. ANG II treatment promoted the accumulation of ?-catenin protein in a time-dependent manner. Because phosphorylation of glycogen synthase kinase-3? (GSK-3?) inhibits ?-catenin degradation, we further evaluated the effects of ANG II and ANG II plus pyr on p-ser9-GSK-3? levels. ANG II-dependent upregulation of ?-catenin protein levels was correlated with GSK-3? phosphorylation. These effects were prevented by pyr. Our data indicate that in M-1 collecting duct cells, the ?-catenin pathway mediates the stimulation of fibronectin and collagen I in response to AT1 receptor activation. PMID:25411386

  15. Angiotensin II increases fibronectin and collagen I through the β-catenin-dependent signaling in mouse collecting duct cells

    PubMed Central

    Cuevas, Catherina A.; Gonzalez, Alexis A.; Inestrosa, Nibaldo C.; Vio, Carlos P.

    2014-01-01

    The contribution of angiotensin II (ANG II) to renal and tubular fibrosis has been widely reported. Recent studies have shown that collecting duct cells can undergo mesenchymal transition suggesting that collecting duct cells are involved in interstitial fibrosis. The Wnt/β-catenin signaling pathway plays an essential role in development, organogenesis, and tissue homeostasis; however, the dysregulation of this pathway has been linked to fibrosis. In this study, we investigated whether AT1 receptor activation induces the expression of fibronectin and collagen I via the β-catenin pathway in mouse collecting duct cell line M-1. ANG II (10−7 M) treatment in M-1 cells increased mRNA, protein levels of fibronectin and collagen I, the β-catenin target genes (cyclin D1 and c-myc), and the myofibroblast phenotype. These effects were prevented by candesartan, an AT1 receptor blocker. Inhibition of the β-catenin degradation with pyrvinium pamoate (pyr; 10−9 M) prevented the ANG II-induced expression of fibronectin, collagen I, and β-catenin target genes. ANG II treatment promoted the accumulation of β-catenin protein in a time-dependent manner. Because phosphorylation of glycogen synthase kinase-3β (GSK-3β) inhibits β-catenin degradation, we further evaluated the effects of ANG II and ANG II plus pyr on p-ser9-GSK-3β levels. ANG II-dependent upregulation of β-catenin protein levels was correlated with GSK-3β phosphorylation. These effects were prevented by pyr. Our data indicate that in M-1 collecting duct cells, the β-catenin pathway mediates the stimulation of fibronectin and collagen I in response to AT1 receptor activation. PMID:25411386

  16. The KIVA-II computer program for transient multidimensional chemically reactive flows with sprays

    SciTech Connect

    Amsden, A.A.; Butler, T.D.; O'Rourke, P.J.

    1987-01-01

    Since its public release in 1985, the KIVA computer program has been utilized for the time dependent analysis of chemically reacting flows with sprays in two and three space dimensions. This paper describes some of the improvements to the original version that have been made since that time. The new code called KIVA-II is planned for public release in early 1988. KIVA-II improves the earlier version in the accuracy and efficiency of the computational procedure, the accuracy of the physics submodels, and in versatility and ease of use. Numerical improvements include the use of the ICE solution procedure in place of the acoustic subcycling method and the implementation of a quasi-second-order-accurate convection scheme. Major extensions to the physical submodels include the inclusion of an optional k-epsilon turbulence model, and several additions to the spray model. We illustrate some of the new capabilities by means of example solutions. 25 refs., 7 figs.

  17. The KIVA-II computer program for transient multidimensional chemically reactive flows with sprays

    SciTech Connect

    Amsden, A.A.; Butler, T.D.; O'Rourke, P.J.

    1987-01-01

    Since its public release in 1985, the KIVA computer program has been used for the time dependent analysis of chemically reacting flows with sprays in two and three space dimensions. This paper describes some of the improvements to the original version that have been made since that time. The new code, called KIVA-II, is planned for public release in early 1988. KIVA-II improves the earlier version in the accuracy and efficiency of the computational procedure, the accuracy of the physics submodels, and in versatility and ease of use. Numerical improvements include the use of the ICE solution procedure in place of the acoustic subcycling method and the implementation of a quasi-second-order-accurate convection scheme. Major extensions to the physical submodels include the inclusion of an optical kappa-epsilon turbulence model, and several additions to the spray model. The authors illustrate some of the new capabilities by means of example solutions.

  18. Effects of chemical speciation in growth media on the toxicity of mercury(II).

    PubMed Central

    Farrell, R E; Germida, J J; Huang, P M

    1993-01-01

    The toxicity of metals, including mercury, is expressed differently in different media, and the addition of soluble organics to the growth medium can have a significant impact on bioassay results. Although the effect of medium composition on metal toxicity is generally attributed to its effect on metal speciation (i.e., the chemical form in which the metal occurs), the importance of individual metal-ligand species remains largely unclear. Here, we report the results of a study that investigated, both experimentally and from a modeling perspective, the effects of complex soluble organic supplements on the acute toxicity (i.e., 50% inhibitory concentration [IC50]) of mercury to a Pseudomonas fluorescens isolate in chemically well-defined synthetic growth media (M-IIX). The media consisted of a basal inorganic salts medium supplemented with glycerol (0.1%, vol/vol) and a variety of common protein hydrolysates (0.1%, vol/vol), i.e., Difco beef extract (X = B), Casamino Acids (X = C), peptone (X = P), soytone (X = S), tryptone (X = T), and yeast extract (X = Y). These were analyzed to obtain cation, anion, and amino acid profiles and the results were used to compute the aqueous speciation of Hg(II) in the media. Respirometric bioassays were performed and IC50s were calculated. Medium components varied significantly in their effects on the acute toxicity of Hg(II) to the P. fluorescens isolate. IC50s ranged from 1.48 to 14.54 micrograms of Hg ml-1, and the acute toxicity of Hg(II) in the different media decreased in the order M-IIC >> M-IIP > M-IIB >> M-IIT > M-IIS >>> M-IIY.(ABSTRACT TRUNCATED AT 250 WORDS) PMID:8517745

  19. Chemical pollutants in field-collected canvasback tissues, eggs, and food materials

    USGS Publications Warehouse

    White, D.H.; Dieter, M.P.; Stendell, R.C.

    1976-01-01

    In 1972 studies began on the levels of environmental pollutants in canvasback tissues, eggs, and food items. The purpose of the studies were to determine if the levels of toxic chemicals found in canvasbacks were of the magnitude to cause problems affecting reproduction and survival. Overall, levels of organochlorine pesticides and PCB's were low in canvasbacks and their eggs. Some individual birds, however, laid eggs with elevated residues of DDE (12.1 ppm) or PCB's (28.6 ppm). There was no significant difference between eggshell thicknesses of 1972-73 and pre-1946 collections. About 12% of the canvasbacks analyzed had elevated levels of blood lead with reduced ALAD enzyme activity. Adult canvasbacks collected from the Chesapeake Bay in 1975 had moderate to high levels of cadmium in their kidneys. Cadmium, in excessive amounts is very toxic and can curtail spermatogenesis in male birds. Although no single toxic chemical found in wild canvasbacks appears to be a major factor in population declines, the cumulative effects of sublethal levels of all the pollutants may render birds susceptible to disease, hunting pressure or predation.

  20. Synthesis, chemical characterization and biological evaluation of new platinum (II)-sulfonamide complexes.

    PubMed

    Craciunescu, D G; Scarcia, V; Furlani, A; Parrondo Iglesias, E; Ravalico, L; Doadrio, A

    1990-02-01

    Six new platinum (II)-sulfonamide complexes were examined for their in vitro cytostatic properties as well as in vivo antitumour effect against three experimental murine tumours. The possible antitrypanosomic in vivo activity against T. brucei, T. congolense and T. cruzi infections was also evaluated. The synthesis and chemical characterization of new complexes is reported. Only two sulfadiazine derivatives appeared to be effective mainly against Ehrlich ascites but in a smaller extent than cisplatin. A satisfactory correlation between antitumour and antitrypanosomic activity was found. PMID:2334458

  1. Analysis of chemical abundances in planetary nebulae with [WC] central stars. II. Chemical abundances and the abundance discrepancy factor

    NASA Astrophysics Data System (ADS)

    García-Rojas, Jorge; Peña, Miriam; Morisset, Christophe; Delgado-Inglada, Gloria; Mesa-Delgado, Adal; Ruiz, María Teresa

    2013-10-01

    Aims: We present the abundance analysis of 12 planetary nebulae ionized by [WC]-type stars and weak-emission-line stars (wels) obtained from high-resolution spectrophotometric data. Our main aims are to determine the chemical composition of the nebulae and to study the behaviour of the abundance discrepancy problem (ADF) in this type of planetary nebulae. Methods: The detection of a large number of optical recombination lines (ORLs) and collisionally excited lines (CELs) from different ions (O+, O++, C++, C+3 and Ne++) were presented previously. Most of the ORLs were reported for the first time in these PNe, which increased the sample of PNe with detected faint ORLs. Ionic abundances were determined from the available CELs and ORLs, using previously determined physical conditions. Based on these two sets of ionic abundances, we derived the total chemical abundances in the nebulae using suitable ionization correction factors (when available). Results: In spite of the [WC] nature of the central stars, moderate ADF(O++) in the range from 1.2 to 4 were found for all the objects. We found that when the quality of the spectra is high enough, the ORLs O++/H+ abundance ratios obtained from different multiplets excited mainly by recombination are very similar. Possible dependence of ADFs on some nebular characteristics such as surface brightness and nebular diameter were analysed, but we found no correlation. Abundances derived from CELs were corrected by determining the t2 temperature fluctuation parameter. O abundances for PNe, derived from ORLs, are in general higher than the solar abundance. We derived the C/O ratio from ORLs and N/O and α-element/O ratios from CELs and found that these PNe are, on average, richer in N and C than the average of the large PN samples. About half of our sample is C-rich (C/O > 1). The growth of α-elements is correlated with the O abundance. Comparing the N/O and C /O ratios with those derived from stellar evolution models, we estimate that about half of our PNe have progenitors with initial masses similar to or larger than 4 M⊙. No correlation was found between the stellar [WC] type and the nebular chemical abundances. A rough O abundance gradient computed for our limited PN sample, compared with the gradient obtained for H ii regions, shows that there is a large dispersion in estimates of the PNe O abundance for a given Galactocentric distance. The PN gradient is flatter than that for H ii regions and at the solar distance and farther out, the PNe have a higher O abundance than H ii regions, similarly to what is found in other spiral galaxies. This fact has no convincing explanation so far. Based on data obtained at Las Campanas Observatory, Carnegie Institution.

  2. Ototoxic occupational exposures for a stock car racing team: II. chemical surveys.

    PubMed

    Gwin, Kristin K; Wallingford, Kenneth M; Morata, Thais C; Van Campen, Luann E; Dallaire, Jacques; Alvarez, Frank J

    2005-08-01

    The National Institute for Occupational Safety and Health (NIOSH) conducted a series of surveys to evaluate occupational exposure to noise and potentially ototoxic chemical agents among members of a professional stock car racing team. Exposure assessments included site visits to the team's race shop and a worst-case scenario racetrack. During site visits to the race team's shop, area samples were collected to measure exposures to potentially ototoxic chemicals, including, organic compounds (typical of solvents), metals, and carbon monoxide (CO). Exposures to these chemicals were all below their corresponding Occupational Safety and Health Administration (OSHA) permissible exposure limits (PELs), NIOSH recommended exposure limits (RELs), and American Conference of Governmental Industrial Hygienists (ACGIH) threshold limit values (TLVs). During site visits to the racetrack, area and personal samples were collected for organic compounds, lead, and CO in and around the "pit" area where the cars undergo race preparation and service during the race. Exposures to organic compounds and lead were either nondetectable or too low to quantify. Twenty-five percent of the CO time-weighted average concentrations exceeded the OSHA PEL, NIOSH REL, and ACGIH TLV after being adjusted for a 10-hour workday. Peak CO measurements exceeded the NIOSH recommended ceiling limit of 200 ppm. Based on these data, exposures to potentially ototoxic chemicals are probably not high enough to produce an adverse effect greater than that produced by the high sound pressure levels alone. However, carbon monoxide levels occasionally exceeded all evaluation criteria at the racetrack. PMID:16009649

  3. Chemical management in fungicide sensitivity of Mycosphaerella fijiensis collected from banana fields in México.

    PubMed

    Aguilar-Barragan, Alejandra; García-Torres, Ana Elisa; Odriozola-Casas, Olga; Macedo-Raygoza, Gloria; Ogura, Tetsuya; Manzo-Sánchez, Gilberto; James, Andrew C; Islas-Flores, Ignacio; Beltrán-García, Miguel J

    2014-01-01

    The chemical management of the black leaf streak disease in banana caused by Mycosphaerella fijiensis (Morelet) requires numerous applications of fungicides per year. However this has led to fungicide resistance in the field. The present study evaluated the activities of six fungicides against the mycelial growth by determination of EC50 values of strains collected from fields with different fungicide management programs: Rustic management (RM) without applications and Intensive management (IM) more than 25 fungicide application/year. Results showed a decreased sensitivity to all fungicides in isolates collected from IM. Means of EC50 values in mg L(-1) for RM and IM were: 13.25 ± 18.24 and 51.58 ± 46.14 for azoxystrobin, 81.40 ± 56.50 and 1.8575 ± 2.11 for carbendazim, 1.225 ± 0.945 and 10.01 ± 8.55 for propiconazole, 220 ± 67.66 vs. 368 ± 62.76 for vinclozolin, 9.862 ± 3.24 and 54.5 ± 21.08 for fludioxonil, 49.2125 ± 34.11 and 112.25 ± 51.20 for mancozeb. A molecular analysis for β-tubulin revealed a mutation at codon 198 in these strains having an EC50 greater than 10 mg L(-1) for carbendazim. Our data indicate a consistency between fungicide resistance and intensive chemical management in banana fields, however indicative values for resistance were also found in strains collected from rustic fields, suggesting that proximity among fields may be causing a fungus interchange, where rustic fields are breeding grounds for development of resistant strains. Urgent actions are required in order to avoid fungicide resistance in Mexican populations of M. fijiensis due to fungicide management practices. PMID:24948956

  4. Chemical management in fungicide sensivity of Mycosphaerella fijiensis collected from banana fields in México

    PubMed Central

    Aguilar-Barragan, Alejandra; García-Torres, Ana Elisa; Odriozola-Casas, Olga; Macedo-Raygoza, Gloria; Ogura, Tetsuya; Manzo-Sánchez, Gilberto; James, Andrew C.; Islas-Flores, Ignacio; Beltrán-García, Miguel J.

    2014-01-01

    The chemical management of the black leaf streak disease in banana caused by Mycosphaerella fijiensis (Morelet) requires numerous applications of fungicides per year. However this has led to fungicide resistance in the field. The present study evaluated the activities of six fungicides against the mycelial growth by determination of EC50 values of strains collected from fields with different fungicide management programs: Rustic management (RM) without applications and Intensive management (IM) more than 25 fungicide application/year. Results showed a decreased sensitivity to all fungicides in isolates collected from IM. Means of EC50 values in mg L−1 for RM and IM were: 13.25 ± 18.24 and 51.58 ± 46.14 for azoxystrobin, 81.40 ± 56.50 and 1.8575 ± 2.11 for carbendazim, 1.225 ± 0.945 and 10.01 ± 8.55 for propiconazole, 220 ± 67.66 vs. 368 ± 62.76 for vinclozolin, 9.862 ± 3.24 and 54.5 ± 21.08 for fludioxonil, 49.2125 ± 34.11 and 112.25 ± 51.20 for mancozeb. A molecular analysis for β-tubulin revealed a mutation at codon 198 in these strains having an EC50 greater than 10 mg L−1 for carbendazim. Our data indicate a consistency between fungicide resistance and intensive chemical management in banana fields, however indicative values for resistance were also found in strains collected from rustic fields, suggesting that proximity among fields may be causing a fungus interchange, where rustic fields are breeding grounds for development of resistant strains. Urgent actions are required in order to avoid fungicide resistance in Mexican populations of M. fijiensis due to fungicide management practices. PMID:24948956

  5. Relationships between chemical structure and rat repellency: II. compounds screened between 1950 and 1960

    USGS Publications Warehouse

    Bowles, Walter A.; Adomaitis, V.A.; DeWitt, J.B.; Pratt, J.J., Jr.

    1974-01-01

    Over 4,600 compounds, chiefly organic types, were evaluated using both a food acceptance test (Part A) and a barrier penetration bioassay (Part B), to correlate relationships between chemical structure and rodent repellency. These chemicals are indexed and classified according to the functional groups present and to the degree of substitution within their molecular structures. The results of reduction in food consumption for each compound appraised are calculated and their K values listed in Table 1. The repellent activities of the functional groups represented, alone or in combinations, are expressed in Table II by a Functional Group Repellency Index.. A ranking of these indices suggests that acyclic and heteroyclic compounds containing tri- or pentavalent nitrogen would be a parent compound of choice for synthesizing novel repellents. Other molecular arrangements, spatial configurations and combinations of functional groups are compared. There were 123 active, interesting or promising compounds included in the 699 having K values of 85 or greater, which were selected for the barrier appraisal study. These chemicals were formulated in selective solvents at several concentrations and applied to burlap. Small food bags were fashioned using the fabric impregnated with the candidate formulation, and exposed to rodent attack following storage periods of varying intervals. The results of these tests are listed in Table III. Again, those compounds containing nitrogen in the functional groupings indicated a high order of effectiveness. Several commercial patents covering rodent repellents were issued using the data from the food acceptance and barrier studies. Organizations and cooperators which supplied samples for the program are listed in Appendix I. The Wiswesser cipher for compounds in Table I is used in Appendix II to facilitate location of chemicals by sample code number as they appear under the index headings, and for computer storage and analysis.

  6. Relationships between chemical structure and rat repellency. II. Compounds screened between 1950 and 1960

    USGS Publications Warehouse

    Bowles, W.A.; Adomaitis, V.A.; DeWitt, J.B.; Pratt, J.J., Jr.

    1974-01-01

    Over 4,600 compounds, chiefly organic types, were evaluated using both a food acceptance test (Part A) and a barrier penetration bioassay (Part B), to correlate relationships between chemical structure and rodent repellency.These chemicals are indexed and classified according to the functional groups present and to the degree of substitution within their molecular structures. The results of reduction in foot consumption for each compound appraised are calculated and their K values listed in Table I.The repellent activities of the functional groups represented, alone or in combinations, are expressed in Table II by a Functional Group Repellency Index. A ranking of these indices suggests that acyclic and heteroyclic compounds containing tri- or pentavalent nitrogen would be a parent compound of choice for synthesizing novel repellents. Other molecular arrangements, spatial configurations and combinations of functional groups are compared.There were 123 active, interesting or promising compounds included in the 699 having K values of 85 or greater, which were selected for the barrier appraisal study. These chemicals were formulated in selective solvents at several concentrations and applied to burlap. Small foot bags were fashioned using the fabric impregnated with the candidate formulation, and exposed to rodent attack following storage periods of varying intervals. The results of these tests are listed in Table III. Again, those compounds containing nitrogen in the functional groupings indicated a high order of effectiveness. Several commercial patents covering rodent repellents were issued using the data from the food acceptance and barrier studies.Organizations and cooperators which supplied samples for the program are listed in Appendix I. The Wiswesser cipher for compounds in Table I is used in Appendix II to facilitate location of chemicals by sample code number as they appear under the index headings, and for computer storage and analysis.

  7. Conditional knockout of collecting duct bradykinin B2 receptors exacerbates angiotensin II-induced hypertension during high salt intake.

    PubMed

    Kopkan, Libor; Huskov, Zuzana; Jchov, rka; ?ervenkov, Lenka; ?ervenka, Lud?k; Saifudeen, Zubaida; El-Dahr, Samir S

    2016-01-01

    We elucidated the role of collecting duct kinin B2 receptor (B2R) in the development of salt-sensitivity and angiotensin II (ANG II)-induced hypertension. To this end, we used a Cre-Lox recombination strategy to generate mice lacking Bdkrb2 gene for B2R in the collecting duct (Hoxb7-Cre(tg/+):Bdkrb2(flox/flox)). In 3 groups of control (Bdkrb2(flox/flox)) and 3 groups of UB(Bdkrb2-/-) mice, systolic blood pressure (SBP) responses to high salt intake (4 or 8% NaCl; HS) were monitored by radiotelemetry in comparison with standard salt diet (0.4% NaCl) prior to and during subcutaneous ANG II infusion (1000?ng/min/kg) via osmotic minipumps. High salt intakes alone for 2 weeks did not alter SBP in either strain. ANG II significantly increased SBP equally in control (121??2 to 156??3?mmHg) and UB(Bdkrb2-/-) mice (120??2 to 153??2?mmHg). The development of ANG II-induced hypertension was exacerbated by 4%HS in both control (125??3 to 164??5?mmHg) and UB(Bdkrb2-/-) mice (124??2 to 162??3?mmHg) during 2 weeks. Interestingly, 8%HS caused a more profound and earlier ANG II-induced hypertension in UB(Bdkrb2-/-) (129??2 to 166??3?mmHg) as compared to control (128??2 to 158??2?mmHg) and it was accompanied by body weight loss and increased mortality. In conclusion, targeted inactivation of B2R in the renal collecting duct does not cause salt-sensitivity; however, collecting duct B2R attenuates the hypertensive actions of ANG II under conditions of very high salt intake. PMID:26151827

  8. Toxicity Screening of the ToxCast Phase II Chemical Library Using a Zebrafish Developmental Assay (SOT)

    EPA Science Inventory

    As part of the chemical screening and prioritization research program of the US EPA, the ToxCast Phase II chemicals were assessed using a vertebrate screen for developmental toxicity. Zebrafish embryos (Danio rerio) were exposed in 96-well plates from late-blastula stage (6hr pos...

  9. Neurocinematography in Pre-World War II Netherlands: The Magnus-Rademaker Collection.

    PubMed

    Koehler, Peter J; Lameris, Bregt; Hielscher, Eva

    2016-01-01

    Historical films made by neuroscientists have shown up in several countries during past years. Although originally supposed to have been lost, we recently found a collection of films produced between 1909 and 1940 by Rudolf Magnus (1873-1927), professor of pharmacology (Utrecht) and his student Gysbertus Rademaker (1887-1957), professor of physiology (1928, succeeding Willem Einthoven) and neurology (1945, both in Leiden). Both collections deal with the physiology of body posture by the equilibrium of reflex musculature contractions for which experimental studies were done with animals (labyrinthectomies, cerebellectomies, and brainstem sections) and observations on patients. The films demonstrate the results of these studies. Moreover, there are films with babies showing tonic neck reflexes and moving images capturing adults with cerebellar symptoms following cerebellectomies for tumors and several other conditions. Magnus' studies resulted in his well-known Körperstellung (1924, "Body Posture") and Rademaker's research in his Das Stehen (1931, "Standing"). The films probably had an educative and scientific purpose. Magnus demonstrated his films at congresses, including the Eighth International Congress of Physiologists (Vienna, 1910) and Rademaker screened his moving images at meetings of the Amsterdam Neurologists Society (at several occasions as reflected in the Winkler-Monakow correspondence and the Nederlands Tijdschrift voor Geneeskunde). Next to these purposes, the films were used to analyze movement and a series of images from the films were published in articles and books. The films are important historical sources that provide a portrait of the pre-World War II era in neuroscience, partly answering questions on how physicians dealt with patients and researchers with their laboratory animals. Moreover, the films confirm that cinematography was an important scientific tool in neuroscience research. PMID:26684426

  10. Chemical Tools To Decipher Regulation of Phosphatases by Proline Isomerization on Eukaryotic RNA Polymerase II.

    PubMed

    Mayfield, Joshua E; Fan, Shuang; Wei, Shuo; Zhang, Mengmeng; Li, Bing; Ellington, Andrew D; Etzkorn, Felicia A; Zhang, Yan Jessie

    2015-10-16

    Proline isomerization greatly impacts biological signaling but is subtle and difficult to detect in proteins. We characterize this poorly understood regulatory mechanism for RNA polymerase II carboxyl terminal domain (CTD) phosphorylation state using novel, direct, and quantitative chemical tools. We determine the proline isomeric preference of three CTD phosphatases: Ssu72 as cis-proline specific, Scp1 and Fcp1 as strongly trans-preferred. Due to this inherent characteristic, these phosphatases respond differently to enzymes that catalyze the isomerization of proline, like Ess1/Pin1. We demonstrate that this selective regulation of RNA polymerase II phosphorylation state exists within human cells, consistent with in vitro assays. These results support a model in which, instead of a global enhancement of downstream enzymatic activities, proline isomerases selectively boost the activity of a subset of CTD regulatory factors specific for cis-proline. This leads to diversified phosphorylation states of CTD in vitro and in cells. We provide the chemical tools to investigate proline isomerization and its ability to selectively enhance signaling in transcription and other biological contexts. PMID:26332362

  11. The chemical shifts of Xe in the cages of clathrate hydrate Structures I and II

    NASA Astrophysics Data System (ADS)

    Stueber, Dirk; Jameson, Cynthia J.

    2004-01-01

    We report, for the first time, a calculation of the isotropic NMR chemical shift of 129Xe in the cages of clathrate hydrates Structures I and II. We generate a shielding surface for Xe in the clathrate cages by quantum mechanical calculations. Subsequently this shielding surface is employed in canonical Monte Carlo simulations to find the average isotropic Xe shielding values in the various cages. For the two types of cages in clathrate hydrate Structure I, we find the intermolecular shielding values [σ(Xe@512 cage)-σ(Xe atom)]=-214.0 ppm, and [σ(Xe@51262 cage)-σ(Xe atom)]=-146.9 ppm, in reasonable agreement with the values -242 and -152 ppm, respectively, observed experimentally by Ripmeester and co-workers between 263 and 293 K. For the 512 and 51264 cages of Structure II we find [σ(Xe@512 cage)-σ(Xe atom)]=-206.7 ppm, and [σ(Xe@51264 cage)-σ(Xe atom)]=-104.7 ppm, also in reasonable agreement with the values -225 and -80 ppm, respectively, measured in a Xe-propane type II mixed clathrate hydrate at 77 and 220-240 K by Ripmeester et al.

  12. Chemical Analysis of Fractionated Halogens in Atmospheric Aerosols Collected in Okinawa, Japan

    NASA Astrophysics Data System (ADS)

    Tsuhako, A.; Miyagi, Y.; Somada, Y.; Azechi, S.; Handa, D.; Oshiro, Y.; Murayama, H.; Arakaki, T.

    2013-12-01

    Halogens (Cl, Br and I) play important roles in the atmosphere, e.g. ozone depletion by Br during spring in Polar Regions. Sources of halogens in atmospheric aerosols are mainly from ocean. But, for example, when we analyzed Br- with ion chromatography, its concentrations were almost always below the detection limit, which is also much lower than the estimated concentrations from sodium ion concentrations. We hypothesized that portions of halogens are escaped to the atmosphere, similar to chlorine loss, changed their chemical forms to such as BrO3- and IO3-, and/or even formed precipitates. There was few reported data so far about fractionated halogen concentrations in atmospheric aerosols. Thus, purpose of this study was to determine halogen concentrations in different fractions; free ion, water-soluble chemically transformed ions and precipitates using the authentic aerosols. Moreover, we analyzed seasonal variation for each fraction. Atmospheric aerosol samples were collected at Cape Hedo Atmosphere and Aerosol Monitoring Station (CHAAMS) of Okinawa, Japan during January 2010 and August 2013. A high volume air sampler was used for collecting total particulate matters on quartz filters on a weekly basis. Ultrapure water was used to extract water-soluble factions of halogens. The extracted solutions were filtered with the membrane filter and used for chemical analysis with ion chromatography and ICP-MS. Moreover, the total halogens in aerosols were obtained after digesting aerosols with tetramethylammonium hydroxide (TMAH) using the microwave and analysis with ICP-MS. For Cl, water-soluble Cl- accounted for about 70% of the estimates with Na content. No other forms of water-soluble Cl were found. About 30% of Cl was assumed volatilized to the gas-phase. For Br, water-soluble Br accounted for about 43% of the estimates with Na content, and within the 43%, about 10% of Br was not in the form of Br-. About 46% of Br was assumed volatilized to the gas-phase. For I, fractioned concentrations are still under investigation, and will be reported and discussed during the meeting. For seasonal variation, in general, concentrations of halogens were the lowest in summer and higher in fall and winter, reflecting air mass movement and wind speed around Okinawa, Japan.

  13. Chemical and biological effects of heavy distillate recycle in the SRC-II process

    SciTech Connect

    Wilson, B.W.; Pelroy, R.A.; Anderson, R.P.; Freel, J.

    1983-12-01

    Recent work from the Merriam Laboratory continuous coal liquefaction units shows that heavy distillate from the SRC-II process can be recycled to extinction, and hence a distillate product boiling entirely below 310/sup 0/C (590/sup 0/F) (or other selected boiling points) is feasible. In these runs distillate yield was not reduced; gas make was unaffected; and hydrogen consumption was increased only slightly, in keeping with the generally higher hydrogen content of lighter end products. Total distillate yield (C/sub 5/-590/sup 0/F) was 56 wt %, MAF coal in runs with subbituminous coal from the Amax Belle Ayr mine. Product endpoint is well below 371/sup 0/C (700/sup 0/F), the temperature above which coal distillates appear to become genotoxic; and the product was shown to be free of mutagenic activity in the Ames test. Chemical analyses showed both the < 270/sup 0/C (< 518/sup 0/F) and the < 310/sup 0/C (< 590/sup 0/F) distillates to be essentially devoid of several reference polycyclic compounds known to be carcinogenic in laboratory animals. Tests for tumorigenic or carcinogenic activity were not carried out on these materials. However, a comparison of chemical data from the Merriam heavy distillate samples with data on the other SRC-II distillates where carcinogenesis or tumorigenesis data is available leads to the expectation that < 371/sup 0/C (< 700/sup 0/F) materials from the Merriam Laboratory will have greatly reduced tumorigenic and carcinogenic activity in skin painting tests. Other studies suggest the product should be more readily upgraded than full-range (C/sub 5/-900/sup 0/F) distillate.

  14. Collection and Chemical Composition of Phloem Sap from Citrus sinensis L. Osbeck (Sweet Orange)

    PubMed Central

    Hijaz, Faraj; Killiny, Nabil

    2014-01-01

    Through utilizing the nutrient-rich phloem sap, sap feeding insects such as psyllids, leafhoppers, and aphids can transmit many phloem-restricted pathogens. On the other hand, multiplication of phloem-limited, uncultivated bacteria such as Candidatus Liberibacter asiaticus (CLas) inside the phloem of citrus indicates that the sap contains all the essential nutrients needed for the pathogen growth. The phloem sap composition of many plants has been studied; however, to our knowledge, there is no available data about citrus phloem sap. In this study, we identified and quantified the chemical components of phloem sap from pineapple sweet orange. Two approaches (EDTA enhanced exudation and centrifugation) were used to collect phloem sap. The collected sap was derivatized with methyl chloroformate (MCF), N-methyl-N- [tert-butyl dimethylsilyl]-trifluroacetamide (MTBSTFA), or trimethylsilyl (TMS) and analyzed with GC-MS revealing 20 amino acids and 8 sugars. Proline, the most abundant amino acid, composed more than 60% of the total amino acids. Tryptophan, tyrosine, leucine, isoleucine, and valine, which are considered essential for phloem sap-sucking insects, were also detected. Sucrose, glucose, fructose, and inositol were the most predominant sugars. In addition, seven organic acids including succinic, fumaric, malic, maleic, threonic, citric, and quinic were detected. All compounds detected in the EDTA-enhanced exudate were also detected in the pure phloem sap using centrifugation. The centrifugation technique allowed estimating the concentration of metabolites. This information expands our knowledge about the nutrition requirement for citrus phloem-limited bacterial pathogen and their vectors, and can help define suitable artificial media to culture them. PMID:25014027

  15. Non-peptide angiotensin II receptor antagonists: chemical feature based pharmacophore identification.

    PubMed

    Krovat, Eva M; Langer, Thierry

    2003-02-27

    Chemical feature based pharmacophore models were elaborated for angiotensin II receptor subtype 1 (AT(1)) antagonists using both a quantitative and a qualitative approach (Catalyst HypoGen and HipHop algorithms, respectively). The training sets for quantitative model generation consisted of 25 selective AT(1) antagonists exhibiting IC(50) values ranging from 1.3 nM to 150 microM. Additionally, a qualitative pharmacophore hypothesis was derived from multiconformational structure models of the two highly active AT(1) antagonists 4u (IC(50) = 0.2 nM) and 3k (IC(50) = 0.7 nM). In the case of the quantitative model, the best pharmacophore hypothesis consisted of a five-features model (Hypo1: seven points, one hydrophobic aromatic, one hydrophobic aliphatic, a hydrogen bond acceptor, a negative ionizable function, and an aromatic plane function). The best qualitative model consisted of seven features (Hypo2: 11 points, two aromatic rings, two hydrogen bond acceptors, a negative ionizable function, and two hydrophobic functions). The obtained pharmacophore models were validated on a wide set of test molecules. They were shown to be able to identify a range of highly potent AT(1) antagonists, among those a number of recently launched drugs and some candidates presently undergoing clinical tests and/or development phases. The results of our study provide confidence for the utility of the selected chemical feature based pharmacophore models to retrieve structurally diverse compounds with desired biological activity by virtual screening. PMID:12593652

  16. Copper(II) diamino acid complexes: quantum chemical computations regarding diastereomeric effects on the energy of complexation.

    PubMed

    Zuilhof, Han; Morokuma, Keiji

    2003-08-21

    [reaction: see text] Quantum chemical calculations were used to rationalize the observed enantiodifferentiation in the complexation of alpha-amino acids to chiral Cu(II) complexes. Apart from Cu(II)[bond]pi interactions and steric repulsions between the anchoring cholesteryl-Glu moiety and an aromatic amino acid R group, hydrogen bonding also plays a role. In fact, in the case of tryptophan, C[double bond]O...H[bond]N hydrogen bonding between the glutamate moiety and the tryptophan N[bond]H group compensates for the loss of intramolecular hydrogen-bonding and diminished Cu(II)[bond]pi interactions. PMID:12916986

  17. Dissociation of I II in chemical oxygen-iodine lasers: experiment, modeling, and pre-dissociation by electrical discharge

    NASA Astrophysics Data System (ADS)

    Katz, A.; Waichman, K.; Dahan, Z.; Rybalkin, V.; Barmashenko, B. D.; Rosenwaks, S.

    2007-06-01

    The dissociation of I II molecules at the optical axis of a supersonic chemical oxygen-iodine laser (COIL) was studied via detailed measurements and three dimensional computational fluid dynamics calculations. Comparing the measurements and the calculations enabled critical examination of previously proposed dissociation mechanisms and suggestion of a mechanism consistent with the experimental and theoretical results obtained in a supersonic COIL for the gain, temperature and I II dissociation fraction at the optical axis. The suggested mechanism combines the recent scheme of Azyazov and Heaven (AIAA J. 44, 1593 (2006)), where I II(A' 3Π 2u), I II(A 3Π 1u) and O II(a1Δ g, v) are significant dissociation intermediates, with the "standard" chain branching mechanism of Heidner et al. (J. Phys. Chem. 87, 2348 (1983)), involving I(2P 1/2) and I II(X1Σ + g, v). In addition, we examined a new method for enhancement of the gain and power in a COIL by applying DC corona/glow discharge in the transonic section of the secondary flow in the supersonic nozzle, dissociating I II prior to its mixing with O II(1Δ). The loss of O II(1Δ) consumed for dissociation was thus reduced and the consequent dissociation rate downstream of the discharge increased, resulting in up to 80% power enhancement. The implication of this method for COILs operating beyond the specific conditions reported here is assessed.

  18. THE CHEMICALLY CONTROLLED SYNTHESIS OF DUST IN TYPE II-P SUPERNOVAE

    SciTech Connect

    Sarangi, Arkaprabha; Cherchneff, Isabelle E-mail: isabelle.cherchneff@unibas.ch

    2013-10-20

    We study the formation of molecules and dust clusters in the ejecta of solar metallicity, Type II-P supernovae (SNe) using a chemical kinetic approach. We follow the evolution of molecules and small dust cluster masses from day 100 to day 1500 after explosion. We consider stellar progenitors with initial masses of 12, 15, 19, and 25 M{sub ☉} that explode as SNe with stratified ejecta. The molecular precursors to dust grains comprise molecular chains, rings and small clusters of silica, silicates, metal oxides, sulfides and carbides, pure metals, and carbon, where the nucleation of silicate clusters is described by a two-step process of metal and oxygen addition. We study the impact of the {sup 56}Ni mass on the type and amount of synthesized dust. We predict that large masses of molecules including CO, SiO, SiS, O{sub 2}, and SO form in the ejecta. We show that the discrepancy between the small dust masses detected at infrared wavelengths some 500 days post-explosion and the larger amounts of dust recently detected with Herschel in SN remnants can be explained by the non-equilibrium chemistry linked to the formation of molecules and dust clusters in the ejected material. Dust gradually builds up from small (∼10{sup –5} M{sub ☉}) to large masses (∼5 × 10{sup –2} M{sub ☉}) over a 5 yr period after explosion. Subsequent dust formation and/or growth is hampered by the shortage of chemical agents participating in the dust nucleation and the long timescale for accretion. The results highlight the dependence of the dust chemical composition and mass on the amount of {sup 56}Ni synthesized during the explosion. This dependence may partly explain the diversity of epochs at which dust forms in SNe. More generally, our results indicate that Type II-P SNe are efficient but moderate dust producers with an upper limit on the mass of synthesized dust ranging from ∼0.03 to 0.09 M{sub ☉}. Other dust sources must then operate at high redshift to explain the large quantities of dust present in young galaxies in the early universe.

  19. Chemical probes of the conformation of DNA modified by cis-diamminedichloroplatinum(II)

    SciTech Connect

    Marrot, L.; Leng, M. )

    1989-02-21

    The purpose of this work was to analyze at the nucleotide level the distortions induced by the binding of cis-diamminedichloroplatinum(II) (cis-DDP) to DNA by means of chemical probes. In order to test the chemical probes, experiments were first carried out on two platinated oligonucleotides. It has been verified by circular dichroism and gel electrophoresis that the binding of cis-DDP to an AG or to a GTG site within a double-stranded oligonucleotide distorts the double helix. The reactivity of the oligonucleotide platinated at the GTG site with chloroacetaldehyde, diethyl pyrocarbonate, and osmium tetraoxide, respectively, suggests a local denaturation of the double helix. The 5'G residue and the T residue within the adduct are no longer paired, while the 3'G residue is paired. The double helix is more distorted (but not denatured) at the 5' side of the adduct than at the 3' side. The reactivities of the chemical probes with six platinated DNA restriction fragments show that even at a relatively high level of platination only a few base pairs are unpaired but the double helix is largely distorted. No local denaturation has been detected at the GG sites separated from the nearest GG or AG sites by at least three base pairs. The AG sites separated from the nearest AG or GG sites by at least three base pairs do not denature the double helix locally when they are in the sequences puAG/pyTC. It is suggested that the distortion within these sequences is induced by adducts located further away along the DNA fragments, these sequences not being the major sites for the binding of cis-DDP.

  20. Preparation of polyethylene sacks for collection of precipitation samples for chemical analysis

    USGS Publications Warehouse

    Schroder, L.J.; Bricker, A.W.

    1985-01-01

    Polyethylene sacks are used to collect precipitation samples. Washing polyethylene with acetone, hexane, methanol, or nitric acid can change the adsorptive characteristics of the polyethylene. In this study, simulated precipitation at pH 4.5 was in contact with the polyethylene sacks for 21 days; subsamples were removed for chemical analysis at 7, 14, and 21 days after intitial contact. Sacks washed with acetone adsorbed iron and lithium; sacks washed with hexane adsorbed barium, iron , and lithium; sacks washed with methanol adsorbed calcium and iron; and sacks washed with 0.30 N nitric acid adsorbed iron. Leaching the plastic sacks with 0.15 N nitric acid did not result in 100-percent recovery of any of the adsorbed metals. Washing polyethylene sacks with dilute nitric acid caused the pH of the simulated precipitation to be decreased by 0.2 pH unit after 1 week of contact with the polyethylene. The specific conductance increased by 10 microsiemens per centimeter. Contamination of precipitation samples by lead was determined to be about 0.1 microgram per liter from contact with precleaned polyethylene sacks. No measurable contamination of precipitation samples by zinc occurred. (USGS)

  1. 76 FR 25723 - Proposed Information Collection for Growing America Through Entrepreneurship (GATE) II Evaluation...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-05-05

    ... Entrepreneurship (GATE) II Evaluation; Comment Request AGENCY: Employment and Training Administration, Labor... that investigated the impact of providing entrepreneurship training services to individuals interested..., K., & Kahvecioglu, D. ``Growing America Through Entrepreneurship: Findings from the Evaluation...

  2. BIOLOGICAL ASSESSMENT OF TOXICITY CAUSED BY CHEMICAL CONSTITUENTS ELUTED FROM SITE SOILS COLLECTED AT THE DRAKE CHEMICAL SUPERFUND SITE

    EPA Science Inventory

    The site was used to manufactured specialty intermediate chemicals for the producers of dyes, pharmaceuticals, cosmetics, herbicides, and pesticides. he herbicide Fenac (2,3,6-trichlorophenylacetic acid) is a major on- and off-site contaminant. ne hundred twenty -eight soils were...

  3. Physical, Chemical, and Mineralogical Properties of Comet 81P/Wild 2 Particles Collected by Stardust

    SciTech Connect

    Flynn, G.

    2008-01-01

    NASA's Stardust spacecraft collected dust from the coma of Comet 81P/Wild 2 by impact into aerogel capture cells or into Al-foils. The first direct, laboratory measurement of the physical, chemical, and mineralogical properties of cometary dust grains ranging from <10-15 to ?10-4 g were made on this dust. Deposition of material along the entry tracks in aerogel and the presence of compound craters in the Al-foils both indicate that many of the Wild 2 particles in the size range sampled by Stardust are weakly bound aggregates of a diverse range of minerals. Mineralogical characterization of fragments extracted from tracks indicates that most tracks were dominated by olivine, low-Ca pyroxene, or Fe-sulfides, although one track was dominated by refractory minerals similar to Ca-Al inclusions in primitive meteorites. Minor mineral phases, including Cu-Fe-sulfide, Fe-Zn-sulfide, carbonate and metal oxides, were found along some tracks. The high degree of variability of the element/Fe ratios for S, Ca, Ti, Cr, Mn, Ni, Cu, Zn, and Ga among the 23 tracks from aerogel capture cells analyzed during Stardust Preliminary Examination is consistent with the mineralogical variability. This indicates Wild 2 particles have widely varying compositions at the largest size analyzed (>10 ?m). Because Stardust collected particles from several jets, sampling material from different regions of the interior of Wild 2, these particles are expected to be representative of the non-volatile component of the comet over the size range sampled. Thus, the stream of particles associated with Comet Wild 2 contains individual grains of diverse elemental and mineralogical compositions, some rich in Fe and S, some in Mg, and others in Ca and Al. The mean refractory element abundance pattern in the Wild 2 particles that were examined is consistent with the CI meteorite pattern for Mg, Si, Cr, Fe, and Ni to 35%, and for Ca, Ti and Mn to 60%, but S/Si and Fe/Si both show a statistically significant depletion from the CI values and the moderately volatile elements Cu, Zn, Ga are enriched relative to CI. This elemental abundance pattern is similar to that in anhydrous, porous interplanetary dust particles (IDPs), suggesting that, if Wild 2 dust preserves the original composition of the Solar Nebula, the anhydrous, porous IDPs, not the CI meteorites, may best reflect the Solar Nebula abundances. This might be tested by elemental composition measurements on cometary meteors.

  4. COMPARISON OF MICROBIAL TRANSFORMATION RATE COEFFICIENTS OF XENOBIOTIC CHEMICALS BETWEEN FIELD-COLLECTED AND LABORATORY MICROCOSM MICROBIOTA

    EPA Science Inventory

    Two second-order transformation rate coefficients--kb, based on total plate counts, and kA, based on periphyton-colonized surface areas--were used to compare xenobiotic chemical transformation by laboratory-developed (microcosm) and by field-collected microbiota. Similarity of tr...

  5. Separation of Corn Fiber and Conversion to Fuels and Chemicals Phase II: Pilot-scale Operation

    SciTech Connect

    Abbas, Charles; Beery, Kyle; Orth, Rick; Zacher, Alan

    2007-09-28

    The purpose of the Department of Energy (DOE)-supported corn fiber conversion project, “Separation of Corn Fiber and Conversion to Fuels and Chemicals Phase II: Pilot-scale Operation” is to develop and demonstrate an integrated, economical process for the separation of corn fiber into its principal components to produce higher value-added fuel (ethanol and biodiesel), nutraceuticals (phytosterols), chemicals (polyols), and animal feed (corn fiber molasses). This project has successfully demonstrated the corn fiber conversion process on the pilot scale, and ensured that the process will integrate well into existing ADM corn wet-mills. This process involves hydrolyzing the corn fiber to solubilize 50% of the corn fiber as oligosaccharides and soluble protein. The solubilized fiber is removed and the remaining fiber residue is solvent extracted to remove the corn fiber oil, which contains valuable phytosterols. The extracted oil is refined to separate the phytosterols and the remaining oil is converted to biodiesel. The de-oiled fiber is enzymatically hydrolyzed and remixed with the soluble oligosaccharides in a fermentation vessel where it is fermented by a recombinant yeast, which is capable of fermenting the glucose and xylose to produce ethanol. The fermentation broth is distilled to remove the ethanol. The stillage is centrifuged to separate the yeast cell mass from the soluble components. The yeast cell mass is sold as a high-protein yeast cream and the remaining sugars in the stillage can be purified to produce a feedstock for catalytic conversion of the sugars to polyols (mainly ethylene glycol and propylene glycol) if desirable. The remaining materials from the purification step and any materials remaining after catalytic conversion are concentrated and sold as a corn fiber molasses. Additional high-value products are being investigated for the use of the corn fiber as a dietary fiber sources.

  6. Type II Cepheids in the Milky Way disc. Chemical composition of two new W Virginis stars: DD Vel and HQ Car

    NASA Astrophysics Data System (ADS)

    Lemasle, B.; Kovtyukh, V.; Bono, G.; François, P.; Saviane, I.; Yegorova, I.; Genovali, K.; Inno, L.; Galazutdinov, G.; da Silva, R.

    2015-07-01

    Context. A robust classification of Cepheids into their different sub-classes and, in particular, between classical and Type II Cepheids, is necessary to properly calibrate the period-luminosity relations and for populations studies in the Galactic disc. Type II Cepheids are, however, very diverse, and classifications based either on intrinsic (period, light curve) or external parameters (e.g., [Fe/H], | z |) do not provide a unique classification. Aims: We want to ascertain the classification of two Cepheids, HQ Car and DD Vel, that are sometimes classified as classical Cepheids and sometimes as Type II Cepheids. Methods: To achieve this goal, we examine both their chemical composition and the presence of specific features in their spectra. Results: We find emission features in the Hα and in the 5875.64 Å He I lines that are typical of W Vir stars. The [Na/Fe] (or [Na/Zn]) abundances are typical of thick-disc stars, while BL Her stars are Na-overabundant ([Na/Fe] > +0.5 dex). Finally, the two Cepheids show a possible (HQ Car) or probable (DD Vel) signature of mild dust-gas separation that is usually observed only in long-period type II Cepheids and RV Tau stars. Conclusions: These findings clearly indicate that HQ Car and DD Vel are both Type II Cepheids from the W Vir sub-class. Several studies have reported an increase in the Cepheids' abundance dispersion towards the outer (thin) disc. A detailed inspection of the Cepheid classification, in particular for those located in the outer disc, will indicate whether this feature is real or simply an artefact of the inclusion of type II Cepheids belonging to the thick disc in the current samples. Based on observations collected at the European Organisation for Astronomical Research in the Southern Hemisphere, Chile (prog. ID: 060.A-9120 and 082.D-0901).Appendices are available in electronic form at http://www.aanda.org

  7. Microbial production of isotopically light iron(II) in a modern chemically precipitated sediment and implications for isotopic variations in ancient rocks

    USGS Publications Warehouse

    Tangalos, G.E.; Beard, B.L.; Johnson, C.M.; Alpers, C.N.; Shelobolina, E.S.; Xu, H.; Konishi, H.; Roden, E.E.

    2012-01-01

    The inventories and Fe isotope composition of aqueous Fe(II) and solid-phase Fe compounds were quantified in neutral-pH, chemically precipitated sediments downstream of the Iron Mountain acid mine drainage site in northern California, USA. The sediments contain high concentrations of amorphous Fe(III) oxyhydroxides [Fe(III)am] that allow dissimilatory iron reduction (DIR) to predominate over Fe–S interactions in Fe redox transformation, as indicated by the very low abundance of Cr(II)-extractable reduced inorganic sulfur compared with dilute HCl-extractable Fe. δ56Fe values for bulk HCl- and HF-extractable Fe were ≈ 0. These near-zero bulk δ56Fe values, together with the very low abundance of dissolved Fe in the overlying water column, suggest that the pyrite Fe source had near-zero δ56Fe values, and that complete oxidation of Fe(II) took place prior to deposition of the Fe(III) oxide-rich sediment. Sediment core analyses and incubation experiments demonstrated the production of millimolar quantities of isotopically light (δ56Fe ≈ -1.5 to -0.5‰) aqueous Fe(II) coupled to partial reduction of Fe(III)am by DIR. Trends in the Fe isotope composition of solid-associated Fe(II) and residual Fe(III)am are consistent with experiments with synthetic Fe(III) oxides, and collectively suggest an equilibrium Fe isotope fractionation between aqueous Fe(II) and Fe(III)am of approximately -2‰. These Fe(III) oxide-rich sediments provide a model for early diagenetic processes that are likely to have taken place in Archean and Paleoproterozoic marine sediments that served as precursors for banded iron formations. Our results suggest pathways whereby DIR could have led to the formation of large quantities of low-δ56Fe minerals during BIF genesis.

  8. Operation and Maintenance of Wastewater Collection Systems. Volume II. Third Edition. A Field Study Training Program.

    ERIC Educational Resources Information Center

    California State Univ., Sacramento. Dept. of Civil Engineering.

    Proper installations, inspections, operations, maintenance and repairs of wastewater collection, conveyance and treatment facilities have a significant impact on the operation and maintenance costs, and the effectiveness of these facilities. This manual is the second volume of a two-part program designed to provide wastewater collection system…

  9. Data Collection and Description of HEA II-B Institutes - 1968-1969. Final Report.

    ERIC Educational Resources Information Center

    DeProspo, Ernest R.

    This study examines the first two years of the Higher Education Act (HEA) Title II-B Institute Program, 1968 and 1969. The primary objective is to describe the institutes and provide a data base for the program. The data base includes Division of Library Programs records, final evaluative reports, "plans of operation," and information on the…

  10. Possible Role of Metal(II) Octacyanomolybdate(IV) in Chemical Evolution: Interaction with Ribose Nucleotides

    NASA Astrophysics Data System (ADS)

    Kumar, Anand; Kamaluddin

    2013-02-01

    We have proposed that double metal cyanide compounds (DMCs) might have played vital roles as catalysts in chemical evolution and the origin of life. We have synthesized a series of metal octacyanomolybdates (MOCMos) and studied their interactions with ribose nucleotides. MOCMos have been shown to be effective adsorbents for 5'-ribonucleotides. The maximum adsorption level was found to be about 50 % at neutral pH under the conditions studied. The zinc(II) octacyanomolybdate(IV) showed larger adsorption compared to other MOCMos. The surface area seems to important parameter for the adsorption of nucleotides. The adsorption followed a Langmuir adsorption isotherms with an overall adsorption trends of the order of 5'-GMP > 5'-AMP > 5'-CMP > 5'-UMP. Purine nucleotides were adsorbed more strongly than pyrimidine nucleotides on all MOCMos possibly because of the additional binding afforded by the imidazole ring in purines. Infrared spectral studies of adsorption adducts indicate that adsorption takes place through interaction between adsorbate molecules and outer divalent ions of MOCMos.

  11. In silico approach to cisplatin toxicity. Quantum chemical studies on platinum(II)-cysteine systems.

    PubMed

    Chojnacki, Henryk; Kuduk-Jaworska, Janina; Jaroszewicz, Iwona; Jański, Jerzy J

    2009-06-01

    The behaviour of cisplatin in serum, and the drastic differences between the properties of this drug and its trans-isomer were the main motivations for this work. In a search for model "thiol-platin(II)" interactions, the first steps of the following reaction systems were evaluated: (1) cisplatin-thiomethanol; (2) transplatin-thiomethanol; (3) cisplatin-cysteine; and (4) transplatin-cysteine. In each case, calculations for the associative mode of reactions were performed. The electronic structure of these molecular systems was studied at the non-empirical all-electron level using density functional theory (DFT) within the Huzinaga and WTBS basis sets including polarisation Gaussian functions and full geometry optimisation. B3LYP or EPBO density functionals were applied throughout. The calculated molecular electrostatic potentials are presented graphically. Assuming that electrostatic effects are dominant, cisplatin should interact more strongly with the sulfur atom of CH3S- and deprotonated CYS-S- than transplatin. This fact has been documented in the supermolecule model of the relevant interaction energies in both gas phase as well as within the solvent polarisable continuum model. The opposite relationship was observed when we compared values of energy differences between products and substrates for both isomers. The data obtained here could be applied to search for correlation between the biological activity of platinum complexes and their properties as estimated by various physico-chemical and in silico methodologies. PMID:19221812

  12. Burnup calculations and chemical analysis of irradiated fuel samples studied in LWR-PROTEUS phase II

    SciTech Connect

    Grimm, P.; Guenther-Leopold, I.; Berger, H. D.

    2006-07-01

    The isotopic compositions of 5 UO{sub 2} samples irradiated in a Swiss PWR power plant, which were investigated in the LWR-PROTEUS Phase II programme, were calculated using the CASMO-4 and BOXER assembly codes. The burnups of the samples range from 50 to 90 MWd/kg. The results for a large number of actinide and fission product nuclides were compared to those of chemical analyses performed using a combination of chromatographic separation and mass spectrometry. A good agreement of calculated and measured concentrations is found for many of the nuclides investigated with both codes. The concentrations of the Pu isotopes are mostly predicted within {+-}10%, the two codes giving quite different results, except for {sup 242}Pu. Relatively significant deviations are found for some isotopes of Cs and Sm, and large discrepancies are observed for Eu and Gd. The overall quality of the predictions by the two codes is comparable, and the deviations from the experimental data do not generally increase with burnup. (authors)

  13. Chemical Characterization and Removal of Carbon-14 from Irradiated Graphite II - 13023

    SciTech Connect

    Dunzik-Gougar, Mary Lou; Cleaver, James; LaBrier, Daniel; McCrory, Shilo; Smith, Tara E.

    2013-07-01

    Approximately 250,000 tonnes of irradiated graphite waste exists worldwide and that quantity is expected to increase with decommissioning of Generation II reactors and deployment of Generation IV gas-cooled, graphite moderated reactors. This situation indicates the need for a graphite waste management strategy. Of greatest concern for long-term disposal of irradiated graphite is carbon-14 (C-14), with a half-life of 5730 years. Study of irradiated graphite from some nuclear reactors indicates C-14 is concentrated on the outer 5 mm of the graphite structure. The aim of the research presented last year and updated here is to identify the chemical form of C-14 in irradiated graphite and develop a practical method by which C-14 can be removed. A nuclear-grade graphite, NBG-18, and a high-surface-area graphite foam, POCOFoam{sup R}, were exposed to liquid nitrogen (to increase the quantity of C-14 precursor) and neutron-irradiated (10{sup 13} neutrons/cm{sup 2}/s). Finer grained NBG-25 was not exposed to liquid nitrogen prior to irradiation at a neutron flux on the order of 10{sup 14} /cm{sup 2}/s. Characterization of pre- and post-irradiation graphite was conducted to determine the chemical environment and quantity of C-14 and its precursors via the use of surface sensitive characterization techniques. Scanning Electron Microscopy (SEM) was used to evaluate the morphological features of graphite samples. The concentration, chemical composition, and bonding characteristics of C-14 and its precursors were determined through X-ray Photoelectron Spectroscopy (XPS), Time-of-Flight Secondary Ion Mass Spectrometry (SIMS), and Energy Dispersive X-ray Analysis Spectroscopy (EDX). Results of post-irradiation characterization of these materials indicate a variety of surface functional groups containing carbon, oxygen, nitrogen and hydrogen. During thermal treatment, irradiated graphite samples are heated in the presence of an inert carrier gas (with or without oxidant gas), which carries off gaseous products released during treatment. Graphite gasification occurs via interaction with adsorbed oxygen complexes. Experiments in argon were performed at 900 deg. C and 1400 deg. C to evaluate the selective removal of C-14. Thermal treatment also was performed with the addition of 3 and 5 volume % oxygen at temperatures 700 deg. C and 1400 deg. C. Thermal treatment experiments were evaluated for the effective selective removal of C-14. Lower temperatures and oxygen levels correlated to more efficient C-14 removal. (authors)

  14. Structural, spectroscopic and quantum chemical studies of acetyl hydrazone oxime and its palladium(II) and platinum(II) complexes

    NASA Astrophysics Data System (ADS)

    Kaya, Yunus; Icsel, Ceyda; Yilmaz, Veysel T.; Buyukgungor, Orhan

    2015-09-01

    Acetyl hydrazone oxime, [(1E,2E)-2-(hydroxyimino)-1-phenylethylidene]acetohydrazone (hipeahH2) and its palladium(II) and platinum(II) complexes, [M(hipeahH)2] (M = PdII and PtII), have been synthesized and characterized by elemental analysis, UV-vis IR, NMR and LC-MS techniques. X-ray diffraction analysis of [Pd(hipeahH)2] shows that the two hipeahH2 ligands are not equal; one of the ligands loses the hydrazone proton, while the other one loses the oxime proton, resulting in a different coordination behavior to form five- and six-membered chelate rings. The molecular geometries from X-ray experiments in the ground state were compared using the density functional theory (DFT) with the B3LYP method combined with the 6-311++G(d,p) basis set for the ligand and the LanL2DZ basis set for the complexes. Comprehensive theoretical and experimental structural studies on the molecule have been carried out by FT-IR, NMR and UV-vis spectrometry. In addition, the isomer studies of ligand and its complexes were made by DFT.

  15. Agricultural hydrology and water quality II: Introduction to the featured collection

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Agricultural hydrology and water quality is a multidisciplinary field devoted to understanding the interrelationship between modern agriculture and water resources. This paper summarizes a featured collection of 10 manuscripts emanating from the 2013 American Water Resources Association Specialty Co...

  16. Vesicle-based method and apparatus for collecting, manipulating, and chemically processing trace macromolecular species

    DOEpatents

    Davalos, Rafael V.; Ellis, Christopher R. B.

    2008-03-04

    Disclosed is an apparatus and method for inserting one or several chemical or biological species into phospholipid containers that are controlled within a microfluidic network, wherein individual containers are tracked and manipulated by electric fields and wherein the contained species may be chemically processed.

  17. Vesicle-based method for collecting, manipulating, and chemically processing trace macromolecular species

    DOEpatents

    Davalos, Rafael V.; Ellis, Christopher R. B.

    2010-08-17

    Disclosed is an apparatus and method for inserting one or several chemical or biological species into phospholipid containers that are controlled within a microfluidic network, wherein individual containers are tracked and manipulated by electric fields and wherein the contained species may be chemically processed.

  18. Odor and chemical emissions from dairy and swine facilities: Part 1 - project overview and collection methods

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Livestock facilities have received numerous criticisms due to their emissions of odorous air and chemicals. Hence, there is a significant need for odor emission factors and identification of principle odorous chemicals. Odor emission factors are used as inputs to odor setback models, while chemica...

  19. Chemical modification of silica gel with synthesized new Schiff base derivatives and sorption studies of cobalt (II) and nickel (II)

    NASA Astrophysics Data System (ADS)

    Kursunlu, Ahmed Nuri; Guler, Ersin; Dumrul, Hakan; Kocyigit, Ozcan; Gubbuk, Ilkay Hilal

    2009-08-01

    In this study, three Schiff base ligands and their complexes were synthesized and characterized by infrared spectroscopy (IR), thermogravimetric analyses (TGA), nuclear magnetic resonance (NMR), elemental analysis and magnetic susceptibility apparatuses. Silica gel was respectively modified with Schiff base derivatives, (E)-2-[(2-chloroethylimino)methyl]phenol, (E)-4-[(2-chloroethylimino)methyl]phenol and N, N'-[1,4-phenilendi(E)methylidene]bis(2-chloroethanamine), after silanization of silica gel by (3-aminopropyl)trimethoxysilane (APTS) by using a suitable method. Characterization of the surface modification was also performed with IR, TGA and elemental analysis. The immobilized surfaces were used for Co(II) and Ni(II) sorption from aqueous solutions and values of sorption were detected by atomic absorption spectrometer (AAS).

  20. Low-temperature chemically-driven atomic layer epitaxy for II-VI material growth

    NASA Astrophysics Data System (ADS)

    Luo, Yi

    2000-10-01

    In this thesis, I present the results of three surface science studies on (1) II-VI semiconductor surface preparation, (2) low-temperature chemically driven atomic layer epitaxy, and (3) investigations of surface chemistry for material deposition with chemical precursors. First, in Chapter 3, I present results of using combination of atomic hydrogen and oxygen plasma to removal surface contaminants such as O, C, S, Cl, etc. from CdTe and Cd1-xZnxTe surfaces at room temperature. XPS, AES, and LEED measurements showed that this method is very effective in removing common surface contaminants via low temperature surface reactions. The surface damage cause by the reactions is much lower than high temperature thermal annealing and ion sputtering. In addition, in situ photoluminescence results shows about three orders of magnitude increase of near band-gap feature intensity after the sample went through H cleaning and annealing to a proper temperature. Second, in Chapter 4, an in situ molecular-level study of material growth using a binary reaction sequence of hydride and metalorganic precursors is presented. The study used a model material system of CdS/ZnSe (100) and focused on the material chemistry of heteroepitaxy growth. In the growth process, dimethylcadmium and H2S precursors were sequentially dosed onto a c(2x2) ZnSe (100) substrate under high-vacuum conditions. At temperatures of ˜300K, saturated chernisorption of a Cd and a S monolayer occurred during each cycle of the binary reaction sequence. Characterization of the growth surface was accomplished in the growth chamber using AES, XPS and LEIS for probing surface chemical composition and LEED for determining surface order. These measurements showed layer-by-layer growth at a substrate temperature of ˜300 K, yielding an ordered stoichiometric US film. Strong variations in the composition of the grown surface layer were observed at different substrate temperatures; these variations were found to be related to the temperature dependence of the precursor reactions with the growth surfaces. Finally, in Chapter 5, I will discuss the detail surface chemical investigation using TPD and NEXAFS for atomic layer epitaxy of CdS on ZnSe(100) surface. Both TPD and NEXAFS results show that either a monolayer of surface methyl or hydrogen termination exists after the growth surface is dosed with DMCd or H2S. Both precursors adsorb on the surface dissociatively. The terminating groups (CH3 and H) are thermally stable on the surface in a certain temperature range, thus passivate the growth surfaces preventing further uptake of materials after monolayer-coverage is reached. However, surface CH3 or H is reactive to the alternative precursor, so the other constituent material can be deposited subsequently. This methyl or hydrogen passivation provides a satisfactory self-limiting material deposition mechanism to allow the growth proceed in a layer-by-layer manner. TPD and NEXAFS results obtained after different reaction steps are presented separately in details.

  1. Low Budget Biology II: A Collection of Low Cost Labs and Activities.

    ERIC Educational Resources Information Center

    Wartski, Bert; Wartski, Lynn Marie

    This document contains 13 low budget labs, demonstrations, and activities to be used in the biology classroom. Each activity has a teacher preparation section which states the purpose of each lab, some basic information, a list of materials and what they do, and how to prep the different solutions and chemicals. All labs are designed for a…

  2. [Historical review on chemical and medical studies of globefish toxin before World War II].

    PubMed

    Suehiro, M

    1994-01-01

    "Fugu," a species of globefish has eaten by Japanese people for a long time, so globefish poisoning in Japan has been prevalent. Figures are shown in the Annual Food Poisoning Report collected and issued by health service authorities of Japanese Government since 1879. These reports prompted Dr. Yoshizumi Tahara, National Institute of Hygienic Sciences to conduct a chemical investigation of the toxic substance of globefish in 1884. However, the analysis was very difficult and his report of investigation was delayed. Before publication of the report of Dr. Tahara, pharmacological and toxicological studies of globefish poisoning were reported by three research groups from the Facultly of Medicine, University of Tokyo in 1889. These reports concluded that globefish poison has curare-like activity and its distribution was limited to specific organs such as the ovaries and the liver. Dr. Tahara successfully isolated the poison from aqueaous extract of ovaries of globefish by precipitation with lead acetate in the presence of ammonia. He presented the results at the monthly meeting of the Pharmaceutical Society of Japan in July 1894. He continued the studies and established an improved method for extraction and purification suitable for large-scale production. Finally, he confirmed that globefish contains only one toxic substance and named it Tetrodotoxin (TTX) in 1909. He elucidated the chemical nature of TTX as follows: 1) TTX is an amorphous hygroscopic powder and its character is neither alkaloid nor protein. 2) The possibility of TTX being a protamine was excluded by chemical analysis. Before the discovery ot TTX, according to folklore, globefish was regarded as medicine for leprosy because flesh of globefish contaminated with a sublethal dose of toxic substance alleviated the neuralgia of patients affected with leprosy. The clinical effect of TTX prepared by Tahara's method to suppress severe neuralgia due to leprosy and to reduce muscle spasms due to tetanus were reported by dermatologists in 1911. TTX was also given to patients with rheumatoid arthritis due to its analgesic effect. Thus, injectable TTX was manufactured and distributed by Sankyo Co., Ltd. from 1913. In terms of purity, the TTX preparation manufactured by Tahara's method seemed to be much more crude than the crystalline TTX obtained by Professor Tsuda and Dr. Kawamura in 1952. According to their report, the LD50 of the preparation for clinical use manufactured by Tahara's method was 4-5 mg/kg mouse compared to 4-6 microg/kg mouse of crystalline TTX. PMID:11613509

  3. Law and psychiatry. Doing forensic work, II: fees, billing, and collections.

    PubMed

    Reid, William H

    2012-05-01

    Forensic practice fees, billing, and collection procedures are quite different from those in general psychiatry. Most forensic practices have far fewer "clients," and individual bills are usually larger. Collections are usually better (and less frequently discounted) in forensic practice, and resolving billing disputes is far more straightforward. Medicare, Medicaid, other insurance coverage, provider networks and agreements, procedure codes, and diagnosis-related groups (DRGs) are all largely irrelevant in forensic work (although sometimes important to direct clinical services in correctional psychiatry or forensic treatment clinics). An understanding of the practicalities and ethics of charging and billing for forensic services greatly simplifies practice management. PMID:22617086

  4. Chemical characterization of binding properties of opacity-associated protein II from Neisseria gonorrhoeae.

    PubMed Central

    Bessen, D; Gotschlich, E C

    1987-01-01

    Binding of an opacity-associated protein II (PIIop) from Neisseria gonorrhoeae to eucaryotic macromolecules was studied. HeLa cell extracts were subjected to sodium dodecyl sulfate-polyacrylamide gel electrophoresis and transferred to nitrocellulose, and purified PIIop bound to approximately 50 distinct molecular species. The binding of PIIop to HeLa cell components was stable in high salt and nonionic detergent and was not inhibited by a variety of monosaccharides and polyionic substances. PIIop binding behavior was compared with that of two model carbohydrate-binding proteins, wheat germ agglutinin (WGA) and concanavalin A (ConA). Model glycoproteins (ovomucoid, fetuin, mucin, ovalbumin) inhibited binding by PIIop, WGA, and ConA to various degrees. HeLa cell glycopeptides, generated by pronase digestion of chloroform-methanol-extracted cells, were tested for their ability to inhibit binding by PIIop to Western blots of HeLa cell macromolecules. HeLa cell extracts inhibited PIIop binding before pronase treatment, but inhibitory activity was lost as a result of pronase digestion. Direct binding to defined glycosylated and nonglycosylated proteins revealed that ConA and WGA bound only glycoproteins, whereas PIIop bound to proteins lacking carbohydrate as well. PIIop binding to human and bovine serum albumins was of high affinity and required partial unfolding of albumin; native albumin was not bound by PIIop; however, both the denatured, reduced form of albumin and the compact, nonreduced form of carboxymethylated albumin were bound strongly by PIIop. Albumin-PIIop interaction did not involve covalent bond formation through sulfhydryl groups. The predominant binding interactions of PIIop found in this study were with protein rather than carbohydrate, and the chemical nature of the interactions is more complex than involvement of purely ionic or hydrophobic forces. Images PMID:3098683

  5. Study of coupled-bunch collective effects in the PEP-II B-Factory

    SciTech Connect

    Byrd, J.

    1993-05-01

    We present an overview of the calculated longitudinal and transverse coupled-bunch (CB) growth using the measured RF cavity higher order mode impedance and estimated resistive wall (RW) impedance for the proposed PEP-II B-Factory, a dual-ring electron-positron collider. We also describe a visual method of representing the effective beam impedance and corresponding growth rates which is especially useful for understanding the dependence of growth rate on higher order mode frequency and Q, spread of HOM frequencies between cells, and for determining the requirements of the CB feedback systems.

  6. Cuebook II. State Education Collective Bargaining Laws. Report No. F80-5.

    ERIC Educational Resources Information Center

    Ross, Doris; Flakus-Mosqueda, Patricia

    State public employee collective bargaining laws affecting education are summarized in this booklet. State provisions and laws relative to coverage, exclusion, determination of bargaining units, union security, administrative roles, management rights, impasse procedures, grievance procedures, unfair practices, and deadline dates are compared.…

  7. User Centered System Design. Part II: Collected Papers from the UCSD HMI Project.

    ERIC Educational Resources Information Center

    California Univ., San Diego, La Jolla. Inst. for Cognitive Science.

    This report is a collection of 11 recent papers by the Human-Machine Interaction Group at the University of California, San Diego. The following papers are included: (1) "Stages and Levels in Human-Machine Interaction," Donald A. Norman; (2) "The Nature of Expertise in UNIX," Stephen W. Draper; (3) "Users in the Real World," David Owen; (4)…

  8. The promising chemical kinetics for the simulation of propane-air combustion with KIVA-II code

    NASA Technical Reports Server (NTRS)

    Ying, S. J.; Gorla, Rama S. R.; Kundu, Krishna P.

    1993-01-01

    The development of chemical kinetics for the simulation of propane-air combustion with the use of computer code KIVA-II since 1989 is summarized here. In order to let readers understand the general feature well, a brief description of the KIVA-II code, specially related with the chemical reactions is also given. Then the results of recent work with 20 reaction mechanism is presented. It is also compared with the 5 reaction mechanism. It may be expected that the numerical stability of the 20 reaction mechanism is better as compared to that of 5 reaction mechanism, but the CPU time of the CRAY computer is much longer. Details are presented in the paper.

  9. Chemical speciation and bioavailability of Cu(II). Study of the ionic copper(II) and bis(glycinate)-copper(II) accumulation by Lemna species

    SciTech Connect

    Benda, F.; Kouba, J. )

    1991-03-01

    In this paper, the authors examined the accumulation of copper(II) in, and its toxic effect on, duckweed, a plant which exhibits extremely high concentration factors. The effect of copper(II) was investigated by adding it to the minimal medium in two forms: CuSO{sub 4} and (Cu(Gly){sub 2}). The neutral (2:1) tetracoordinated bis(glycinate)-copper(II) complex is constituted by two five-membered rings bonded to the central copper atom with the cis configuration. This complex was chosen to model the function of a neutral species (eliminating the charge effect) involving a nontoxic ligand, for which - in contrast to the hydrated Cu{sup 2+} species - direct permeation through the cell wall is conceivable.

  10. Environmental Technology Verification Report: Grouts for Wastewater Collection Systems, Avanti International AV-118 Acrylic Chemical Grout

    EPA Science Inventory

    Municipalities are discovering rapid degradation of infrastructures in wastewater collection and treatment facilities due to the infiltration of water from the surrounding environments. Wastewater facilities are not only wet, but also experience hydrostatic pressure conditions un...

  11. West Hackberry Strategic Petroleum Reserve site brine-disposal monitoring, Year I report. Volume II. Physical and chemical oceanography. Final report

    SciTech Connect

    DeRouen, L.R.; Hann, R.W.; Casserly, D.M.; Giammona, C.; Lascara, V.J.

    1983-02-01

    This project centers around the Strategic Petroleum Site (SPR) known as the West Hackberry salt dome which is located in southwestern Louisiana, and which is designed to store 241 million barrels of crude oil. Oil storage caverns are formed by injecting water into salt deposits, and pumping out the resulting brine. Studies described in this report were designed as follow-on studies to three months of pre-discharge characterization work, and include data collected during the first year of brine leaching operations. The objectives were to: (1) characterize the environment in terms of physical, chemical and biological attributes; (2) determine if significant adverse changes in ecosystem productivity and stability of the biological community are occurring as a result of brine discharge; and (3) determine the magnitude of any change observed. Contents of Volume II include: introduction; physical oceanography; estuarine hydrology and hydrography; analysis of discharge plume; and water and sediment quality.

  12. A new technology for harnessing the dye polluted water and dye collection in a chemical factory.

    PubMed

    Pu, J P; Pu, P M; Hu, C H; Qian, J L; Pu, J X; Hua, J K

    2001-04-01

    A new technology for harnessing the dye polluted water and dye collection was developed. It is based on the enhanced evaporation by using solar, wind and air temperature energy and additional heat-electric energy. It consists of four parts: (1) evaporation carrier system (evaporation carrier and frame for evaporation carrier) for polluted water; (2) polluted water circulating system (pumping-spraying-collecting); (3) heating system; (4) workshop with polluted water reservoir-tanks and rainfall prevention roof. The polluted water was (heated in case necessary) sprayed to the evaporation carrier system and the water was evaporated when it moved in the space and downward along the carrier mainly by using natural (solar, wind and air temperature energy). In case, when there is no roof for the carrier system, the polluted water can be stored in the reservoirs (storage volume for about 20 days). The first 10-25 mm rainfall also need to be stored in the reservoirs to meet the state standard for discharging wastewater. The dye may be collected at the surface in the reservoir-tanks and the crystallized salt may be collected at the bottom plate. The black-color wastewater released by the factory is no more discharged to the surface water system of Taihu Lake Basin. About 2 kg dye and 200 kg industrial salt may be collected from each tone of the polluted water. The non-pollution production of dye may be realized by using this technology with environmental, economical and social benefits. PMID:11590742

  13. DEVELOPMENT AND ASSESSMENT OF PROCEDURES FOR COLLECTION, CHEMICAL CHARACTERIZATION AND MUTAGENICITY TESTING OF AMBIENT AIR

    EPA Science Inventory

    The overall objective of this Research Triangle Institute pilot study was to develop and evaluate a minimal testing protocol which could detect and quantify the mutagenic potential of ambient air. The cost-effective biological and chemical testing protocol developed under this pr...

  14. TESTING DUPLICATE DIET SAMPLE COLLECTION METHODS FOR MEASURING PERSONAL DIETARY EXPOSURES TO CHEMICAL CONTAMINANTS

    EPA Science Inventory

    Dietary ingestion may be a significant pathway of human exposure to many potentially toxic chemicals. The U.S.Environmental Protection Agency-National Human Exposure Laboratory has made the development of methods for measuring persoanl dietary exposures a high priority for its di...

  15. Long-term observation of water-soluble chemical components in the bulk atmospheric aerosols collected at Okinawa, Japan

    NASA Astrophysics Data System (ADS)

    Handa, Daishi; Somada, Yuka; Ijyu, Moriaki; Azechi, Sotaro; Nakaema, Fumiya; Arakaki, Takemitsu; Tanahara, Akira

    2010-05-01

    The economic development and population growth in recent Asia spread air pollution. Emission rate of air pollutants from Asia, in particular oxides of nitrogen, surpassed those from North America and Europe and should continue to exceed them for decades. The study of the long-range transported air pollution from Asian continent has gained a special attention in Japan because of increase in photochemical oxidants in relatively remote islands. Okinawa Island is situated approximately 1500 km south of Tokyo, Japan, 2000 km southeast of Beijing, China, and 1000 km south of South Korea. Its location in Asia is well suited for studying long-range transport of air pollutants in East Asia because maritime air mass prevails during summer, while continental air mass dominates during fall, winter, and spring. The maritime air mass data can be seen as background and can be compared with continental air masses which have been affected by anthropogenic activities. Bulk aerosol samples were collected on quartz filters by using a high volume air sampler. Sampling duration was one week for each sample. We determined the concentrations of water-soluble anions, cations and dissolved organic carbon (DOC) in the bulk aerosols collected at the Cape Hedo Atmosphere and Aerosol Monitoring Station (CHAAMS) using ion chromatography, atomic absorption spectrometry, and total organic carbon analyzer, respectively. We will report water-soluble chemical components data of anions, cations and DOC in bulk atmospheric aerosols collected at CHAAMS during August, 2005 to April, 2010. Seasonal variation of water-soluble chemical components showed that the concentrations were relatively low in summer, higher in fall and winter, and the highest in spring. When air mass came from Asian Continent, the concentrations of water-soluble chemical components were much higher compared to the other directions. In addition, we calculated background concentration of water-soluble chemical components at Okinawa, Japan.

  16. Chemical speciation of size-segregated floor dusts and airborne magnetic particles collected at underground subway stations in Seoul, Korea.

    PubMed

    Jung, Hae-Jin; Kim, BoWha; Malek, Md Abdul; Koo, Yong Sung; Jung, Jong Hoon; Son, Youn-Suk; Kim, Jo-Chun; Kim, HyeKyoung; Ro, Chul-Un

    2012-04-30

    Previous studies have reported the major chemical species of underground subway particles to be Fe-containing species that are generated from wear and friction processes at rail-wheel-brake and catenaries-pantographs interfaces. To examine chemical composition of Fe-containing particles in more details, floor dusts were collected at five sampling locations of an underground subway station. Size-segregated floor dusts were separated into magnetic and non-magnetic fractions using a permanent magnet. Using X-ray diffraction (XRD) and scanning electron microscopy/energy dispersive X-ray spectrometry (SEM/EDX), iron metal, which is relatively harmless, was found to be the dominating chemical species in the floor dusts of the <25 μm size fractions with minor fractions of Mg, Al, Si, Ca, S, and C. From SEM analysis, the floor dusts of the <25 μm size fractions collected on railroad ties appeared to be smaller than 10 μm, indicating that their characteristics should somewhat reflect the characteristics of airborne particles in the tunnel and the platform. As most floor dusts are magnetic, PM levels at underground subway stations can be controlled by removing magnetic indoor particles using magnets. In addition, airborne subway particles, most of which were smaller than 10 μm, were collected using permanent magnets at two underground subway stations, namely Jegi and Yangjae stations, in Seoul, Korea. XRD and SEM/EDX analyses showed that most of the magnetic aerosol particles collected at Jegi station was iron metal, whereas those at Yangjae station contained a small amount of Fe mixed with Na, Mg, Al, Si, S, Ca, and C. The difference in composition of the Fe-containing particles between the two subway stations was attributed to the different ballast tracks used. PMID:22381374

  17. Thymine vanadyl(II) compound as a diabetic drug model: Chemical spectroscopic and antimicrobial assessments

    NASA Astrophysics Data System (ADS)

    El-Sayed, Mohamed Y.; Refat, Moamen S.

    2014-09-01

    The aim of this study was to synthesize a novel bifunctionalized thymine vanadyl(II) compound. The solid vanadyl(II) compound has been characterized by elemental analyses (CHN), Raman laser, infrared spectra, molar conductivity, electronic spectra, thermogravimetric analyses (TGA), scanning electron microscopy (SEM) and X-ray powder diffraction (XRD) studies. Electronic and magnetic measurements have confirmed that the speculated geometry of vanadyl(II) compound is square pyramidal geometry. The microbial test was performed for the vanadyl complex against some kinds of bacteria and fungi. The results suggested that [VO(Thy)2] adduct has an anti-diabetic profile.

  18. Spatial distribution and temporal variation of chemical species in the bulk atmospheric aerosols collected at the Okinawa archipelago, Japan

    NASA Astrophysics Data System (ADS)

    Handa, D.; Somada, Y.; Ijyu, M.; Azechi, S.; Nakaema, F.; Arakaki, T.; Tanahara, A.

    2009-12-01

    The economic development and population growth in recent Asia have been increasing air pollution. A computer simulation study showed that air pollutants emitted from Asian continent could spread quickly within northern hemisphere. We initiated a study to elucidate the special distribution and chemical characterization of atmospheric aerosols around Okinawa archipelago, Japan. Okinawa Island is situated approximately 1500 km south of Tokyo, Japan, 2000 km southeast of Beijing, China, and 1000 km south of South Korea. Its location in Asia is well suited for studying long-range transport of air pollutants in East Asia because maritime air mass prevails during summer, while continental air mass dominates during fall, winter, and spring. The maritime air mass data can be seen as background and can be compared with continental air masses which have been affected by anthropogenic activities. We simultaneously collected bulk aerosol samples by using the same types of high volume air samplers at Cape Hedo Atmosphere and Aerosol Monitoring Station (CHAAMS, Okinawa Island), Kume Island (ca. 160 km south-west of CHAAMS) and Minami-daitou Island (ca. 320 km south-east of CHAAMS). We determined the concentrations of water-soluble anions, cations and dissolved organic carbon (DOC) using ion chromatography, atomic absorption spectrometry, and total organic carbon analyzer, respectively. We report and discuss spatial distribution and temporal variation of chemical species concentrations in bulk atmospheric aerosols collected during July, 2008 to July, 2009. We determine “background” concentration of chemical components in Okinawa archipelago. We then compare each chemical component among CHAAMS, Kume Island and Minami-daito Island to elucidate the influence of the long-range transport of chemical species from Asian continent.

  19. Oxidative damage induced in A549 cells by physically and chemically characterized air particulate matter (PM2.5) collected in Abidjan, Côte d'Ivoire.

    PubMed

    Kouassi, Kouakou S; Billet, Sylvain; Garçon, Guillaume; Verdin, Anthony; Diouf, Amadou; Cazier, Fabrice; Djaman, Joseph; Courcot, Dominique; Shirali, Pirouz

    2010-05-01

    Exposure to high levels of air pollution particulate matter (PM) is strongly associated with increased pulmonary morbidity and mortality. However, the underlying mechanisms of action whereby PM cause adverse health effects are still unclear. In developing countries, like in the sub-Saharian region of Africa, people are often exposed to high PM levels. Hence, three PM(2.5) samples were collected in the District of Abidjan (Côte d'Ivoire), under rural, urban or industrial influences. Their most toxicologically relevant physical and chemical characteristics were determined--thereby showing that most of them were equal or smaller than 2.5 microm--and the influence of both natural (Ca, Na, Mg, Ti, etc.) and anthropic (Al, Fe, Mn, Cr, Pb, Zn, Cu, Ni, benzene and its derivatives, paraffins, etc.) emission sources. The toxicity induced by the three PM samples was studied through 5-bromodeoxyuridine incorporation to DNA, mitochondrial dehydrogenase activity and extracellular lactate dehydrogenase activity. Hence, effect concentrations at 10 and 50% (EC(10) and EC(50), respectively) were as follows: (i) rural PM--EC(10) = 5.91 microg cm(-2) and EC(50) = 29.55 microg cm(-2); (ii) urban PM--EC(10) = 5.45 microg cm(-2) and EC(50) = 27.23 microg cm(-2); and (iii) industrial PM--EC(10) = 6.86 microg cm(-2) and EC(50) = 34.29 microg cm(-2). Moreover, PM-induced oxidative damage in A549 cells was observed through the induction of lipid peroxidation, the alteration of superoxide dismutase activity, and the disruption of glutathione status. Both the transition metals and the organic chemicals within the three collected PM samples under study might be involved in the oxidative damage and, therefore, the toxicity they induced in A549 cells. PMID:19943358

  20. Chemical and isotopic properties and origin of coarse airborne particles collected by passive samplers in industrial, urban, and rural environments

    NASA Astrophysics Data System (ADS)

    Guéguen, Florence; Stille, Peter; Dietze, Volke; Gieré, Reto

    2012-12-01

    Passive air samplers have been installed in industrial, urban, rural and remote forested environments in order to collect coarse airborne particles for subsequent chemical characterization. To identify principal polluting sources, isotopic tracers, such as Sr, Nd and Pb isotopic ratios, have been used. The mass deposition rates (MDRs) of trace metals, determined for each of the studied environments, clearly indicate that industrial and traffic sites are especially affected by air pollution. Elements such as V, Pb, Fe, Cr, Co, Mo, Cd, Ni, As, Sb and Zn are notably enriched in samples from industrial zones, whereas V, Mn, Ba, Sr, Al, U, Th, rare earth elements (REE), Zr, Y, Cs, Rb, Sb, Sn and Cu are principal components of the airborne particles collected close to areas influenced by heavy traffic. The chemical/isotopic baseline composition derived from the airborne particles is the result of mixing of particles from different industrial sources, traffic and fertilizers. The monthly analysis of trace-metal MDRs of the collected airborne particle samples from different stations around the industrial zone allows for the detection of distinct atmospheric dust-deposition events during the year, characterized by high MDRs. "Natural" dusts from regional soil re-suspension, including from more distant regions like the Sahara desert, might overprint the regional atmospheric baseline composition, as suggested by trace metal trajectories in ternary diagrams and by Sr, Nd and Pb isotope data.

  1. The evolution of gene collectives: How natural selection drives chemical innovation.

    PubMed

    Fischbach, Michael A; Walsh, Christopher T; Clardy, Jon

    2008-03-25

    DNA sequencing has become central to the study of evolution. Comparing the sequences of individual genes from a variety of organisms has revolutionized our understanding of how single genes evolve, but the challenge of analyzing polygenic phenotypes has complicated efforts to study how genes evolve when they are part of a group that functions collectively. We suggest that biosynthetic gene clusters from microbes are ideal candidates for the evolutionary study of gene collectives; these selfish genetic elements evolve rapidly, they usually comprise a complete pathway, and they have a phenotype-a small molecule-that is easy to identify and assay. Because these elements are transferred horizontally as well as vertically, they also provide an opportunity to study the effects of horizontal transmission on gene evolution. We discuss known examples to begin addressing two fundamental questions about the evolution of biosynthetic gene clusters: How do they propagate by horizontal transfer? How do they change to create new molecules? PMID:18216259

  2. The evolution of gene collectives: How natural selection drives chemical innovation

    PubMed Central

    Fischbach, Michael A.; Walsh, Christopher T.; Clardy, Jon

    2008-01-01

    DNA sequencing has become central to the study of evolution. Comparing the sequences of individual genes from a variety of organisms has revolutionized our understanding of how single genes evolve, but the challenge of analyzing polygenic phenotypes has complicated efforts to study how genes evolve when they are part of a group that functions collectively. We suggest that biosynthetic gene clusters from microbes are ideal candidates for the evolutionary study of gene collectives; these selfish genetic elements evolve rapidly, they usually comprise a complete pathway, and they have a phenotype—a small molecule—that is easy to identify and assay. Because these elements are transferred horizontally as well as vertically, they also provide an opportunity to study the effects of horizontal transmission on gene evolution. We discuss known examples to begin addressing two fundamental questions about the evolution of biosynthetic gene clusters: How do they propagate by horizontal transfer? How do they change to create new molecules? PMID:18216259

  3. ANALYTICAL METHODS FOR A NATIONAL STUDY OF CHEMICAL RESIDUES IN FISH - II. PESTICIDES AND POLYCHLORINATED BIPHENYLS

    EPA Science Inventory

    Analytical methods and a quality assurance plan have been developed to determine the concentration of a select group of bioaccumulatable chemicals in fish tissue. he analytes include PCBs and 21 pesticides and industrial chemicals. he methodology has been used to conduct a survey...

  4. Impact of geothermal technology improvements on royalty collections on federal lands: Volume II: Appendices

    SciTech Connect

    Not Available

    1988-10-01

    This volume contains the appendices for the ''Impact of Geothermal Technology Improvements on Royalty Collections on Federal Lands, Final Report, Volume I.'' The material in this volume supports the conclusions presented in Volume I and details each Known Geothermal Resource Area's (KGRA's) royalty estimation. Appendix A details the physical characteristics of each KGRA considered in Volume I. Appendix B supplies summary narratives on each state which has a KGRA. The information presented in Appendix C shows the geothermal power plant area proxies chosen for each KGRA considered within the report. It also provides data ranges which fit into the IMGEO model for electric energy cost estimates. Appendix D provides detailed cost information from the IMGEO model if no Geothermal Program RandD goals were completed beyond 1987 and if all the RandD goals were completed by the year 2000. This appendix gives an overall electric cost and major system costs, which add up to the overall electric cost. Appendix E supplies information for avoided cost projections for each state involved in the study that were used in the IMGEO model run to determine at what cost/kWh a 50 MWe plant could come on line. Appendix F supplies the code used in the determination of royalty income, as well as, tabled results of the royalty runs (detailed in Appendix G). The tabled results show royalty incomes, assuming a 10% discount rate, with and without RandD and with and without a $0.01/kWh transmission cost. Individual data sheets for each KGRA royalty income run are presented in Appendix G.

  5. Deep proteomic profiling of vasopressin-sensitive collecting duct cells. II. Bioinformatic analysis of vasopressin signaling.

    PubMed

    Yang, Chin-Rang; Raghuram, Viswanathan; Emamian, Milad; Sandoval, Pablo C; Knepper, Mark A

    2015-12-15

    Vasopressin controls osmotic water transport in the renal collecting duct through regulation of aquaporin-2 (AQP2). We carried out bioinformatic analysis of quantitative proteomic data from the accompanying article to investigate the mechanisms involved. The experiments used stable isotope labeling by amino acids in cell culture in cultured mpkCCD cells to quantify each protein species in each of five differential-centrifugation (DC) fractions with or without the vasopressin analog 1-desamino-8-d-arginine-vasopressin (dDAVP). The mass spectrometry data and parallel Western blot experiments confirmed that dDAVP addition is associated with an increase in AQP2 abundance in the 17,000-g pellet and a corresponding decrease in the 200,000-g pellet. Remarkably, all subunits of the cytoplasmic ribosome also increased in the 17,000-g pellet in response to dDAVP (P < 10(-34)), with a concomitant decrease in the 200,000-g pellet. Eukaryotic translation initiation complex 3 (eIF3) subunits underwent parallel changes (P < 10(-6)). These findings are consistent with translocation of assembled ribosomes and eIF3 complexes into the rough endoplasmic reticulum in response to dDAVP. Conversely, there was a systematic decrease in small GTPase abundances in the 17,000-g fraction. In contrast, most proteins, including protein kinases, showed no systematic redistribution among DC fractions. Of the 521 protein kinases coded by the mouse genome, 246 were identified, but many fewer were found to colocalize with AQP2 among DC fractions. Bayes' rule was used to integrate the new colocalization data with prior data to identify protein kinases most likely to phosphorylate aquaporin-2 at Ser(256) (Camk2b > Camk2d > Prkaca) and Ser(261) (Mapk1 = Mapk3 > Mapk14). PMID:26310817

  6. Initial chemical and biological characterization of hydrotreated solvent refined coal (SRC-II) liquids: a status report

    SciTech Connect

    Weimer, W.C.; Wilson, B.W.; Pelroy, R.A.; Craun, J.C.

    1980-07-01

    This report presents the results of both chemical and biomedical research performed on a solvent refined coal (SRC-II) research material (distillate blend) which was produced by the pilot plant facility at Fort Lewis, Washington. Samples of this distillate blend were subjected to research-scale hydrotreatment by Universal Oil Products, Inc., prior to chemical and biological analysis at PNL. The samples are considered to be, in general, generically representative of raw or hydrotreated materials which might be produced by demonstration or commercial-scale facilities. The above described feedstock and hydrotreated materials were analyzed for chemical composition both prior to and after chemical fractionation. The fractionation procedure used was an acid-base-neutral solvent extraction. The fractions produced, as well as the unfractionated materials, were subjected to microbial mutagenesis testing (Ames assay) and to further chemical analysis. The principal components of the unmodified distillate blend are two and three ringed aromatic and heteroatomic species together with high concentrations of phenolic and polynuclear aromatic components relative to typical levels found in petroleum crudes. The Ames assay mutagenic response for the unfractionated material, as well as the fractions produced by the solvent separation, was reduced considerably in the hydrotreated materials compared to that of the feedstock. Total mutagenic response for the hydrotreated products was approximately 1% of that in the untreated feedstock. The concentrations of two important genetically active compound classes, the polynuclear aromatic hydrocarbons and the primary aromatic amines, were considerably reduced in both of the hydrotreated products compared to the feedstock.

  7. CHEMICALLY BONDED CEMENTS FROM BOILER ASH AND SLUDGE WASTES. PHASE II REPORT, SEPT.1998-JULY 1999.

    SciTech Connect

    SUGAMA,T.YAGER,K.A.BLANKENHORN,D.

    1999-08-01

    Based upon the previous Phase I research program aimed at looking for ways of recycling the KeySpan-generated wastes, such as waste water treatment sludge (WWTS) and bottom ash (BA), into the potentially useful cementitious materials called chemically bonded cement (CBC) materials, the emphasis of this Phase II program done at Brookhaven National Laboratory, in a period of September 1998 through July 1999, was directed towards the two major subjects: One was to assess the technical feasibility of WWTS-based CBC material for use as Pb-exchange adsorbent (PEA) which remediates Pb-contaminated soils in the field; and the other was related to the establishment of the optimum-packaging storage system of dry BA-based CBC components that make it a promising matrix material for the steam-cured concrete products containing sand and coarse aggregate. To achieve the goal of the first subject, a small-scale field demonstration test was carried out. Using the PEA material consisting of 30 wt% WWTS, 13 wt% Type I cement and 57 wt% water, the PES slurry was prepared using a rotary shear concrete mixer, and then poured on the Pb-contaminated soil. The PEA-to-soil ratio by weight was a factor of 2.0. The placed PEA slurry was blended with soil using hand mixing tools such as claws and shovels. The wettability of soils with the PEA was very good, thereby facilitating the soil-PEA mix procedures. A very promising result was obtained from this field test; in fact, the mount of Pb leached out from the 25-day-aged PEA-treated soil specimen was only 0.74 mg/l, meeting the requirement for EPA safe regulation of < 5 mg/l. In contrast, a large amount (26.4 mg/l) of Pb was detected from the untreated soil of the same age. Thus, this finding demonstrated that the WWTS-based CBC has a potential for use as PEA material. Regarding the second subject, the dry-packed storage system consisting of 68.7 wt% BA, 13.0 wt% calcium aluminate cement (CAC), 13.0 wt% Type I portland cement and 5.3 wt% sodium polyphosphate (NaP), was designed in response to the identification of the most effective CBC formulation in strengthening the steam-cured concrete specimens. Using this storage system with the material cost of 6.32 cents/lb, the 80 C-20 hour-steam-cured concrete specimens displayed the compressive strength of 3980 psi, tensile splitting of 416 psi, flexural strength of 808 psi, and modulus of elasticity of 3.16 x 10{sup 6} psi. Furthermore, the specimens had a good resistance to acid erosion and a lower permeability of water, compared with those of the conventional Type I cement concrete specimens. Consequently, the cost-effective BA-based CBC gave the promise of being a potentially useful material for fabricating high-performance precast concrete products, such as building blocks, pipes, and slabs.

  8. Field survey of Glycyrrhiza plants in Central Asia (3). Chemical characterization of G. glabra collected in Uzbekistan.

    PubMed

    Hayashi, Hiroaki; Hattori, Sayaka; Inoue, Kenichiro; Khodzhimatov, Olimjon; Ashurmetov, Ozodbek; Ito, Michiho; Honda, Gisho

    2003-11-01

    The chemical characteristics of Glycyrrhiza glabra L. were investigated at a habitat in Uzbekistan. HPLC analysis of the underground parts indicated that glycyrrhizin contents varied from 3.3 to 6.1% of dry weight, and that glabridin, a species-specific flavonoid for G. glabra, was detected in all underground samples (0.08-0.35% of dry weight). HPLC analysis of the leaves indicated that G. glabra plants collected in the present study could be divided into two types, RT-type and IQ-type, according to their major flavonol glycosides, rutin or isoquercitrin, respectively. PMID:14600388

  9. Synthesis, Spectroscopic, Structural and Quantum Chemical Studies of a New Imine Oxime and Its Palladium(II) Complex: Hydrolysis Mechanism.

    PubMed

    Kaya, Yunus; Yilmaz, Veysel T; Buyukgungor, Orhan

    2016-01-01

    In this work, we report synthesis, crystallographic, spectroscopic and quantum chemical studies of a new imine oxime, namely (4-nitro-phenyl)-(1-phenyl-ethylimino)-acetaldehyde oxime (nppeieoH). Spectroscopic and X-ray diffraction studies showed that nppeieoH is hydrolyzed in aqueous solution, forming nitroisonitrosoacetophenone (ninap) and the hydrolysis product binds to Pd(II) to yield [Pd(nppeieo)(ninap)]. The mechanism of the hydrolysis reaction has been theoretically investigated in detail, using density functional theory (DFT) with the B3LYP method. The vibrational and the electronic spectra of nppeieoH and its Pd(II) complex, the HOMO and LUMO analysis, Mulliken atomic charges and molecular electrostatic potential were also performed. The predicted nonlinear optical properties of both compounds are higher than those of urea. PMID:26805795

  10. Screening of novel chemical compounds as possible inhibitors of carbonic anhydrase and photosynthetic activity of photosystem II.

    PubMed

    Karacan, Mehmet Sayım; Zharmukhamedov, Sergei K; Mamaş, Serhat; Kupriyanova, Elena V; Shitov, Alexandr V; Klimov, Vyacheslav V; Özbek, Neslihan; Özmen, Ümmühan; Gündüzalp, Ayla; Schmitt, Franz-Josef; Karacan, Nurcan; Friedrich, Thomas; Los, Dmitry A; Carpentier, Robert; Allakhverdiev, Suleyman I

    2014-08-01

    Thirty novel chemical compounds were designed and synthesized expecting that they would be possible inhibitors. From this number eleven were organic bases, twenty-four were their organic derivatives and fourteen were metal complexes. Screening of these chemicals by their action on photosynthetic electron transfer (PET) and carbonic anhydrase (CA) activity (CAA) of photosystem II (PSII), α-CA, as well as β-CA was done. Several groups were revealed among them. Some of them are capable to suppress either one, two, three, or even all of the measured activities. As example, one of the Cu(II)-phenyl sulfonylhydrazone complexes (compound 25) suppresses CAA of α-CA by 88%, CAA of β-CA by 100% inhibition; CAA of PSII by 100% and the PSII photosynthetic activity by 66.2%. The Schiff base compounds (12, 15) and Cu(II)-phenyl sulfonylhydrazone complexes (25, 26) inhibited the CAA and PET of PSII significantly. The obtained data indicate that the PSII donor side is a target of the inhibitory action of these agents. Some physico- or electrochemical properties such as diffusion coefficient, number of transferred electrons, peak potential and heterogeneous standard rate constants of the compounds were determined in nonaqueous media. pKa values were also determined in nonaqueous and aqueous media. Availability in the studied group of novel chemical agents possessing different inhibitory activity allow in future to isolate the "active part" in the structure of the inhibitors responsible for different inhibitory mechanisms, as well as to determine the influence of side substituters on its inhibitory efficiency. PMID:24418071

  11. Monitoring physical and chemical parameters of Delaware Bay waters with an ERTS-1 data collection platform

    NASA Technical Reports Server (NTRS)

    Klemas, V. (Principal Investigator); Wethe, C.

    1975-01-01

    The author has identified the following significant results. Results of the analysis of data collected during the summer of 1974 demonstrate that the ERTS Data Collection Platform (DCP) is quite responsive to changing water parameters and that this information can be successfully transmitted under all weather conditions. The monitoring of on-site probe outputs reveals a rapid response to changing water temperature, salinity, and turbidity conditions on incoming tides as the tidal salt wedge passes the probe location. The changes in water properties were corroborated by simultaneously sampling the water for subsequent laboratory analysis. Fluctuations observed in the values of salinity, conductivity, temperature and water depth over short time intervals were extremely small. Due to the nature of the probe, 10% to 20% fluctuations were observed in the turbidity values. The use of the average of the values observed during an overpass provided acceptable results. Good quality data was obtained from the satellite on each overpass regardless of weather conditions. Continued use of the DCP will help provide an indication of the accuracy of the probes and transmission system during long term use.

  12. Thin films of tin(II) sulphide (SnS) by aerosol-assisted chemical vapour deposition (AACVD) using tin(II) dithiocarbamates as single-source precursors

    NASA Astrophysics Data System (ADS)

    Kevin, Punarja; Lewis, David J.; Raftery, James; Azad Malik, M.; O'Brien, Paul

    2015-04-01

    The synthesis of the asymmetric dithiocarbamates of tin(II) with the formula [Sn(S2CNRR')2] (where R=Et, R'=n-Bu (1); R=Me, R'=n-Bu (2); R=R'=Et (3)) and their use for the deposition of SnS thin films by aerosol-assisted chemical vapour deposition (AACVD) is described. The effects of temperature and the concentration of the precursors on deposition were investigated. The stoichiometry of SnS was best at higher concentrations of precursors (250 mM) and at 450 °C. The direct electronic band gap of the SnS produced by this method was estimated from optical absorbance measurements as 1.2 eV. The composition of films was confirmed by powder X-ray diffraction (p-XRD) and energy dispersive analysis of X-rays (EDAX) spectroscopy.

  13. Human urinary excretion of non-persistent environmental chemicals: an overview of Danish data collected between 2006 and 2012.

    PubMed

    Frederiksen, Hanne; Jensen, Tina Kold; Jørgensen, Niels; Kyhl, Henriette Boye; Husby, Steffen; Skakkebæk, Niels E; Main, Katharina M; Juul, Anders; Andersson, Anna-Maria

    2014-01-01

    Several non-persistent industrial chemicals have shown endocrine disrupting effects in animal studies and are suspected to be involved in human reproductive disorders. Among the non-persistent chemicals that have been discussed intensively during the past years are phthalates, bisphenol A (BPA), triclosan (TCS), and parabens because of their anti-androgenic and/or estrogenic effects. Phthalates are plasticizers used in numerous industrial products. Bisphenol A is the main component of polycarbonate plastics and epoxy resins. Parabens and TCS are antimicrobial preservatives and other phenols such as benzophenone-3 (BP-3) act as a UV-screener, while chlorophenols and phenyl phenols are used as pesticides and fungicides in agriculture. In spite of the widespread use of industrial chemicals, knowledge of exposure sources and human biomonitoring studies among different segments of the population is very limited. In Denmark, we have no survey programs for non-persistent environmental chemicals, unlike some countries such as the USA (NHANES) and Germany (GerES). However, we have analyzed the excretion of seven parabens, nine phenols, and the metabolites of eight different phthalates in urine samples collected over the past 6 years from four Danish cohorts. Here, we present biomonitoring data on more than 3600 Danish children, adolescents, young men, and pregnant women from the general population. Our study shows that nearly all Danes were exposed to the six most common phthalates, to BPA, TCS, and BP-3, and to at least two of the parabens. The exposure to other non-persistent chemicals was also widespread. Our data indicate decreasing excretion of two common phthalates (di-n-butyl phthalate and di-(2-ethylhexyl) phthalate) over time. PMID:24395915

  14. ENVIRONMENTAL PATHWAYS OF SELECTED CHEMICALS IN FRESHWATER SYSTEMS. PART II. LABORATORY STUDIES

    EPA Science Inventory

    Environmental exposure assessment models and laboratory procedures for predicting the pathways of potentially harmful chemicals in freshwater environments were described in Part I of this report (PB-274 548). Procedures were developed for measuring the rates of volatilization, ph...

  15. STRUCTURE-TOXICITY RELATIONSHIPS FOR INDUSTRIAL CHEMICALS CAUSING TYPE(II) NARCOSIS SYNDROME

    EPA Science Inventory

    Several structure-activity relationships have been published for estimating the lethality of nonpolar nonelectrolytes to fish. The vast majority of non-reactive industrial chemicals produce toxicity symptoms consistent with narcosis. However, researchers have found that many chem...

  16. Test Driving ToxCast: Endocrine Profiling for 1858 Chemicals Included in Phase II

    PubMed Central

    Filer, Dayne; Patisaul, Heather B.; Schug, Thaddeus; Reif, David; Thayer, Kristina

    2014-01-01

    Identifying chemicals, beyond those already implicated, to test for potential endocrine disruption is a challenge and high throughput approaches have emerged as a potential tool for this type of screening. This review focused the Environmental Protection Agency’s (EPA) ToxCast™ high throughput in vitro screening (HTS) program. Utility for identifying compounds was assessed and reviewed by using it to run the recently expanded chemical library (from 309 compounds to 1858) through the ToxPi™ prioritization scheme for endocrine disruption. The analysis included metabolic and neuroendocrine targets. This investigative approach simultaneously assessed the utility of ToxCast, and helped identify novel chemicals which may have endocrine activity. Results from this exercise suggest the spectrum of environmental chemicals with potential endocrine activity is much broader than indicated, and that some aspects of endocrine disruption are not fully covered in ToxCast. PMID:25460227

  17. Salmonella mutagenicity tests. II. Results from the testing of 270 chemicals

    SciTech Connect

    Mortelmans, K.; Haworth, S.; Lawlor, T.; Speck, W.; Tainer, B.; Zeiger, E.

    1986-01-01

    This publication includes data of Salmonella mutagenicity results on 270 coded chemicals, encompassing 329 tests performed by three laboratories under contract to the National Toxicology Program (NTP). The preincubation modification of the Salmonella/mammalian microsome assay was used to test chemicals in up to five Salmonella strains in the presence and absence of rat and hamster liver S-9. With a few exceptions, inter- and intralaboratory reproducibility was good.

  18. Dust as interstellar catalyst. II. How chemical desorption impacts the gas

    NASA Astrophysics Data System (ADS)

    Cazaux, S.; Minissale, M.; Dulieu, F.; Hocuk, S.

    2016-01-01

    Context. Interstellar dust particles, which represent 1% of the total mass, are recognized to be very powerful interstellar catalysts in star-forming regions. The presence of dust can have a strong impact on the chemical composition of molecular clouds. While observations show that many species that formed onto dust grains populate the gas phase, the process that transforms solid state into gas phase remains unclear. Aims: The aim of this paper is to consider the chemical desorption process, i.e. the process that releases solid species into the gas phase, in astrochemical models. These models allow determining the chemical composition of star-forming environments with an accurate treatment of the solid-phase chemistry. Methods: In paper I we derived a formula based on experimental studies with which we quantified the efficiencies of the chemical desorption process. Here we extend these results to astrophysical conditions. Results: The simulations of astrophysical environments show that the abundances of gas-phase methanol and H2O2 increase by four orders of magnitude, whereas gas-phase H2CO and HO2 increase by one order of magnitude when the chemical desorption process is taken into account. The composition of the ices strongly varies when the chemical desorption is considered or neglected. Conclusions: We show that the chemical desorption process, which directly transforms solid species into gas-phase species, is very efficient for many reactions. Applied to astrophysical environments such as ρ Oph A, we show that the chemical desorption efficiencies derived in this study reproduce the abundances of observed gas-phase methanol, HO2, and H2O2, and that the presence of these molecules in the gas shows the last signs of the evolution of a cloud before the frost.

  19. Collective retention and transmission of chemical signals in a social insect

    NASA Astrophysics Data System (ADS)

    Gill, Katherine P.; van Wilgenburg, Ellen; Taylor, Peter; Elgar, Mark A.

    2012-03-01

    Social insect colonies exhibit highly coordinated responses to ecological challenges by acquiring information that is disseminated throughout the colony. Some responses are coordinated directly from the signals produced by individuals that acquired the information. Other responses may require information to be transferred indirectly through a third party, thereby requiring colony-wide retention of information. Social insects use colony signature odours to distinguish between nestmates and non-nestmates, and the level of aggression between non-nestmates typically varies according to the distance between colonies and thus their history of interactions. Such coordinated, colony-specific responses may require information about particular odours to be disseminated and retained across the colony. Our field experiments with weaver ants reveal colony-wide, indirect acquisition and retention of the signature odours of a different colony with which they had experienced aggression. These data highlight the significance of interaction history and suggest the presence of a collective memory.

  20. Chemical fingerprinting of petroleum biomarkers in Deepwater Horizon oil spill samples collected from Alabama shoreline.

    PubMed

    Mulabagal, V; Yin, F; John, G F; Hayworth, J S; Clement, T P

    2013-05-15

    We compare the chromatographic signatures of petroleum biomarkers in Deepwater Horizon (DH) source oil, three other reference crude oils, DH emulsified mousse that arrived on Alabama's shoreline in June 2010, and seven tar balls collected from Alabama beaches from 2011 to 2012. Characteristic hopane and sterane fingerprints show that all the tar ball samples originated from DH oil. In addition, the diagnostic ratios of various hopanes indicate an excellent match. Quantitation data for C₃₀αβ-hopane concentration levels show that most of the weathering observed in DH-related tar balls found on Alabama's beaches is likely the result of natural evaporation and dissolution that occurred during transport across the Gulf of Mexico prior to beach deposition. Based on the physical and biomarker characterization data presented in this study we conclude that virtually all fragile, sticky, brownish tar balls currently found on Alabama shoreline originated from the DH oil spill. PMID:23523118

  1. Ram-air sample collection device for a chemical warfare agent sensor

    DOEpatents

    Megerle, Clifford A.; Adkins, Douglas R.; Frye-Mason, Gregory C.

    2002-01-01

    In a surface acoustic wave sensor mounted within a body, the sensor having a surface acoustic wave array detector and a micro-fabricated sample preconcentrator exposed on a surface of the body, an apparatus for collecting air for the sensor, comprising a housing operatively arranged to mount atop the body, the housing including a multi-stage channel having an inlet and an outlet, the channel having a first stage having a first height and width proximate the inlet, a second stage having a second lower height and width proximate the micro-fabricated sample preconcentrator, a third stage having a still lower third height and width proximate the surface acoustic wave array detector, and a fourth stage having a fourth height and width proximate the outlet, where the fourth height and width are substantially the same as the first height and width.

  2. CHEMICAL INTERACTIONS OF ARSENATE, ARSENITE, PHOSPHATE, AND SILICATE WITH IRON (II, III) HYDROXYCARBONATE GREEN RUST

    EPA Science Inventory

    Granular zerovalent iron has been proposed to be used as a medium in permeable reactive barriers (PRBs) to remove arsenic from contaminated groundwater. Iron(II, III) hydroxycarbonate green rust (carbonate green rust, or CGR) is a major corrosion product of zerovalent iron under ...

  3. CHEMICAL INTERACTIONS OF ARSENATE, ARSENITE, PHOSPHATE, AND SILICATE WITH IRON (II,III) HYDROXYCARBONATE GREEN RUST

    EPA Science Inventory

    Granular zerovalent iron has been proposed to be used as a medium in permeable reactive barriers (PRBs) to remove arsenic from contaminated groundwater. Iron(II, III) hydroxycarbonate green rust (carbonate green rust, or CGR) is a major corrosion product of zerovalent iron under ...

  4. Chemical Remediation of Nickel(II) Waste: A Laboratory Experiment for General Chemistry Students

    ERIC Educational Resources Information Center

    Corcoran, K. Blake; Rood, Brian E.; Trogden, Bridget G.

    2011-01-01

    This project involved developing a method to remediate large quantities of aqueous waste from a general chemistry laboratory experiment. Aqueous Ni(II) waste from a general chemistry laboratory experiment was converted into solid nickel hydroxide hydrate with a substantial decrease in waste volume. The remediation method was developed for a

  5. Chemical Remediation of Nickel(II) Waste: A Laboratory Experiment for General Chemistry Students

    ERIC Educational Resources Information Center

    Corcoran, K. Blake; Rood, Brian E.; Trogden, Bridget G.

    2011-01-01

    This project involved developing a method to remediate large quantities of aqueous waste from a general chemistry laboratory experiment. Aqueous Ni(II) waste from a general chemistry laboratory experiment was converted into solid nickel hydroxide hydrate with a substantial decrease in waste volume. The remediation method was developed for a…

  6. Dust depletion, chemical uniformity and environment of CaII H&K quasar absorbers

    NASA Astrophysics Data System (ADS)

    Zych, Berkeley J.; Murphy, Michael T.; Hewett, Paul C.; Prochaska, Jason X.

    2009-02-01

    CaII??3934, 3969 absorbers, which are likely to be a subset of damped Lyman ? systems (DLAs), are the most dusty quasar absorbers known with an order of magnitude more extinction in E(B - V) than other absorption systems. There is also evidence that CaII absorbers trace galaxies with more ongoing star formation than the average quasar absorber. Despite this, relatively little is known in detail about these unusual absorption systems. Here, we present the first high-resolution spectroscopic study of 19 CaII quasar absorbers, in the range 0.6 <= zabs <= 1.2, with CaII?3934 equivalent widths, W39340 >= 0.2. Their general elemental depletion patterns are found to be similar to measurements in the warm halo phase of the Milky Way (MW) and Magellanic Clouds interstellar medium. Dust depletions and ?-enrichments profiles of subsamples of seven and three absorbers, respectively, are measured using a combination of Voigt profile fitting and apparent optical depth techniques. Deviations in [Cr/Zn] ~ 0.3 +/- 0.1 and [Si/Fe] >~ 0.8 +/- 0.1dex are detected across the profile of one absorber, which we attribute to differential dust depletion. The remaining absorbers have <0.3dex (3? limit) variation in [Cr/Zn], much like the general DLA population, though the dustiest CaII absorbers, those with W39340 > 0.7, remain relatively unprobed in our sample. A limit on electron densities in CaII absorbers, ne < 0.1cm-3, is derived using the ratio of neutral and singly ionized species and assuming a MW-like radiation field. These electron densities may imply hydrogen densities sufficient for the presence of molecular hydrogen in the absorbers. The CaII absorber sample comprises a wide range of velocity widths, ?v90 = 50-470kms-1, and velocity structures, thus a range of physical models for their origin, from simple discs to galactic outflows and mergers, would be required to explain the observations.

  7. Comparison of remote consequences in Taraxacum officinale seed progeny collected in radioactively or chemically contaminated areas.

    PubMed

    Pozolotina, Vera N; Antonova, Elena V; Bezel, Victor S

    2012-10-01

    We carried out a comparative study of seed progeny taken from the dandelion (Taraxacum officinale s.l.) coenopopulations exposed for a long time to radioactive or chemical contamination originated from the East-Ural radioactive trace zone (EURT) or Nizhniy Tagil metallurgical combine impact zone (NTMC), respectively. Coenopopulations from EURT, NTMC and background areas significantly differ from each other with respect to the qualitative and quantitative composition of allozyme phenes. An analysis of clonal diversity showed the uniqueness of all coenopopulations in terms of their phenogenetics. P-generation seed viability was found to decrease in a similar manner as all types of the industrial stress increased. Studies of F (1)-generation variability in radio- and metal resistance by family analysis showed that seed progeny from EURT impact zone possessed high viability that, however, was accompanied by development of latent injuries resulting in low resistance to additional man-caused impacts. In F (1)-generation originated from NTMC zone, high seed viability was combined with increased resistance to provocative heavy metal and radiation exposure. No significant differences in responses to 'habitual' and 'new' factors, i.e. pre-adaptation effect, were found in samples from the contaminated areas. PMID:22661315

  8. Divergent Chemical Cues Elicit Seed Collecting by Ants in an Obligate Multi-Species Mutualism in Lowland Amazonia

    PubMed Central

    Youngsteadt, Elsa; Guerra Bustios, Patricia; Schal, Coby

    2010-01-01

    In lowland Amazonian rainforests, specific ants collect seeds of several plant species and cultivate them in arboreal carton nests, forming species-specific symbioses called ant-gardens (AGs). In this obligate mutualism, ants depend on the plants for nest stability and the plants depend on ant nests for substrate and nutrients. AG ants and plants are abundant, dominant members of lowland Amazonian ecosystems, but the cues ants use to recognize the seeds are poorly understood. To address the chemical basis of the ant-seed interaction, we surveyed seed chemistry in nine AG species and eight non-AG congeners. We detected seven phenolic and terpenoid volatiles common to seeds of all or most of the AG species, but a blend of the shared compounds was not attractive to the AG ant Camponotus femoratus. We also analyzed seeds of three AG species (Anthurium gracile, Codonanthe uleana, and Peperomia macrostachya) using behavior-guided fractionation. At least one chromatographic fraction of each seed extract elicited retrieval behavior in C. femoratus, but the active fractions of the three plant species differed in polarity and chemical composition, indicating that shared compounds alone did not explain seed-carrying behavior. We suggest that the various AG seed species must elicit seed-carrying with different chemical cues. PMID:21209898

  9. Aerosols Collected at a Tropical Marine Environment: Size-Resolved Chemical Composition Using IC, TOC, and Thermal-Optical Analyses

    NASA Astrophysics Data System (ADS)

    Morales-García, F.; Mayol-Bracero, O. L.; Repollet-Pedrosa, M.; Kasper-Giebl, A.; Ramírez-Santa Cruz, C.; Puxbaum, H.

    2009-05-01

    Size-resolved chemical characterization was performed on aerosol samples collected at two different marine sites in the tropics: Dian Point (DP), Antigua and Cape San Juan (CSJ), Puerto Rico. A 13-stage Dekati low- pressure impactor (Dp 0.1 to 10 μm), a 10-stage micro-orifice uniform deposit impactor (Dp 0.054 to 18 μm), and stacked-filter units (Dp < 1.7 μm) were used to collect the samples. Na+, NH4+, K+, Mg2+, Ca2+, Cl-, NO2-, NO3-, SO42-, acetate, formate, malonate, and oxalate were determined using ion chromatography (IC). Thermal-optical analysis (TOA) was used to determine the concentrations of aerosol total carbon (TC), organic carbon (OC), and elemental carbon (EC). Five-day back trajectories calculated using NOAA's HYSPLIT (HYbrid Single-Particle Lagrangian Integrated Trajectory) model identified air masses coming from the North Atlantic (maritime air), Northwest Africa (desert dust), and North America (anthropogenic pollution). Size-resolved chemical characterization of aerosol samples using IC and TOA confirmed that aerosols become aged as they are transported to the Caribbean and their composition depends on the air mass origin. Gravimetric analyses showed that average fine mass concentrations for CSJ station were higher than for DP station (CSJ: 1.9 μg m-3; DP: 1.2 μg m-3). The aerosol chemical composition changed with air masses of different origin and with different pollution levels. In both locations the predominant water-soluble ions in the fine aerosol fraction were Cl-, Na+, and SO42-. Sulphate was observed in higher concentrations during the polluted case and particulate organic matter concentrations were higher for the maritime case. During desert dust events an increase in Ca2+ and Mg2+ of 4 and 2 times, respectively, was observed mainly in the coarse mode. Results for the size-resolved chemical composition and complete aerosol chemical apportionment including the residual mass will be presented.

  10. In Vitro Screening of 1877 Industrial and Consumer Chemicals, Pesticides and Pharmaceuticals in up to 782 Assays: ToxCast Phase I and II (SOT)

    EPA Science Inventory

    In Phase II of the ToxCast program, the U.S. EPA and Tox21 partners screened 1,877 chemicals, including pesticides; food, cosmetics and personal care ingredients; pharmaceuticals; and industrial chemicals. Testing used a 782 in vitro assays across 7 technologies and multiple bi...

  11. Chemical variability of groundwater samples collected from a coal seam gas exploration well, Maramarua, New Zealand.

    PubMed

    Taulis, Mauricio; Milke, Mark

    2013-03-01

    A pilot study has produced 31 groundwater samples from a coal seam gas (CSG) exploration well located in Maramarua, New Zealand. This paper describes sources of CSG water chemistry variations, and makes sampling and analytical recommendations to minimize these variations. The hydrochemical character of these samples is studied using factor analysis, geochemical modelling, and a sparging experiment. Factor analysis unveils carbon dioxide (CO(2)) degassing as the principal cause of sample variation (about 33%). Geochemical modelling corroborates these results and identifies minor precipitation of carbonate minerals with degassing. The sparging experiment confirms the effect of CO(2) degassing by showing a steady rise in pH while maintaining constant alkalinity. Factor analysis correlates variations in the major ion composition (about 17%) to changes in the pumping regime and to aquifer chemistry variations due to cation exchange reactions with argillaceous minerals. An effective CSG water sampling program can be put into practice by measuring pH at the wellhead and alkalinity at the laboratory; these data can later be used to calculate the carbonate speciation at the time the sample was collected. In addition, TDS variations can be reduced considerably if a correct drying temperature of 180 °C is consistently implemented. PMID:23199455

  12. Comparative study of the chemical composition of essential oils of five Tagetes species collected in Venezuela.

    PubMed

    Armas, Kaylin; Rojas, Janne; Rojas, Luis; Morales, Antonio

    2012-09-01

    The leaves and inflorescences of five species of Tagetes, family Asteraceae, were collected from different locations in Mérida state, Venezuela, and their essential oils analyzed by GC and GC/MS. Several differences were observed in the composition of these oils, mainly regarding the major components, which for T. caracasana were trans-ocimenone (64.3%) and cis-tagetone (13.7%), and for T. erecta, piperitone (35.9%) and terpinolene (22.2%). High amounts of trans-anethole (87.5%) and estragole (10.7%) were observed in T. filifolia, while T. subulata essential oil contained terpinolene (26.0%), piperitenone (13.1%) and limonene (10.8%). For T. patula, two different oil samples were analyzed, leaves (TPL) and inflorescences (TPI). The TPL oil showed terpinolene (20.9%) and piperitenone (14.0%) as main components, while the TPI sample was composed mainly of beta-caryophyllene (23.7%), terpinolene (15.6%) and cis-beta-ocimene (15.5%). PMID:23074915

  13. A review of class I and class II pet food recalls involving chemical contaminants from 1996 to 2008.

    PubMed

    Rumbeiha, Wilson; Morrison, Jamie

    2011-03-01

    Commercial pet food in USA is generally safe, but adulteration does occur. Adulterated food has to be recalled to protect pets and public health. All stakeholders, including food firms, distributors, and government agencies such as the Food and Drug Administration (FDA) participate in food recall. The objective of this review is to describe the pet food recall procedure from start to finish, and to review class I and II pet food recalls from 1996 to 2008, with a specific focus on those due to chemical contaminants/adulterants. Information was requested from the FDA by Freedom of Information Act. Only those recalls backed by the FDA scientific review were considered. The legal framework for food recalls in the Code of Federal Regulations, Title 21, Chapter 1, Part 7 and in the Food and Drug Administration Amendments Act of 2007, Title X was reviewed. From 1996 to 2008, there were a total of 22 class I and II pet food recalls. Of these, only six (27%) were due to chemical adulterants. The adulterants were aflatoxins, cholecalciferol, methionine, and melamine, and cyanuric acid. The causes of adulteration included inadequate testing of raw materials for toxins, use of wrong or faulty mixing equipment, and misformulation of raw materials. Overall, pet food manufactured in the USA is safe. Even with shortcomings in the recall process, the incidence of illness associated with pet food adulteration is low. Added changes can only make the system better in the future to safeguard pet and public safety. PMID:21125435

  14. A review of class I and class II pet food recalls involving chemical contaminants from 1996 to 2008.

    TOXLINE Toxicology Bibliographic Information

    Rumbeiha W; Morrison J

    2011-03-01

    Commercial pet food in USA is generally safe, but adulteration does occur. Adulterated food has to be recalled to protect pets and public health. All stakeholders, including food firms, distributors, and government agencies such as the Food and Drug Administration (FDA) participate in food recall. The objective of this review is to describe the pet food recall procedure from start to finish, and to review class I and II pet food recalls from 1996 to 2008, with a specific focus on those due to chemical contaminants/adulterants. Information was requested from the FDA by Freedom of Information Act. Only those recalls backed by the FDA scientific review were considered. The legal framework for food recalls in the Code of Federal Regulations, Title 21, Chapter 1, Part 7 and in the Food and Drug Administration Amendments Act of 2007, Title X was reviewed. From 1996 to 2008, there were a total of 22 class I and II pet food recalls. Of these, only six (27%) were due to chemical adulterants. The adulterants were aflatoxins, cholecalciferol, methionine, and melamine, and cyanuric acid. The causes of adulteration included inadequate testing of raw materials for toxins, use of wrong or faulty mixing equipment, and misformulation of raw materials. Overall, pet food manufactured in the USA is safe. Even with shortcomings in the recall process, the incidence of illness associated with pet food adulteration is low. Added changes can only make the system better in the future to safeguard pet and public safety.

  15. Hygroscopic and Chemical Properties of Aerosols collected near a Copper Smelter: Implications for Public and Environmental Health

    PubMed Central

    Sorooshian, Armin; Csavina, Janae; Shingler, Taylor; Dey, Stephen; Brechtel, Fred J.; Sáez, A. Eduardo; Betterton, Eric A.

    2012-01-01

    Particulate matter emissions near active copper smelters and mine tailings in the southwestern United States pose a potential threat to nearby environments owing to toxic species that can be inhaled and deposited in various regions of the body depending on the composition and size of the particles, which are linked by particle hygroscopic properties. This study reports the first simultaneous measurements of size-resolved chemical and hygroscopic properties of particles next to an active copper smelter and mine tailings by the towns of Hayden and Winkelman in southern Arizona. Size-resolved particulate matter samples collected near an active copper smelter were examined with inductively coupled plasma mass spectrometry, ion chromatography, and a humidified tandem differential mobility analyzer. Aerosol particles collected at the measurement site are enriched in metals and metalloids (e.g. arsenic, lead, and cadmium) and water-uptake measurements of aqueous extracts of collected samples indicate that the particle diameter range of particles most enriched with these species (0.18–0.55 µm) overlaps with the most hygroscopic mode at a relative humidity of 90% (0.10–0.32 µm). These measurements have implications for public health, microphysical effects of aerosols, and regional impacts owing to the transport and deposition of contaminated aerosol particles. PMID:22852879

  16. Bacterial mutagenicity and chemical analysis of polycyclic aromatic hydrocarbons and some nitro derivatives in environmental samples collected in West Germany

    SciTech Connect

    Garner, R.C.; Stanton, C.A.; Martin, C.N.; Chow, F.L.; Thomas, W.; Hubner, D.; Herrmann, R.

    1986-01-01

    Snow and air particulate samples collected in Upper Frankonia, Federal Republic of Germany, have been analyzed for nitro-polycyclic aromatic hydrocarbons (PAH) and PAH content. A novel clean-up technique has been developed enabling interfering organochlorine environmental contaminants to be removed prior to analysis of the hydrocarbons by GC-MS. Mass fragmentation patterns are presented for 1-nitropyrene, 6-nitrobenzo(a)pyrene, 6-nitrochrysene, and 3-nitrofluoranthene. The level of these compounds found in air samples was in the range of 0.2-2.0 ng.m-3 with the exception of 6-nitrobenzo(a)pyrene, which was not detected. This compares with PAH values of between 1 and 6 ng.m-3. The freshly fallen snow sample collected at the side of a motorway had no detectable PAHs or nitro-PAHs. Parallel studies on the bacterial mutagenicity of the collected air samples using Salmonella typhimurium TA98 and TA100 in the presence and absence of aroclor-induced rat liver S9 revealed both direct and indirect activity. Larger numbers of mutants were induced in the presence of S9 than in its absence. The snow sample was devoid of mutagenic activity. These studies show the utility of the biological approach to screen environmental samples prior to expensive and time-consuming chemical analysis.

  17. Atomic Data for Zn II: Improving Spectral Diagnostics of Chemical Evolution in High-redshift Galaxies

    NASA Astrophysics Data System (ADS)

    Kisielius, Romas; Kulkarni, Varsha P.; Ferland, Gary J.; Bogdanovich, Pavel; Som, Debopam; Lykins, Matt L.

    2015-05-01

    Damped Lyα (DLA) and sub-DLA absorbers in quasar spectra provide the most sensitive tools for measuring the element abundances of distant galaxies. The estimation of abundances from absorption lines depends sensitively on the accuracy of the atomic data used. We have started a project to produce new atomic spectroscopic parameters for optical and UV spectral lines using state-of-the-art computer codes employing a very broad configuration interaction (CI) basis. Here we report our results for Zn ii, an ion used widely in studies of the interstellar medium (ISM) as well as DLAs and sub-DLAs. We report new calculations of many energy levels of Zn ii and the line strengths of the resulting radiative transitions. Our calculations use the CI approach within a numerical Hartree-Fock framework. We use both nonrelativistic and quasi-relativistic one-electron radial orbitals. We have incorporated the results of these atomic calculations into the plasma simulation code Cloudy and applied them to a lab plasma and examples of a DLA and a sub-DLA. Our values of the Zn ii λ λ 2026, 2062 oscillator strengths are higher than previous values by 0.10 dex. The Cloudy calculations for representative absorbers with the revised Zn atomic data imply ionization corrections lower than calculated earlier by 0.05 dex. The new results imply that Zn metallicities should be lower by 0.1 dex for DLAs and by 0.13-0.15 dex for sub-DLAs than in past studies. Our results can be applied to other studies of Zn ii in the Galactic and extragalactic ISM.

  18. Chemical and statistical interpretation of sized aerosol particles collected at an urban site in Thessaloniki, Greece.

    PubMed

    Tsitouridou, Roxani; Papazova, Petia; Simeonova, Pavlina; Simeonov, Vasil

    2013-01-01

    The size distribution of aerosol particles (PM0.015-PM18) in relation to their soluble inorganic species and total water soluble organic compounds (WSOC) was investigated at an urban site of Thessaloniki, Northern Greece. The sampling period was from February to July 2007. The determined compounds were compared with mass concentrations of the PM fractions for nano (N: 0.015 < Dp < 0.06), ultrafine (UFP: 0.015 < Dp < 0.125), fine (FP: 0.015 < Dp < 2.0) and coarse particles (CP: 2.0 < Dp < 8.0) in order to perform mass closure of the water soluble content for the respective fractions. Electrolytes were the dominant species in all fractions (24-27%), followed by WSOC (16-23%). The water soluble inorganic and organic content was found to account for 53% of the nanoparticle, 48% of the ultrafine particle, 45% of the fine particle and 44% of the coarse particle mass. Correlations between the analyzed species were performed and the effect of local and long-range transported emissions was examined by wind direction and backward air mass trajectories. Multivariate statistical analysis (cluster analysis and principal components analysis) of the collected data was performed in order to reveal the specific data structure. Possible sources of air pollution were identified and an attempt is made to find patterns of similarity between the different sized aerosols and the seasons of monitoring. It was proven that several major latent factors are responsible for the data structure despite the size of the aerosols - mineral (soil) dust, sea sprays, secondary emissions, combustion sources and industrial impact. The seasonal separation proved to be not very specific. PMID:24007436

  19. Physico-chemical studies in the removal of Sr(II) from aqueous solutions using activated sericite.

    PubMed

    Lalhmunsiama; Tiwari, Diwakar; Lee, Seung-Mok

    2015-09-01

    Sericite, a mica based natural clay, was annealed at 800 °C for 4 h followed by acid activation using 3.0 mol/L of HCl at 100 °C in order to obtain activated sericite (AS). The activation of sericite causes a significant increase in specific surface area. Further, SEM images of the AS showed a disordered and heterogeneous surface structure with mesopores on its surface whereas the pristine sericite possessed a compact layered structure. The materials were further employed in the removal of Sr(II) from aqueous solutions in a batch reactor system. Removal of Sr(II) was studied as a function of pH, concentration of adsorbate, contact time, background electrolyte concentrations and dose of adsorbents using pristine sericite and AS. The removal of Sr(II) was favoured increasing the pH of the solution and the extent of Sr(II) removal was increased with increasing the sorbate concentration. Equilibrium sorption data obtained with pristine sericite were fitted well to Langmuir adsorption isotherm whereas the sorption data collected using AS better fitted to the Freundlich adsorption isotherm. The time dependence sorption data showed that the uptake of Sr(II) was very rapid and an apparent sorption equilibrium was achieved within 30 min and 60 min of contact for sericite and AS, respectively. The kinetic data were modelled to the pseudo-first order and pseudo-second order rate kinetics and sorption capacities as well as rate constants were evaluated. Increase in background electrolyte concentrations NaNO3 (0.001-0.1 mol/L) indicated that the presence of NaNO3 caused to decrease the percent removal of Sr(II) by sericite and AS. Furthermore, fixed-bed column reactor operations were performed to obtain the breakthrough data. The breakthrough data were fitted well to the non-linear Thomas equation. Therefore, the present study suggested that AS can be adequately applied for the removal of Sr(II) from the aquatic environment. PMID:26048059

  20. Variations of chemical components in fossil corals collected from Tahiti by IODP Expedition 310

    NASA Astrophysics Data System (ADS)

    Inoue, M.; Harada, M.; Suzuki, A.; Tanimizu, M.; Tokoyama, Y.

    2008-12-01

    Integrated Ocean Drilling Program (IODP) Expedition 310 to the reef terraces around Tahiti, French Polynesia was conducted for the purpose of establishing the course of postglacial sea level rise at Tahiti and to define sea-surface temperature (SST) and marine environmental variation for the region over the period 20-10 ka. While sea-level during the Last Glacial Maximum (LGM) has been observed as much as ca. 130 m below its present value for sites remote from former ice sheet (far-field sites), fossil coral records contain evidence of a dramatic sea level rise in excess 20 m within the last deglaciation around 14 ka, termed meltwater pulse 1A (mwp-1A). Although this event would have had a significant effect on global climate, the relationship between mwp-1A and the climate system remains a subject of debate. Coral geochemistry has a potential as proxies for marine environments, and in this study we measured trace elements, such as Ba, U and Cd, in addition to Pb isotope ratios in fossil Porites sp. collected around Tahiti in order to reconstruct SST, upwelling and/or wind source/direction. Skeletal conditions of fossil corals were investigated using X-ray diffraction and we selected samples composed of only aragonite. Dating of fossil corals were determined based on 14C method by accelerator mass spectrometry. As a result, approximately 10 samples were from before and in the period of mwp-1A event (15 - 14 ka). Then bulk samples were taken from all coral specimens by a milling machine and trace elements and Pb isotopic compositions in bulk samples were analyzed by inductively coupled mass spectrometer (ICP-MS) and multiple-collector ICP-MS, respectively. Data of Pb isotope ratios in fossil corals were comparable with those from crust in the Central Andes, suggesting that easterly wind was predominant around Tahiti with a slight variation depending on the age. We will also discuss the relationship between upwelling and climate condition around the mwp-1A based on Cd contents and U/Ca ratios.

  1. PERFORMANCE OF NORTH AMERICAN BIOREACTOR LANDFILLS: II. CHEMICAL AND BIOLOGICAL CHARACTERISTICS

    EPA Science Inventory

    The objective of this research was to examine the performance of five North American bioreactor landfills. This paper represents the second of a two part series and addresses biological and chemical aspects of bioreactor performance including gas production and management, and l...

  2. Test driving ToxCast: endocrine profiling for1858 chemicals included in phase II

    EPA Science Inventory

    Introduction: Identifying chemicals to test for potential endocrine disruption beyond those already implicated in the peer-reviewed literature is a challenge. This review is intended to help by summarizing findings from the Environmental Protection Agencys (EPA) ToxCast high th...

  3. CHEMICALLY ACTIVE FLUID BED FOR SOX CONTROL: VOLUME II. SPENT SORBENT PROCESSING FOR DISPOSAL/UTILIZATION

    EPA Science Inventory

    The report describes the processing of spent calcium-based sulfur sorbents (limestones or dolomites) from an atmospheric-pressure, chemically active fluid bed (CAFB) gasification process, using a regenerative sulfur sorbent process that produces low- to intermediate-Btu gas. Data...

  4. ACCURACY OF PESTICIDE REFERENCE STANDARD SOLUTIONS. PART II. CHEMICAL STABILITY UNDER FOUR STORAGE CONDITIONS

    EPA Science Inventory

    A study was undertaken to assess the long-term chemical stability of dilute standard pesticide solutions of 4 compound classes. The solutions were studied under 4 storage conditions: freezer at -15C; refrigerator at 3C; ambient temperature in the dark; and ambient temperature on ...

  5. Iso-chemical potential trajectories in the P-T plane for He II

    NASA Technical Reports Server (NTRS)

    Maytal, B.; Nissen, J. A.; Van Sciver, S. W.

    1990-01-01

    Trajectories of constant chemical potential in the P-T plane serve as an integral formulation of London's equation. The trajectories are useful for analysis and synthesis of fountain effect pump performance. A family of trajectories is generated from available numerical codes.

  6. Four-Year Summary, Educational and Commercial Utilization of a Chemical Information Center, Part II.

    ERIC Educational Resources Information Center

    Schipma, Peter B., Ed.

    The major objective of the Illinois Institute of Technology Retrieval Institute (IITRI) Computer Search Center (CSC) is to educate and link industry, academia, and government institutions to chemical and other scientific information systems and sources. The CSC is in full operation providing services to users from a variety of machine-readable…

  7. Development of a benchtop baking method for chemically leavened crackers. II. Validation of the method

    Technology Transfer Automated Retrieval System (TEKTRAN)

    A benchtop baking method has been developed to predict the contribution of gluten functionality to overall flour performance for chemically leavened crackers. Using a diagnostic formula and procedure, dough rheology was analyzed to evaluate the extent of gluten development during mixing and machinin...

  8. Test driving ToxCast: endocrine profiling for1858 chemicals included in phase II

    EPA Science Inventory

    Introduction: Identifying chemicals to test for potential endocrine disruption beyond those already implicated in the peer-reviewed literature is a challenge. This review is intended to help by summarizing findings from the Environmental Protection Agency’s (EPA) ToxCast™ high th...

  9. Review of chemical-kinetic problems of future NASA missions, II: Mars entries

    NASA Technical Reports Server (NTRS)

    Park, Chul; Howe, John T.; Jaffe, Richard L.; Candler, Graham V.

    1994-01-01

    The present work aims to derive a set of thermomechanical relaxation rate parameters and chemical reaction rate coefficients relevant to future interplanetary missions. It also attempts to assess the impact of thermochemical nonequilibrium phenomena on radiative heating rates for the stagnation point of the Martian entry vehicle.

  10. PRELIMINARY ASSESSMENTS OF IN VITRO PHARMACOKINETIC DATA AND EXPOSURE INFORMATION FOR THE TOXCAST PHASE II CHEMICALS

    EPA Science Inventory

    Momentum has been growing in Toxicology to assess the utility of high-throughput screening (HTS) assays in the determination of chemical testing priorities. However, in vitro potencies determined in these assays do not consider in vivo bioavailability, clearance or exposure estim...

  11. Theory of chemical bonds in metalloenzymes II: Hybrid-DFT studies in iron-sulfur clusters

    NASA Astrophysics Data System (ADS)

    Shoji, M.; Koizumi, K.; Kitagawa, Y.; Yamanaka, S.; Kawakami, T.; Okumura, M.; Yamaguchi, K.

    Important chemical reactions for life often require multistep electron transfers (ET) and strong reducing forces. In these reactions, electron transfer proteins as ferredoxins (Fds) play a key role. For elucidation of the core electronic states in these electron transfer processes, an inorganic model compound [Fe2S2(S2-o-xyl)2] is used as our first study. It was experimentally characterized that the model compound is in a similar electronic state to the active site core in Fds. On the reduced form, the diiron core exists in a characteristic mixed-valence state that has mobile electron (spin). Hybrid density functional theory (HDFT) calculations are performed to investigate the chemical bond nature, electronic structures, and magnetic interactions. The spin states and energy levels are further discussed with spin Hamiltonians, which contain Heisenberg exchange term and double exchange term to describe the mixed-valence state. We have determined their effective exchange integrals (J) and resonance parameters (B) from (HDFT) calculations in several procedures. These magnetic interactions are in good agreement with experiments. To estimate B values, we propose a new procedure using molecular orbital energies. The B values are properly evaluated compared with other procedures, using total energies. The chemical bond natures and the ground electronic structures are elucidated in terms of chemical indices defined by the occupation number of natural orbitals. Finally, implications of the computational results are discussed in relation to rational design of biomolecular devices.

  12. [Chemical composition of fresh bee pollen collected in the Misintá páramo from the Venezuelan Andes].

    PubMed

    Vit, Patricia; Santiago, B

    2008-12-01

    Venezuelan bee pollen has not been characterized, and marketing is not regulated. Pollen is consumed for apitherapeutical purposes for its nutritional and medicinal properties. This product of the hive is the most popular after honey; therefore it is necessary to characterize and to value it to initiate a database to support the proposal of a norm for bee pollen quality control. Samples of bee pollen collected by bees in the Misintá páramo of Mérida state were characterized accoridng to the chemical composition (moisture, ash, fat, pH, proteins) of four color fractions (yellow, orange, ochre, green). Yellow pollen was the most frequent fraction, with 2.18 g ash/100 g, 5.37 g ether extract/100 g, 14.88 g moisture/100 g, and 37.32 g proteins/100 g. PMID:19368304

  13. New integration techniques for chemical kinetic rate equations. II - Accuracy comparison

    NASA Technical Reports Server (NTRS)

    Radhakrishnan, K.

    1986-01-01

    A comparison of the accuracy of several techniques recently developed for solving stiff differential equations is presented. The techniques examined include two general purpose codes EEPISODE and LSODE developed for an arbitrary system of ordinary differential equations, and three specialized codes CHEMEQ, CREKID, and GCKP84 developed specifically to solve chemical kinetic rate equations. The accuracy comparisons are made by applying these solution procedures to two practical combustion kinetics problems. Both problems describe adiabatic, homogeneous, gas phase chemical reactions at constant pressure, and include all three combustion regimes: induction heat release, and equilibration. The comparisons show that LSODE is the most efficient code - in the sense that it requires the least computational work to attain a specified accuracy level. An important finding is that an iterative solution of the algebraic enthalpy conservation equation for the temperature can be more accurate and efficient than computing the temperature by integrating its time derivative.

  14. Exclusion of cosmic rays in protoplanetary disks. II. Chemical gradients and observational signatures

    SciTech Connect

    Cleeves, L. Ilsedore; Bergin, Edwin A.; Adams, Fred C.

    2014-10-20

    The chemical properties of protoplanetary disks are especially sensitive to their ionization environment. Sources of molecular gas ionization include cosmic rays (CRs), stellar X-rays, and short-lived radionuclides, each of which varies with location in the disk. This behavior leads to a significant amount of chemical structure, especially in molecular ion abundances, which is imprinted in their submillimeter rotational line emission. Using an observationally motivated disk model, we make predictions for the dependence of chemical abundances on the assumed properties of the ionizing field. We calculate the emergent line intensity for abundant molecular ions and simulate sensitive observations with the Atacama Large Millimeter/Sub-millimeter Array (ALMA) for a disk at D = 100 pc. The models readily distinguish between high ionization rates (ζ ≳ 10{sup –17} s{sup –1} per H{sub 2}) and below, but it becomes difficult to distinguish between low ionization models when ζ ≲ 10{sup –19} s{sup –1}. We find that H{sub 2}D{sup +} emission is not detectable for sub-interstellar CR rates with ALMA (6h integration), and that N{sub 2}D{sup +} emission may be a more sensitive tracer of midplane ionization. HCO{sup +} traces X-rays and high CR rates (ζ{sub CR} ≳ 10{sup –17} s{sup –1}), and provides a handle on the warm molecular ionization properties where CO is present in the gas. Furthermore, species like HCO{sup +}, which emits from a wide radial region and samples a large gradient in temperature, can exhibit ring-like emission as a consequence of low-lying rotational level de-excitation near the star. This finding highlights a scenario where rings are not necessarily structural or chemical in nature, but simply a result of the underlying line excitation properties.

  15. Seasonal variation of water-soluble chemical components in the bulk atmospheric aerosols collected at Okinawa Island, Japan

    NASA Astrophysics Data System (ADS)

    Handa, D.; Nakajima, H.; Nakaema, F.; Arakaki, T.; Tanahara, A.

    2008-12-01

    The economic development and population growth in recent Asia spread air pollution. Emission rate of air pollutants from Asia, in particular oxides of nitrogen, surpassed those from North America and Europe and should continue to exceed them for decades. The study of the air pollution transported from Asian continent has gained a special attention in Japan. Okinawa Island is situated approximately 1500 km south of Tokyo, Japan, 2000 km southeast of Beijing, China, and 1000 km south of South Korea. Its location is ideal in observing East Asian atmospheric aerosols because maritime air mass prevails during summer, while continental air mass dominates during fall, winter, and spring. The maritime air mass data can be seen as background and can be compared with continental air masses which have been affected by anthropogenic activities. In 2005, Cape Hedo Atmosphere and Aerosol Monitoring Station (CHAAMS) was established by the National Institute for Environmental Studies (NIES) at the northern tip of Okinawa Island, Japan to monitor the air quality of Asia. Bulk aerosol samples were collected on quartz filters by using a high volume air sampler. Sampling duration was one week for each sample. We determined the concentrations of water-soluble anions, cations and dissolved organic carbon in the bulk aerosols collected at the CHAAMS, using ion chromatography, atomic absorption spectrometry, and total organic carbon analyzer, respectively. Seasonal variation of water-soluble chemical components showed that the concentrations were relatively low in summer, higher in fall and winter, and the highest in spring. When air mass came from Asian Continent, the concentrations of water-soluble chemical components were much higher compared to the other directions.

  16. Chemical analysis of CH stars - II. Atmospheric parameters and elemental abundances

    NASA Astrophysics Data System (ADS)

    Karinkuzhi, Drisya; Goswami, Aruna

    2015-01-01

    We present detailed chemical analyses for a sample of 12 stars selected from the CH star catalogue of Bartkevicius. The sample includes two confirmed binaries, four objects that are known to show radial velocity variations and the rest with no information on the binary status. A primary objective is to examine if all these objects exhibit chemical abundances characteristics of CH stars, based on detailed chemical composition study using high-resolution spectra. We have used high-resolution (R 42 000) spectra from the ELODIE archive. These spectra cover 3900 to 6800 in the wavelength range. We have estimated the stellar atmospheric parameters, the effective temperature Teff, the surface gravity log g, and metallicity [Fe/H] from local thermodynamic equilibrium analysis using model atmospheres. Estimated temperatures of these objects cover a wide range from 4200 to 6640 K, the surface gravity from 0.6 to 4.3 and metallicity from -0.13 to -1.5. We report updates on elemental abundances for several heavy elements, Sr, Y, Zr, Ba, La, Ce, Pr, Nd, Sm, Eu and Dy. For the object HD 89668, we present the first abundance analyses results. Enhancement of heavy elements relative to Fe, a characteristic property of CH stars is evident from our analyses in the case of four objects, HD 92545, HD 104979, HD 107574 and HD 204613. A parametric-model-based study is performed to understand the relative contributions from the s- and r-process to the abundances of the heavy elements.

  17. STUDIES ON ISOLATED NUCLEI. II. ISOLATION AND CHEMICAL CHARACTERIZATION OF NUCLEOLAR AND NUCLEOPLASMIC SUBFRACTIONS.

    PubMed

    MAGGIO, R; SIEKEVITZ, P; PALADE, G E

    1963-08-01

    This paper describes the subfractionation of nuclei isolated from guinea pig liver by the procedure presented in the first article of the series (8). Centrifugation in a density gradient system of nuclear fractions disrupted by sonication permits the isolation of the following subfractions: (a) a nucleolar subfraction which consists mainly of nucleoli surrounded by a variable amount of nucleolus-associated chromatin and contaminated by chromatin blocks derived primarily from von Kupffer cell nuclei; (b) and (c), two nucleoplasmic subfractions (I and II) which consist mainly of chromatin threads in a coarser (I) or finer (II) degree of fragmentation. The protein, RNA, and DNA content of these subfractions was determined, and their RNA's characterized in terms of NaCl-solubility, nucleotide composition, and in vivo nucleotide turnover, using inorganic (32)P as a marker. The results indicate that there are at least three types of RNA in the nucleus (one in the nucleolus and two in the nucleoplasm or chromatin), which differ from one another in NaCl-solubility, nucleotide composition, turnover, and possibly sequence. Possible relations among these RNA's and those of the cytoplasm are discussed. PMID:14079490

  18. Removal of cadmium(II) from aqueous solutions by chemically modified maize straw.

    PubMed

    Guo, Hong; Zhang, Shufen; Kou, Zinong; Zhai, Shangru; Ma, Wei; Yang, Yi

    2015-01-22

    A new regenerable adsorbent was successfully prepared by modifying maize straw (MS) with succinic anhydride in xylene. The succinylated-maize straw (S-MS) was characterized by FTIR, solid-state MAS (13)C NMR spectroscopy, SEM-EDX and point of zero charge analysis. NaS-MS was successfully obtained after deprotonating the carboxylic acid groups of S-MS by Na2CO3 solution. Batch experiments were carried out with NaS-MS for the removal of Cd(II). The effects of pH, adsorbent dosage, contact time, initial concentration and temperature were investigated. The experimental data were best described by a pseudo-second-order kinetics and Langmuir adsorption models. Thermodynamic parameters (ΔG, ΔH, and ΔS) were also calculated from data obtained from experiments performed to study the effect of temperatures. NaS-MS could be regenerated at least five times in saturated NaCl solution without any loss. Furthermore, ∼97% of adsorbed Cd(II) ions could be recovered as the metal oxide. Finally, the adsorption mechanism of NaS-MS was discussed. PMID:25439883

  19. Chemical evolution of dehydrogenases: Amino acid pentacyanoferrate (II) as possible intermediates

    NASA Astrophysics Data System (ADS)

    Kamaluddin; Nath, Mala; Deopujari, Sushama W.

    1989-03-01

    Dehydrogenation of ascorbic acid and reduced nicotinamide adenine dinucleotide (NADH) with methylene blue using complexes of the type [Fe(II)(CN)5 (L)] n- (wheren=3 or 4; L=glycine, histidine, imidazole, and triglycine) as catalyst have been studied at pH 9.18. Similar kinetic behavior was observed for the dehydrogenation of ascorbic acid as well as for NADH; both reactions showed first order dependency on the substrates. First order dependence was observed only at lower concentrations of methylene blue; at higher concentrations of methylene blue, the reactions were independent of methylene blue. The order with respect to catalyst varied between 0.3 0.5. A tentative mechanism which conforms to the observed kinetics has been proposed. It is believed that on the primitive earth when the reducing potential of the atmosphere was not high enough, lower oxidation state iron complexes like [Fe(II)(CN)5(L)] n- might have been involved in dehydrogenase-type activity.

  20. Chemical Abundances in the Stellar Populations of the Leo I and Leo II dSph Galaxies

    NASA Astrophysics Data System (ADS)

    Bosler, T. L.; Smecker-Hane, T. A.; Stetson, P. B.

    2002-05-01

    Our goal is to map the chemical abundance distribution of the stellar populations of the Leo I and Leo II dwarf spheroidal (dSph) galaxies to constrain the physical processes that regulate their evolution. The dSphs are particularly interesting galaxies because their star formation histories (SFHs) appear to be much more complicated than theory would predict for such low mass, low luminosity, low surface-brightness galaxies. Color-magnitude diagrams (CMDs) of these dSphs have shown that they formed stars over many Gyr. In order to understand the true spread in stellar ages and chemical abundances we need more precise abundance indicators than can be inferred from CMD analysis: abundances based upon the broad-band colors of red giants are subject to large systematic errors because of limitations in convection theory, and poorly determined color--effective temperature relations produce sizable uncertainties in the derived shapes of theoretical red giant branches. Therefore we are measuring the abundance distribution of the Leo I and Leo II dSphs from spectroscopy of individual red giant stars using the Ca II absorption lines in the near infrared (8498, 8542, and 8662 Å). Our observations are made on the Keck I 10-meter Telescope using the Low Resolution Imaging Spectrometer. One night of successful observations yielded spectra of approximately 40 stars in each dSph from which abundances with random uncertainties of ≈ 0.1 dex will be derived. Calibration of the Ca II strengths to [Fe/H] has been done by Rutledge, et al. (1997, PASP, 109, 907) using Galactic globular clusters. We are also deriving a new calibration for [Ca/H]. This new calibration will remove the dependence on SFH built into the Rutledge, et al. calibration, i.e., the assumptions of a unique age for the system and a Galactic [Ca/Fe]--[Fe/H] relationship. Financial support for this project was provided by NSF grant AST-0070985 to TSH, and an ARCS Foundation fellowship to TB.

  1. PKC-α-dependent augmentation of cAMP and CREB phosphorylation mediates the angiotensin II stimulation of renin in the collecting duct.

    PubMed

    Gonzalez, Alexis A; Liu, Liu; Lara, Lucienne S; Bourgeois, Camille R T; Ibaceta-Gonzalez, Cristobal; Salinas-Parra, Nicolas; Gogulamudi, Venkateswara R; Seth, Dale M; Prieto, Minolfa C

    2015-11-15

    In contrast to the negative feedback of angiotensin II (ANG II) on juxtaglomerular renin, ANG II stimulates renin in the principal cells of the collecting duct (CD) in rats and mice via ANG II type 1 (AT1R) receptor, independently of blood pressure. In vitro data indicate that CD renin is augmented by AT1R activation through protein kinase C (PKC), but the exact mechanisms are unknown. We hypothesize that ANG II stimulates CD renin synthesis through AT1R via PKC and the subsequent activation of cAMP/PKA/CREB pathway. In M-1 cells, ANG II increased cAMP, renin mRNA (3.5-fold), prorenin, and renin proteins, as well as renin activity in culture media (2-fold). These effects were prevented by PKC inhibition with calphostin C, PKC-α dominant negative, and by PKA inhibition. Forskolin-induced increases in cAMP and renin expression were prevented by calphostin C. PKC inhibition and Ca2+ depletion impaired ANG II-mediated CREB phosphorylation and upregulation of renin. Adenylate cyclase 6 (AC) siRNA remarkably attenuated the ANG II-dependent upregulation of renin mRNA. Physiological activation of AC with vasopressin increased renin expression in M-1 cells. The results suggest that the ANG II-dependent upregulation of renin in the CD depends on PKC-α, which allows the augmentation of cAMP production and activation of PKA/CREB pathway via AC6. This study defines the intracellular signaling pathway involved in the ANG II-mediated stimulation of renin in the CD. This is a novel mechanism responsible for the regulation of local renin-angiotensin system in the distal nephron. PMID:26268270

  2. Hygroscopic and chemical properties of aerosols collected near a copper smelter: implications for public and environmental health.

    PubMed

    Sorooshian, Armin; Csavina, Janae; Shingler, Taylor; Dey, Stephen; Brechtel, Fred J; Sáez, A Eduardo; Betterton, Eric A

    2012-09-01

    Particulate matter emissions near active copper smelters and mine tailings in the southwestern United States pose a potential threat to nearby environments owing to toxic species that can be inhaled and deposited in various regions of the body depending on the composition and size of the particles, which are linked by particle hygroscopic properties. This study reports the first simultaneous measurements of size-resolved chemical and hygroscopic properties of particles next to an active copper smelter and mine tailings by the towns of Hayden and Winkelman in southern Arizona. Size-resolved particulate matter samples were examined with inductively coupled plasma mass spectrometry, ion chromatography, and a humidified tandem differential mobility analyzer. Aerosol particles collected at the measurement site are enriched in metals and metalloids (e.g., arsenic, lead, and cadmium) and water-uptake measurements of aqueous extracts of collected samples indicate that the particle diameter range of particles most enriched with these species (0.18-0.55 μm) overlaps with the most hygroscopic mode at a relative humidity of 90% (0.10-0.32 μm). These measurements have implications for public health, microphysical effects of aerosols, and regional impacts owing to the transport and deposition of contaminated aerosol particles. PMID:22852879

  3. Chemical variation in molecular cloud cores in the Orion A cloud. II.

    NASA Astrophysics Data System (ADS)

    Tatematsu, Ken'ichi; Ohashi, Satoshi; Umemoto, Tomofumi; Lee, Jeong-Eun; Hirota, Tomoya; Yamamoto, Satoshi; Choi, Minho; Kandori, Ryo; Mizuno, Norikazu

    2014-02-01

    We have mapped six molecular cloud cores in the Orion A giant molecular cloud (GMC), whose kinetic temperatures range from 10 to 30 K, in CCS and N2H+ with the Nobeyama 45 m radio telescope to study their chemical characteristics. We identified 31 intensity peaks in the CCS and N2H+ emission in these molecular cloud cores. We found, for cores with temperatures lower than ˜ 25 K, that the column density ratio of N(N2H+)/N(CCS) is low toward starless core regions while it is high toward star-forming core regions, in cases where we detected both the CCS and N2H+ emission. This is very similar to the tendency found in dark clouds (kinetic temperature ˜ 10 K). The criterion found in the Orion A GMC is N(N2H+)/N(CCS) ˜ 2-3. In some cases, both CCS and N2H+ emission is detected toward protostars. A secondary late-stage CCS peak in the chemical evolution caused by CO depletion may be a possible explanation for this. We found that the chemical variation of CCS and N2H+ can also be used as a tracer of evolution in warm (10-25 K) GMC cores. On the other hand, some protostars do not accompany N2H+ intensity peaks but are associated with dust continuum emitting regions, suggesting that the N2H+ abundance might be decreased due to CO evaporation in warmer star-forming sites.

  4. Physical and chemical properties of Red MSX Sources in the southern sky: H II regions

    NASA Astrophysics Data System (ADS)

    Yu, Naiping; Wang, Jun-Jie; Li, Nan

    2015-01-01

    We have studied the physical and chemical properties of 18 southern Red Midcourse Space Experiment Sources (RMSs), using archival data taken from the Atacama Pathfinder Experiment (APEX) Telescope Large Area Survey of the Galaxy, the Australia Telescope Compact Array, and the Millimeter Astronomy Legacy Team Survey at 90 GHz. Most of our sources have simple cometary/unresolved radio emissions at 4.8 and/or 8.6GHz. The large number of Lyman continuum fluxes (NL) indicates they are probably massive O- or early B-type star formation regions. Archival IRAS infrared data are used to estimate the dust temperature, which is about 30 K of our sources. Then, the H2 column densities and the volume-averaged H2 number densities are estimated using the 870 μm dust emissions. Large-scale infall and ionized accretions may be occurring in G345.4881+00.3148. We also attempt to characterize the chemical properties of these RMSs through molecular line (N2H+ (1-0) and HCO+ (1-0)) observations. Most of the detected N2H+ and HCO+ emissions match well with the dust emission, implying a close link to their chemical evolution in the RMSs. We found that the abundance of N2H+ is one order of magnitude lower than that in other surveys of infrared dark clouds, and a positive correlation between the abundances of N2H+ and HCO+. The fractional abundance of N2H+ with respect to H2 seems to decrease as a function of NL. These observed trends could be interpreted as an indication of enhanced destruction of N2H+, either by CO or through dissociative recombination with electrons produced by central UV photons.

  5. On the validity of 3D polymer gel dosimetry: II. Physico-chemical effects

    NASA Astrophysics Data System (ADS)

    Vandecasteele, Jan; De Deene, Yves

    2013-01-01

    This study quantifies some major physico-chemical factors that influence the validity of MRI (PAGAT) polymer gel dosimetry: temperature history (pre-, during and post-irradiation), oxygen exposure (post-irradiation) and volumetric effects (experiment with phantom in which a small test tube is inserted). Present results confirm the effects of thermal history prior to irradiation. By exposing a polymer gel sample to a linear temperature gradient of ˜2.8 °C cm-1 and following the dose deviation as a function of post-irradiation time new insights into temporal variations were added. A clear influence of the temperature treatment on the measured dose distribution is seen during the first hours post-irradiation (resulting in dose deviations up to 12%). This effect diminishes to 5% after 54 h post-irradiation. Imposing a temperature offset (maximum 6 °C for 3 h) during and following irradiation on a series of calibration phantoms results in only a small dose deviation of maximum 4%. Surprisingly, oxygen diffusing in a gel dosimeter up to 48 h post-irradiation was shown to have no effect. Volumetric effects were studied by comparing the dose distribution in a homogeneous phantom compared to the dose distribution in a phantom in which a small test tube was inserted. This study showed that the dose measured inside the test tube was closer to the ion chamber measurement in comparison to the reference phantom without test tube by almost 7%. It is demonstrated that physico-chemical effects are not the major causes for the dose discrepancies encountered in the reproducibility study discussed in the concurrent paper (Vandecasteele and De Deene 2013a Phys. Med. Biol. 58 19-42). However, it is concluded that these physico-chemical effects are important factors that should be addressed to further improve the dosimetric accuracy of 3D MRI polymer gel dosimetry. Both authors contributed equally to this study.

  6. The resonance line of B II in IUE spectra of chemically peculiar stars

    NASA Technical Reports Server (NTRS)

    Leckrone, D. S.

    1981-01-01

    A description is presented of high-dispersion spectroscopic observations of eight chemically peculiar stars including Kappa Cnc and Mu Lep, and of one normal comparison star, Nu Cap, in the vicinity of 1362 A. The reported data were obtained with the International Ultraviolet Explorer during the first 15 months of its operation. The initial reduction of the data, which were originally described in a qualitative summary by Leckrone (1980), was affected by a serious error in the calibration of the instrument's intensity transfer function. This error has been corrected in the currently presented data. The results of spectrum syntheses of the 1362 A feature are also described for several of the stars.

  7. Potential halogenated industrial carcinogenic and mutagenic chemicals. II. Halogenated saturated hydrocarbons.

    PubMed

    Fishbein, L

    1979-03-01

    The halogenated saturated hydrocarbons analogously to the previously considered halogenated unsaturated hydrocarbons (Part I) possess considerable utility in a broad spectrum of applications including; solvents, dry-cleaning fluids, refrigerants, fumigants, degreasing agents, propellants and intermediates in the production of other chemicals, textiles and plastics. Methyl chloride, methylene chloride, chloroform, carbon tetrachloride, methyl chloroform, 1,1,2-trichloroethane, hexachloroethane, ethyl chloride and fluorocarbons were reviewed principally in terms of their synthesis (or occurrence), areas of application, stability, distribution, reactivity, levels of exposure, populations at risk, carcinogenicity, mutagenicity and metabolism. PMID:373115

  8. Preliminary Results of Detailed Chemical Abundance Analysis of Milky Way Satellite Galaxy Reticulum II Discovered in the Dark Energy Survey

    NASA Astrophysics Data System (ADS)

    Nagasawa, Daniel; Marshall, Jennifer L.; Li, Ting; Dark Energy Survey Milky Way Science Group

    2016-01-01

    We present preliminary results from abundance analysis of stars in Milky Way satellite galaxies found in the Dark Energy Survey (DES). DES has discovered 16 candidate satellite galaxies of the Milky Way in its first two years of operation. Since January 2015, three candidates have subsequently been revealed to be dark matter-dominated by spectroscopic follow-up studies of their kinematics, confirming their status as satellite galaxies. Spectroscopic follow-up of the remaining 13 candidates is underway. We have analyzed high resolution VLT/GIRAFFE spectra of member stars in one of these satellite galaxies, Reticulum II. Using equivalent width measurement and spectral synthesis methods, we measure the abundances of Iron and other species in order to begin to understand the chemical content of these Milky Way satellites.

  9. An Observational and Numerical Study of the Nocturnal Sea Breeze. Part II: Chemical Transport.

    NASA Astrophysics Data System (ADS)

    Buckley, Robert L.; Kurzeja, Robert J.

    1997-12-01

    Chemical transport at the Savannah River Site (SRS) in South Carolina during nocturnal sea-breeze passage is examined using simulations from a three-dimensional mesoscale dynamic model [(RAMS) Regional Atmospheric Modeling System] and a Lagrangian particle dispersion model (LPDM) and supplemental surface measurements of sulfur hexafluoride (SF6) obtained during a 1988 field campaign. Plume dispersion and regional transport were characterized by nights with onshore and offshore synoptic winds. For onshore winds, the sea breeze lifts, redirects, and broadens an initially narrow plume but maintains its general structure. Regional calculations reveal particle translations exceeding 100 km under these conditions. On the other hand, with offshore synoptic winds, frontal passage leads to stronger lifting, turbulence, and vertical shearing that fragments the plume. In addition, complicated recirculation of pollutants is possible and may increase chemical concentrations in areas near the source. Observed and model plumes were shown to depend strongly on vertical, horizontal, and temporal wind shear, and vertical motion. These features were simulated by the RAMS and LPDM models but are not possible with Gaussian models. Turbulence and topography also had important effects on plume characteristics but were simulated adequately only in the frontal region. Deficiencies in the model simulation were attributed mainly to insufficient vertical resolution and inadequate resolution of surface features.

  10. Amyloid fibrillation in native and chemically-modified forms of carbonic anhydrase II: role of surface hydrophobicity.

    PubMed

    Es-Haghi, Ali; Shariatizi, Sajad; Ebrahim-Habibi, Azadeh; Nemat-Gorgani, Mohsen

    2012-03-01

    Chemical modification or mutation of proteins may bring about significant changes in the net charge or surface hydrophobicity of a protein structure. Such events may be of major physiological significance and may provide important insights into the genetics of amyloid diseases. In the present study, fibrillation potential of native and chemically-modified forms of bovine carbonic anhydrase II (BCA II) were investigated. Initially, various denaturing conditions including low pH and high temperatures were tested to induce fibrillation. At a low pH of around 2.4, where the protein is totally dissociated, the apo form was found to take up a pre-molten globular (PMG) conformation with the capacity for fibril formation. Upon increasing the pH to around 3.6, a molten globular (MG) form became abundant, forming amorphous aggregates. Charge neutralization and enhancement of hydrophobicity by methylation, acetylation and propionylation of lysine residues appeared very effective in promoting fibrillation of both the apo and holo forms under native conditions, the rates and extents of which were directly proportional to surface hydrophobicity, and influenced by salt concentration and temperature. These modified structures underwent more pronounced fibrillation under native conditions, than the PMG intermediate form, observed under denaturing conditions. The nature of the fibrillation products obtained from intermediate and modified structures were characterized and compared and their possible cytotoxicity determined. Results are discussed in terms of the importance of surface net charge and hydrophobicity in controlling protein aggregation. A discussion on the physiological significance of the observations is also presented. PMID:22251892

  11. ANALYSIS OF TWO SMALL MAGELLANIC CLOUD H II REGIONS CONSIDERING THERMAL INHOMOGENEITIES: IMPLICATIONS FOR THE DETERMINATIONS OF EXTRAGALACTIC CHEMICAL ABUNDANCES

    SciTech Connect

    Pena-Guerrero, Maria A.; Peimbert, Antonio; Peimbert, Manuel; Ruiz, Maria Teresa E-mail: antonio@astroscu.unam.mx E-mail: mtruiz@das.uchile.cl

    2012-02-20

    We present long-slit spectrophotometry considering the presence of thermal inhomogeneities (t{sup 2}) of two H II regions in the Small Magellanic Cloud (SMC): NGC 456 and NGC 460. Physical conditions and chemical abundances were determined for three positions in NGC 456 and one position in NGC 460, first under the assumption of uniform temperature and then allowing for the possibility of thermal inhomogeneities. We determined t{sup 2} values based on three different methods: (1) by comparing the temperature derived using oxygen forbidden lines with the temperature derived using helium recombination lines (RLs), (2) by comparing the abundances derived from oxygen forbidden lines with those derived from oxygen RLs, and (3) by comparing the abundances derived from ultraviolet carbon forbidden lines with those derived from optical carbon RLs. The first two methods averaged t{sup 2} = 0.067 {+-} 0.013 for NGC 456 and t{sup 2} = 0.036 {+-} 0.027 for NGC 460. These values of t{sup 2} imply that when gaseous abundances are determined with collisionally excited lines they are underestimated by a factor of nearly two. From these objects and others in the literature, we find that in order to account for thermal inhomogeneities and dust depletion, the O/H ratio in low-metallicity H II regions should be corrected by 0.25-0.45 dex depending on the thermal structure of the nebula or by 0.35 dex if such information is not available.

  12. Metal-poor dwarf galaxies in the SIGRID galaxy sample. I. H II region observations and chemical abundances

    SciTech Connect

    Nicholls, David C.; Dopita, Michael A.; Sutherland, Ralph S.; Jerjen, Helmut; Kewley, Lisa J.; Basurah, Hassan

    2014-05-10

    In this paper we present the results of observations of 17 H II regions in thirteen galaxies from the SIGRID sample of isolated gas-rich irregular dwarf galaxies. The spectra of all but one of the galaxies exhibit the auroral [O III] 4363 Å line, from which we calculate the electron temperature, T{sub e} , and gas-phase oxygen abundance. Five of the objects are blue compact dwarf galaxies, of which four have not previously been analyzed spectroscopically. We include one unusual galaxy which exhibits no evidence of the [N II] λλ 6548,6584 Å lines, suggesting a particularly low metallicity (< Z {sub ☉}/30). We compare the electron temperature based abundances with those derived using eight of the new strong-line diagnostics presented by Dopita et al. Using a method derived from first principles for calculating total oxygen abundance, we show that the discrepancy between the T{sub e} -based and strong-line gas-phase abundances have now been reduced to within ∼0.07 dex. The chemical abundances are consistent with what is expected from the luminosity-metallicity relation. We derive estimates of the electron densities and find them to be between ∼5 and ∼100 cm{sup –3}. We find no evidence for a nitrogen plateau for objects in this sample with metallicities 0.5 > Z {sub ☉} > 0.15.

  13. Air pollutant concentrations near three Texas roadways, part II: Chemical characterization and transformation of pollutants

    NASA Astrophysics Data System (ADS)

    Clements, Andrea L.; Jia, Yuling; Denbleyker, Allison; McDonald-Buller, Elena; Fraser, Matthew P.; Allen, David T.; Collins, Donald R.; Michel, Edward; Pudota, Jayanth; Sullivan, David; Zhu, Yifang

    Spatial gradients of vehicular emitted air pollutants were measured in the vicinity of three roadways in the Austin, Texas area: (1) State Highway 71 (SH-71), a heavily traveled arterial highway dominated by passenger vehicles; (2) Interstate 35 (I-35), a limited access highway north of Austin in Georgetown; and (3) Farm to Market Road 973 (FM-973), a heavily traveled surface roadway with significant truck traffic. A mobile monitoring platform was used to characterize the gradients of CO and NO x concentrations with increased distance from each roadway, while concentrations of carbonyls in the gas-phase and fine particulate matter mass and composition were measured at stationary sites upwind and at one (I-35 and FM-973) or two (SH-71) downwind sites. Regardless of roadway type or wind direction, concentrations of carbon monoxide (CO), nitric oxide (NO), and oxides of nitrogen (NO x) returned to background levels within a few hundred meters of the roadway. Under perpendicular wind conditions, CO, NO and NO x concentrations decreased exponentially with increasing distance perpendicular to the roadways. The decay rate for NO was more than a factor of two greater than for CO, and it comprised a larger fraction of NO x closer to the roadways than further downwind suggesting the potential significance of near roadway chemical processing as well as atmospheric dilution. Concentrations of most carbonyl species decreased with distance downwind of SH-71. However, concentrations of acetaldehyde and acrolein increased farther downwind of SH-71, suggesting chemical generation from the oxidation of primary vehicular emissions. The behavior of particle-bound organic species was complex and further investigation of the size-segregated chemical composition of particulate matter (PM) at increasing downwind distances from roadways is warranted. Fine particulate matter (PM 2.5) mass concentrations, polycyclic aromatic hydrocarbons (PAHs), hopanes, and elemental carbon (EC) concentrations generally exhibited concentrations that decreased with distance downwind of SH-71. Concentrations of organic carbon (OC) increased from upwind concentrations immediately downwind of SH-71 and continued to increase further downwind from the roadway. This behavior may have primarily resulted from condensation of semi-volatile organic species emitted from vehicle sources with transport downwind of the roadway.

  14. CHEMICAL PROCESSES IN PROTOPLANETARY DISKS. II. ON THE IMPORTANCE OF PHOTOCHEMISTRY AND X-RAY IONIZATION

    SciTech Connect

    Walsh, Catherine; Millar, T. J.; Nomura, Hideko; Aikawa, Yuri

    2012-03-10

    We investigate the impact of photochemistry and X-ray ionization on the molecular composition of, and ionization fraction in, a protoplanetary disk surrounding a typical T Tauri star. We use a sophisticated physical model, which includes a robust treatment of the radiative transfer of UV and X-ray radiation, and calculate the time-dependent chemical structure using a comprehensive chemical network. In previous work, we approximated the photochemistry and X-ray ionization; here, we recalculate the photoreaction rates using the explicit UV wavelength spectrum and wavelength-dependent reaction cross sections. We recalculate the X-ray ionization rate using our explicit elemental composition and X-ray energy spectrum. We find that photochemistry has a larger influence on the molecular composition than X-ray ionization. Observable molecules sensitive to the photorates include OH, HCO{sup +}, N{sub 2}H{sup +}, H{sub 2}O, CO{sub 2}, and CH{sub 3}OH. The only molecule significantly affected by the X-ray ionization is N{sub 2}H{sup +}, indicating that it is safe to adopt existing approximations of the X-ray ionization rate in typical T Tauri star-disk systems. The recalculation of the photorates increases the abundances of neutral molecules in the outer disk, highlighting the importance of taking into account the shape of the UV spectrum in protoplanetary disks. A recalculation of the photoreaction rates also affects the gas-phase chemistry due to the adjustment of the H/H{sub 2} and C{sup +}/C ratios. The disk ionization fraction is not significantly affected by the methods adopted to calculate the photochemistry and X-ray ionization. We determine that there is a probable 'dead zone' where accretion is suppressed, present in a layer, Z/R {approx}< 0.1-0.2, in the disk midplane, within R Almost-Equal-To 200 AU.

  15. Temporal variability in 20 chemical elements content of Parasol Mushroom (Macrolepiota procera) collected from two sites over a few years.

    PubMed

    Gucia, Magdalena; Jarzyńska, Grażyna; Kojta, Anna K; Falandysz, Jerzy

    2012-01-01

    Mature specimens of Parasol Mushroom were collected annually in the outskirts of the Siemiany (2000-2003) and Rafa (2001-2003) sites in the northern part of Poland to examine temporal variations and similarities in the composition of 20 chemical elements. Analysis was done under the same condition and using well-validated analytical methods. Elements were determined by inductively coupled plasma-atomic emission spectroscopy and cold vapour-atomic absorption spectroscopy (Hg). The ranges of Ag, Al, Ba, Ca, Cd, Co, Cu, Cr, Fe, Hg, K, Mg, Mn, Na, Ni, P, Pb, Rb, Sr and Zn concentrations in the caps of fruiting bodies were similar (p > 0.05; Mann-Whitney U test) for both geographically distant sites, and these specimens from Rafa were more contaminated with Pb (p < 0.05; Mann-Whitney U test). The annual collections of caps in the Siemiany site varied in Ag, Al, Ba, Ca, Cd, Co, Cu, Fe, Hg, Na, Rb and Sr and contents (0.05 < p < 0.001), while they were similar in Cr, K, Mg, Mn, Ni, P, Pb and Zn (p > 0.05; Mann-Whitney U test). The annual collections of specimens from the Rafa site varied in contents of Ag, Al, Ba, Ca, Fe, Hg, K, Mg, Mn, P, Rb and Zn (p > 0.05), while they were similar in Cd, Co, Cr, Cu, Na, Ni, Pb and Sr (p < 0.05). The results of this study imply that metallic elements content of Parasol Mushroom collected at the same undisrupted sites, and hence keeping the same geochemical condition for mushroom development and fructification (the same stands and probably the same mycelia), can fluctuate over the years or the life-span of mycelium. Hence, when assessing the nutritional value of essential metallic elements and status of non-essential or toxic metallic elements in Parasol's Mushroom caps (and probably also of other mushrooms species) to man, the possible fluctuation in contents over time have to be taken into account. PMID:22251207

  16. A physical chemical approach to understanding cellular dysfunction in type II diabetes

    NASA Astrophysics Data System (ADS)

    Miranker, Andrew

    2013-03-01

    The conversion of soluble protein into b-sheet rich amyloid fibers is the hallmark of a number of serious diseases. Precursors for many of these systems (e.g. Ab from Alzheimer's disease) reside in close association with a biological membranes. Membrane bilayers are reported to accelerate the rate of amyloid assembly. Furthermore, membrane permeabilization by amyloidogenic peptides can lead to toxicity. Given the b-sheet rich nature of mature amyloid, it is seemingly paradoxical that many precursors are either intrinsically b-helical, or transiently adopt an a-helical state upon association with membrane. We have investigated these phenomena in islet amyloid polypeptide (IAPP). IAPP is a 37-residue peptide hormone which forms amyloid fibers in individuals with type II diabetes. We report here the discovery of an oligomeric species that arises through stochastic nucleation on membranes, and results in disruption of the lipid bilayer. These species are stable, result in all-or-none leakage, and represent a definable protein/lipid phase that equilibrates over time. To characterize the reaction pathway of assembly, we apply an experimental design that includes ensemble and single particle evaluations in vitro and correlate these with quantitative measures of cellular toxicity.

  17. Modeling of chemical interactions of fuel rod materials at high temperatures II. Investigation of downward relocation of molten materials

    NASA Astrophysics Data System (ADS)

    Veshchunov, M. S.; Palagin, A. V.

    1998-01-01

    In Part II of the modeling of chemical interactions of fuel rod materials at high temperatures, qualitative results on the nature of Zr-rich melt oxidation and interactions with fuel rods allow further interpretation of the post-test examinations of structures (debris) formed in the CORA tests under more complicated conditions, namely during downward relocation of the melt. In this situation, the molten mass extensively oxidizes and simultaneously dissolves UO 2 pellets and ZrO 2 scales of the cladding. The analysis of these simultaneous physico-chemical processes on the basis of the kinetic oxidation/dissolution model developed in Part I of the paper, allows a new interpretation and explanation of the CORA tests results concerning relocation dynamics of the major part of the melt (slow relocation of melt in the form of massive slug rather than quick relocations of droplets and rivulets), formation of local blockages (debris) in the interrod space and accumulation of the melt in the core region in the form of molten pool.

  18. Recovery of Cu(II) by chemical reduction using sodium dithionite: effect of pH and ligands.

    PubMed

    Chou, Yi-Hsuan; Yu, Jui-Hsuan; Liang, Yang-Min; Wang, Pin-Jan; Li, Chi-Wang; Chen, Shiao-Shing

    2015-01-01

    Wastewaters containing Cu(II) and ligands are ubiquitous in various industrial sectors, and efficacy of copper removal processes, especially precipitation, is greatly compromised by ligands. Chemical reduction, being commonly employed for production of metal nanoparticles, is also effective for metal removal. Adjustment of pH and addition of ligands are important to control the particle size in metallic nanoparticle production. Exploiting the fact that ligands and metals coexist in many wastewaters, chemical reduction was employed to treat ligand-containing wastewater in this study. The experimental result shows that depending on pH, type of ligands, and copper:ligand molar ratio, copper could be removed by either the reduction or precipitation mechanism. Almost complete copper removal could be achieved by the reduction mechanism under optimal condition for solutions containing either EDTA (ethylenediaminetetraacetic acid) or citrate ligands. For solutions containing ammonia, depending on pH and Cu:ammonia molar ratio, copper was removed by both precipitation and reduction mechanisms. At pH of 9.0, formation of nano-sized particles, which readily pass through a 0.45 μm filter used for sample pretreatment before residual copper analysis, results in the lowest copper removal efficiency. Both cuprous oxide and metallic copper are identified in the solids produced, and the possible explanations are provided. PMID:26606104

  19. Studies in photochemical smog chemistry. I. Atmospheric chemistry of toluene. II. Analysis of chemical reaction mechanisms for photochemical smog

    SciTech Connect

    Leone, J.A.

    1985-01-01

    This study focuses on two related topics in the gas phase organic chemistry of importance in urban air pollution. Part I describes an experimental and modeling effort aimed at developing a new explicit reaction mechanism for the atmospheric photooxidation of toluene. This mechanism is tested using experimental data from both indoor and outdoor smog chamber facilities. The predictions of the new reaction mechanism are found to be in good agreement with both sets of experimental data. Additional simulations performed with the new mechanism are used to investigate various mechanistic paths, and to gain insight into areas where the understanding is not complete. The outdoor experimental facility, which was built to provide the second set of experimental data, consists of a 65 cubic meter teflon smog chamber together with full instrumentation capable of measuring ozone, nitrogen dioxide, nitric oxide, peroxyacetyl nitrate (PAN), carbon monoxide, relative humidity, temperature, aerosol size distributions, and of course toluene and its photooxidation products. In Part II, a theoretical analysis of lumped chemical reaction mechanisms for photochemical smog is presented. Included is a description of a new counter species analysis technique which can be used to analyze any complex chemical reaction mechanism. Finally, a new lumped mechanism for photochemical smog is developed and tested against experimental data from two smog chamber facilities. Advantages of this mechanism relative to the existing lumped mechanisms are discussed.

  20. Seasonal characteristics of chemical compositions of the atmospheric aerosols collected in urban seaside area at Tokaimura, eastern central Japan

    NASA Astrophysics Data System (ADS)

    Fu, Fengfu; Watanabe, K.; Yabuki, S.; Akagi, T.

    2004-10-01

    To obtain the seasonal characteristics and the size distributions of chemical compositions of the atmospheric aerosols in urban seaside area of eastern central Japan, size-separated aerosol samples were collected at Tokaimura (36.27°N, 140.36°E) using an Andersen type sampler during July 2002 to July 2003. A maximum mass concentration of aerosols (about 50 μg/m3) during April and May and a minimum one (about 13 μg/m3) in January and a size distribution with two peaks at 0.43-1.5 μm and 3-8 μm were observed. The size-separated aerosols were divided into water-soluble and water-insoluble fractions, and Na+, Cl-, NH4+, NO3-, SO42-, Mg2+, Ca2+, and Pb2+ in water-soluble fraction and Na, Al, Ca, Mg, Fe, Pb, Th, and U in insoluble fractions were analyzed. Then, the seasonal variations and the size distribution in mass concentration of each chemical composition and the chemistry of sea-salt particles were also studied in detail. Our results showed that (1) considerable amount of soil-derived particles was supplied from dust storm incident in China, (2) there was a loss of chlorine in sea-salt particles and this loss was compensated with the replacement by SO42- and NO3-, (3) the size distribution of Th and U showed a bimodal curve with two peaks at 0.43 μm and bigger than 3 μm and these two elements in the atmosphere seem to have two sources, and (4) aerosols contained both soluble and insoluble Pb and the soluble one became much lower in the colder seasons. The concentrations of soluble Pb showed a close relationship with anions such as Cl- and SO42-.

  1. Bioerodible polyanhydrides as drug-carrier matrices. II. Biocompatibility and chemical reactivity.

    PubMed

    Leong, K W; D'Amore, P D; Marletta, M; Langer, R

    1986-01-01

    The biocompatibility of bioerodible polyanhydrides and toxicology of the polymer breakdown products were assessed. Poly-[bis (p-carboxy-phenoxy) propane anhydride] (PCPP), Poly(terephthalic acid anhydride) (PTA), and their copolymers with sebacic acid were tested. The polymers did not provoke inflammatory responses in the corneas of rabbits over a six week implantation period. Subcutaneous implantation studies of PCPP in rats over a six month period showed no evidence of inflammatory cells and only slight tissue encapsulation by layers of fibroblastic cells. The degradation products of the polymers were nonmutagenic, noncytotoxic, and had a low teratogenic potential. The in vitro growth of mammalian cells on the polymers was unaffected as measured by cell morphology and cell growth rate. The chemical reactivity of the polyanhydrides with reactive model drugs, para substituted anilines, was also examined. Amides were formed when the drugs were injection molded with the polyanhydrides at 120 degrees C. However, no reaction was observed using compression molding at room temperature. No reaction occurred between the polymer and the drug during the hydrolytic degradation of the matrix at 37 degrees C. PMID:3949823

  2. Chemical Composition of Two H II Regions in NGC 6822 Based on VLT Spectroscopy

    NASA Astrophysics Data System (ADS)

    Peimbert, M.; Peimbert, A.; Ruiz, M. T.

    2005-05-01

    We present long slit spectrophotometry of regions V and X of the local group irregular galaxy NGC 6822. The data consist of VLT FORS observations in the 3450 to 7400 Å range. We have obtained electron temperatures and densities using different line intensity ratios. We have derived the H, He, C, and O abundances based on recombination lines; the abundance ratios among these elements are almost independent of the temperature structure of the nebulae. We have also determined the N, O, Ne, S, Cl, and Ar abundances based on collisionally excited lines; the ratios of these abundances relative to that of H depend strongly on the temperature structure of the nebulae. We compare the chemical composition of NGC 6822 V with those of the Sun, the Orion nebula, NGC 346 in the SMC, and 30 Doradus in the LMC. The O/H value derived from recombination lines for NGC 6822 V is in good agreement with the value derived by Venn et al. (2001) from A type supergiants in NGC 6822. MP received partial support from DGAPA UNAM (grant IN 114601). AP received partial support from DGAPA UNAM (grant IN 118405). MTR received partial support from FONDAP(15010003), a Guggenheim Fellowship and Fondecyt(1010404).

  3. Review of Catalytic Hydrogen Generation in the DWPF Chemical Processing Cell, Part II

    SciTech Connect

    Koopman, David C.; Lambert, Daniel P.; Baich, Mark A.

    2005-08-01

    The Savannah River National Laboratory is in the process of investigating factors suspected of impacting catalytic hydrogen generation in the Defense Waste Processing Facility, DWPF, Chemical Process Cell, CPC. Noble metal catalyzed hydrogen generation in simulation work constrains the allowable acid addition operating window in DWPF. This constraint potentially impacts washing strategies during sludge batch preparation. It can also influence decisions related to the addition of secondary waste streams to a sludge batch. Catalytic hydrogen generation data from 2002-2005 were reviewed. The data came from process simulations of the DWPF Sludge Receipt and Adjustment Tank, SRAT, and Slurry Mix Evaporator, SME. Most of the data was from the development work for the Sludge Batch 3 process flowsheet. This included simulant and radioactive waste testing. Preliminary Sludge Batch 4 data were also reviewed. A statistical analysis of SB3 simulant hydrogen generation data was performed. One factor considered in the statistical analysis was excess acid. Excess acid was determined experimentally as the acid added beyond that required to achieve satisfactory nitrite destruction.

  4. The Chemical Properties of Milky Way and M31 Globular Clusters. II. Stellar Population Model Predictions

    NASA Astrophysics Data System (ADS)

    Beasley, Michael A.; Brodie, Jean P.; Strader, Jay; Forbes, Duncan A.; Proctor, Robert N.; Barmby, Pauline; Huchra, John P.

    2005-03-01

    We derive ages, metallicities, and abundance ratios ([α/Fe]) from the integrated spectra of 23 globular clusters in M31 by employing multivariate fits to two different stellar population models. We also perform a parallel analysis on 21 Galactic globular clusters as a consistency check and in order to facilitate a differential analysis. Our analysis shows that the M31 globular clusters separate into three distinct components in age and metallicity; we identify an old, metal-poor group (seven clusters), an old, metal-rich group (10 clusters), and an intermediate-age (3-6 Gyr), intermediate-metallicity ([Z/H]~-1) group (six clusters). This third group is not identified in the Galactic globular cluster sample. We also see evidence that the old, metal-rich Galactic globular clusters are 1-2 Gyr older than their counterparts in M31. The majority of globular clusters in both samples appear to be enhanced in α-elements, but the degree of enhancement is rather model-dependent. The intermediate-age globular clusters appear to be the most enhanced, with [α/Fe]~0.4. These clusters are clearly depressed in CN with respect to the models and the bulk of the M31 and Milky Way sample. Compared with the bulge of M31, M32, and NGC 205, these clusters most resemble the stellar populations in NGC 205 in terms of age, metallicity, and CN abundance. We infer horizontal branch morphologies for the M31 clusters using the Rose Ca II index and demonstrate that blue horizontal branches are not leading to erroneous age estimates in our analysis. We discuss and reject as unlikely the hypothesis that these objects are in fact foreground stars contaminating the optical catalogs. The intermediate-age clusters have generally higher velocities than the bulk of the M31 cluster population. Spatially, three of these clusters are projected onto the bulge region, and the remaining three are distributed at large radii. We discuss these objects within the context of the build-up of the M31 halo and suggest that these clusters possibly originated in a gas-rich dwarf galaxy, which may or may not be presently observable in M31.

  5. Chemical and toxicological characterization of residential oil burner emissions: II. Mutagenic, tumorigenic, and potential teratogenic activity.

    PubMed

    Braun, A G; Busby, W F; Liber, H L; Thilly, W G

    1987-08-01

    Extracts of effluents from a modern residential oil burner have been evaluated in several toxicological assay systems. Bacterial mutagens were detected in extracts from both the particulate and vapor phase emissions. Effluents from continuous operation were an order of magnitude less mutagenic than those from cyclic (5 min on, 10 min off) operations. No difference in the yield of bacterial mutagens per gram of fuel burned was found between cyclic operation under low and moderate sooting conditions. On the basis of elution behavior from alumina it appeared that the bacterial mutagens collected from high sooting effluents were more polar than those from low sooting effluent. An extract that was mutagenic in bacteria did not induce a significant increase in mutation frequency to human lymphoblasts. No evidence of tumorigenicity was observed in a limited number of newborn mice after IP injection of effluent extract when compared to historical control data. Putative nonmutagenic teratogens were detected in effluent using an attachment inhibition assay. The level of these agents was reduced in effluents from continuous oil burner operation. PMID:3665866

  6. Chemical and toxicological characterization of residential oil burner emissions: II. Mutagenic, tumorigenic, and potential teratogenic activity.

    PubMed Central

    Braun, A G; Busby, W F; Liber, H L; Thilly, W G

    1987-01-01

    Extracts of effluents from a modern residential oil burner have been evaluated in several toxicological assay systems. Bacterial mutagens were detected in extracts from both the particulate and vapor phase emissions. Effluents from continuous operation were an order of magnitude less mutagenic than those from cyclic (5 min on, 10 min off) operations. No difference in the yield of bacterial mutagens per gram of fuel burned was found between cyclic operation under low and moderate sooting conditions. On the basis of elution behavior from alumina it appeared that the bacterial mutagens collected from high sooting effluents were more polar than those from low sooting effluent. An extract that was mutagenic in bacteria did not induce a significant increase in mutation frequency to human lymphoblasts. No evidence of tumorigenicity was observed in a limited number of newborn mice after IP injection of effluent extract when compared to historical control data. Putative nonmutagenic teratogens were detected in effluent using an attachment inhibition assay. The level of these agents was reduced in effluents from continuous oil burner operation. PMID:3665866

  7. Chemical and toxicological characterization of residential oil burner emissions. II. Mutagenic, tumorigenic, and potential teratogenic activity

    SciTech Connect

    Braun, A.G.; Busby, W.F. Jr.; Liber, H.L.; Thilly, W.G.

    1987-08-01

    Extracts of effluents from a modern residential oil burner have been evaluated in several toxicological assay systems. Bacterial mutagens were detected in extracts from both the particulate and vapor phase emissions. Effluents from continuous operation were an order of magnitude less mutagenic than those from cyclic (5 min on, 10 min off) operations. No difference in the yield of bacterial mutagens per gram of fuel burned was found between cyclic operation under low and moderate sooting conditions. On the basis of elution behavior from alumina it appeared that the bacterial mutagens collected from high sooting effluents were more polar than those from low sooting effluent. An extract that was mutagenic in bacteria did not induce a significant increase in mutation frequency to human lymphoblasts. No evidence of tumorigenicity was observed in a limited number of newborn mice after IP injection of effluent extract when compared to historical control data. Putative nonmutagenic teratogens were detected in effluent using an attachment inhibition assay. The level of these agents was reduced in effluents from continuous oil burner operation.

  8. Template synthesis and physico-chemical characterization of 14-membered tetraimine macrocyclic complexes, [MLX 2] [M = Co(II), Ni(II), Cu(II) and Zn(II)]. DNA binding study on [CoLCl 2] complex

    NASA Astrophysics Data System (ADS)

    Firdaus, Farha; Fatma, Kaneez; Azam, Mohammad; Khan, Shahper N.; Khan, Asad U.; Shakir, Mohammad

    2009-04-01

    The template condensation reaction between glyoxal and 1,8-diaminonaphthalene resulted a few novel mononuclear 14-membered tetraimine macrocyclic complexes of the type, [MLX 2] [M = Co(II), Ni(II), Cu(II) and Zn(II), for X = Cl or NO 3]. The stoichiometry and the nature of the complexes have been deduced from the results of elemental analyses and conductance data. The formation of macrocyclic framework has been inferred from the appearance of imine υ(C dbnd N) and υ(M sbnd N) band in IR spectra and the resonance signals observed in 1H and 13C-NMR spectra. However, the overall geometry of the complexes has been assigned on the positions of bands in electronic spectra and magnetic moment data. The distortion in Cu(II) complexes has been deduced on EPR data. The thermal behavior of these complexes has been studied by TGA analysis. Absorption and circular dichroism studies on the complex proved a significant binding to calf thymus DNA.

  9. A multimedia fate and chemical transport modeling system for pesticides: II. Model evaluation

    NASA Astrophysics Data System (ADS)

    Li, Rong; Scholtz, M. Trevor; Yang, Fuquan; Sloan, James J.

    2011-07-01

    Pesticides have adverse health effects and can be transported over long distances to contaminate sensitive ecosystems. To address problems caused by environmental pesticides we developed a multimedia multi-pollutant modeling system, and here we present an evaluation of the model by comparing modeled results against measurements. The modeled toxaphene air concentrations for two sites, in Louisiana (LA) and Michigan (MI), are in good agreement with measurements (average concentrations agree to within a factor of 2). Because the residue inventory showed no soil residues at these two sites, resulting in no emissions, the concentrations must be caused by transport; the good agreement between the modeled and measured concentrations suggests that the model simulates atmospheric transport accurately. Compared to the LA and MI sites, the measured air concentrations at two other sites having toxaphene soil residues leading to emissions, in Indiana and Arkansas, showed more pronounced seasonal variability (higher in warmer months); this pattern was also captured by the model. The model-predicted toxaphene concentration fraction on particles (0.5-5%) agrees well with measurement-based estimates (3% or 6%). There is also good agreement between modeled and measured dry (1:1) and wet (within a factor of less than 2) depositions in Lake Ontario. Additionally this study identified erroneous soil residue data around a site in Texas in a published US toxaphene residue inventory, which led to very low modeled air concentrations at this site. Except for the erroneous soil residue data around this site, the good agreement between the modeled and observed results implies that both the US and Mexican toxaphene soil residue inventories are reasonably good. This agreement also suggests that the modeling system is capable of simulating the important physical and chemical processes in the multimedia compartments.

  10. Program for monitoring the chemical quality of ground water in Utah - Summary of data collected through 1984

    SciTech Connect

    Price, D.; Arnow, T.

    1986-01-01

    The US Geological Survey formally started a program for monitoring groundwater quality in Utah during 1957 in cooperation with the Utah Geological Survey. The monitoring program was initiated to detect any changes in chemical quality that might be associated with the withdrawal of water from wells. Dissolved-solids concentrations in water samples collected from the observation wells through 1984 ranged from 92 to 19,000 mg/L. An observation well in the Uinta Basin yielded the sample with the smallest dissolved solids concentration, and another well in the Uinta Basin yielded the sample with the largest dissolved solids concentration. There was a progressive increase in salinity of water produced by several of the observation wells in Pahvant Valley and in the Milford and Beryl-Enterprise areas. Water quality changes related either to groundwater withdrawals or groundwater recharge also were detected in several other areas. Water produced from wells in Goshen Valley and the upper Fremont River valley had short term increases in chloride, sulfate, and dissolved solids concentrations, indicating possible local contamination of the groundwater. Also, since the late 1950's, dissolved solids concentrations have increased in water produced by a well completed in the principal aquifer in Salt Lake Valley downgradient from areas where extensive use has been made of road salt. 40 refs., 38 figs., 38 tabs.

  11. Chemical analyses of coal, coal-associated rocks and coal combustion products collected for the National Coal Quality Inventory

    USGS Publications Warehouse

    Hatch, Joseph R.; Bullock, John H., Jr.; Finkelman, Robert B.

    2006-01-01

    In 1999, the USGS initiated the National Coal Quality Inventory (NaCQI) project to address a need for quality information on coals that will be mined during the next 20-30 years. At the time this project was initiated, the publicly available USGS coal quality data was based on samples primarily collected and analyzed between 1973 and 1985. The primary objective of NaCQI was to create a database containing comprehensive, accurate and accessible chemical information on the quality of mined and prepared United States coals and their combustion byproducts. This objective was to be accomplished through maintaining the existing publicly available coal quality database, expanding the database through the acquisition of new samples from priority areas, and analysis of the samples using updated coal analytical chemistry procedures. Priorities for sampling include those areas where future sources of compliance coal are federally owned. This project was a cooperative effort between the U.S. Geological Survey (USGS), State geological surveys, universities, coal burning utilities, and the coal mining industry. Funding support came from the Electric Power Research Institute (EPRI) and the U.S. Department of Energy (DOE).

  12. Fine organic aerosols collected in a humid, rural location (Great Smoky Mountains, Tennessee, USA): Chemical and temporal characteristics

    NASA Astrophysics Data System (ADS)

    Yu, Liya E.; Shulman, Michelle L.; Kopperud, Royal; Hildemann, Lynn M.

    Fine organic aerosols collected at the Great Smoky Mountain National Park, Tennessee (USA) during 15 July -25 August 1995 as part of the Southeastern Aerosol and Visibility Study (SEAVS) were chemically characterized. The water-soluble organic species (WSOS) often dominated over the solvent-soluble organic species (SSOS) at this remote, humid sampling site, contributing 76-98% of the total identified organic mass in 17 out of the 21 daytime samples analyzed. Nighttime samples tended to have slightly larger concentrations of total SSOS than the daytime, with nocturnal/diurnal organic mass ratios greater than 1.0 in 7 out of the 10 paired samples. However, for total WSOS mass, the nocturnal-to-diurnal ratios were less than 0.3 in 7 out of the 10 paired samples, reflecting much more substantial depletion and/or less production of the more polar organics during nighttime. Based on identified species, the organic-mass-to-organic-carbon (OM-OC) ratios at the SEAVS site are estimated as 2.0, 2.2, and 1.3 for the daytime total organics, WSOS, and SSOS, respectively. For the nighttime samples, the OM-OC ratio for total identified organics is estimated to be 1.8, slightly lower than the daytime ratio due to the smaller mass fraction of WSOS present at night.

  13. 77 FR 47666 - Agency Information Collection Activities: Proposed Collection; Comments Requested: Import/Export...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-08-09

    ...: Import/Export Declaration for List I and List II Chemicals; DEA Forms 486 and 486A ACTION: 60-Day Notice... Administration (DEA), will be submitting the following information collection request to the Office of Management... component of the Department of Justice sponsoring the collection: Form Number: DEA Forms 486 and...

  14. Optical detection/collection of toxic Cd(II) ions using cubic Ia3d aluminosilica mesocage sensors.

    PubMed

    El-Safty, Sherif A; Shenashen, Mohamed A; Khairy, Mohamed

    2012-08-30

    Optical sensors for selective removal and detection of extremely toxic ions such as cadmium (Cd(II)) in aquatic samples were successfully fabricated via simple strategy. Aluminosilica-based network platforms are used as selective mesopore shape and size carriers in order to fabricate optical sensors through the direct functionalization of ?, ?, ?, and ?-tetrakis(1-methylpyridinium-4-yl)porphine ?-toluenesulfonate (TMPyP) moieties without any prior surface modification using silane or thiol agents. In turn, the key advantage of a heretical three-dimensional (3D) cubic Ia3d mesocage is the facile access of target ions such as ion transports and the high affinity responses of TMPyP receptor-Cd(II) analyte binding events, which result in the easy generation and transduction of optical signals even at the trace level of the Cd(II) ion. The optical sensor design-based aluminosilica cages enable the sensitive detection and selective removal of Cd(II) ions even at ultra-trace concentrations of 10(-10)mol/dm(3) with rapid response time (in minutes). This rational strategy is crucial to the development of optical mesocollectors (i.e., probe surface-mounted naked-eye ion-sensor strips) with highly selective Cd(II) ion removal from aqueous water. These new classes of optical mesocollectors exhibit long-term stability and reusability of deleterious Cd(II) ions, which makes them efficient for various analytical applications. PMID:22939130

  15. Photochemical Formation of Fe(II) and Peroxides in Coastal Seawater Collected around Okinawa Island, Japan - Impact of Red Soil Pollution

    NASA Astrophysics Data System (ADS)

    Okada, K.; Nakajima, H.; Higuchi, T.; Fujimura, H.; Arakaki, T.; Taira, H.

    2003-12-01

    In a study to elucidate the impacts of red soil pollution on the oxidizing power of seawater, photochemical formation of Fe(II) and peroxides was studied in seawaters collected around Okinawa Island, Japan. The northern part of Okinawa Island suffers from red soil pollution which is caused mainly by land development such as pineapple farming and the construction of recreational facilities. We studied photochemical formation of peroxides and Fe(II) in the same seawater samples because the reaction between HOOH and Fe(II) forms hydroxyl radical (OH radical), the most potent environmental oxidant. Photochemical formation of Fe(II) was fast and reached steady-state in 30 minutes of simulated sunlight illumination and the steady-state Fe(II) concentrations were about 80% of total iron concentrations. Photochemical formation of peroxides was relatively slow and formation kinetics varied, depending on the initial peroxide concentrations. Because photochemical formation of peroxides was faster and total iron concentrations in the red soil polluted seawater were higher, red soil polluted seawater is expected to have greater oxidizing power than seawater that is not polluted with red soil.

  16. CHEMICAL COMPOSITION OF ESSENTIAL OILS FROM A COLLECTION OF OCIMUM SPECIES (NCRPIS, AMES, USA); INVESTIGATION OF THEIR ANTIFUNGAL ACTIVITIES AND EFFECTS ON FUNGAL POLYAMINES

    Technology Transfer Automated Retrieval System (TEKTRAN)

    The North Central Regional Plant Introduction Station conserves germplasm of aromatic plants, including extensive collections of Ocimum providing valuable sources of key genes for developing new basil cultivars. We conducted chemical analyses of essential oils of 73 Ocimum accessions, comparing our...

  17. Seed chemical composition variability and FAD2A functional SNP genotypes in the U.S. peanut mini-core collection

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Peanut seeds are nutritious containing high amounts of oil and protein as well as some useful phytochemicals which can contribute to human health. The U.S. peanut mini-core collection is an important genetic resource for improving seed quality and developing new cultivars. Variability of seed chemic...

  18. The GLAS editing procedures for the FGGE level II-B data collected during SOP-1 and 2

    NASA Technical Reports Server (NTRS)

    Baker, W.; Edelmann, D.; Carus, H.

    1981-01-01

    The modifications made to the FGGE Level II-b data are discussed and the FORTRAN program developed to perform the modifications is described. It is suggested that the edited database is the most accurate one available for FGGE SOP-1 and 2.

  19. Seizure modeling of Pb(II) and Cd(II) from aqueous solution by chemically modified sugarcane bagasse fly ash: isotherms, kinetics, and column study.

    PubMed

    Shah, Bhavna; Mistry, Chirag; Shah, Ajay

    2013-04-01

    Heavy metal pollution is a common environmental problem all over the world. The purpose of the research is to examine the applicability of bagasse fly ash (BFA)-an agricultural waste of sugar industry used for the synthesis of zeolitic material. The zeolitic material are used for the uptake of Pb(II) and Cd(II) heavy metal. Bagasse fly ash is used as a native material for the synthesis of zeolitic materials by conventional hydrothermal treatment without (conventional zeolitic bagasse fly ash (CZBFA)) and with electrolyte (conventional zeolitic bagasse fly ash in electrolyte media (ECZBFA)) media. Heavy metal ions Pb(II) and Cd(II) were successfully seized from aqueous media using these synthesized zeolitic materials. In this study, the zeolitic materials were well characterized by different instrumental methods such as Brunauer-Emmett-Teller, XRF, Fourier transform infrared spectroscopy, powder X-ray diffraction, and scanning electron microscopic microphotographs. The presence of analcime, phillipsite, and zeolite P in adsorbents confirms successful conversion of native BFA into zeolitic materials. Seizure modeling of Pb(II) and Cd(II) was achieved by batch sorption experiments, isotherms, and kinetic studies. These data were used to compare and evaluate the zeolitic materials as potential sorbents for the uptake of heavy metal ions from an aqueous media. The Langmuir isotherm correlation coefficient parameters best fit the equilibrium data which indicate the physical sorption. Pseudo-second-order and intra-particle diffusion model matches best which indicates that the rate of sorption was controlled by film diffusion. The column studies were performed for the practical function of sorbents, and breakthrough curves were obtained, which revealed higher sorption capacity as compared to batch method. Synthesized zeolitic material (CZBFA and ECZBFA), a low-cost sorbent, was proven as potential sorbent for the uptake of Pb(II) and Cd(II) heavy metal ions. PMID:22739768

  20. Developmental Effects of the ToxCast™ Phase I and Phase II Chemicals in Caenorhabditis elegans and Corresponding Responses in Zebrafish, Rats, and Rabbits

    PubMed Central

    Boyd, Windy A.; Smith, Marjolein V.; Co, Caroll A.; Pirone, Jason R.; Rice, Julie R.; Shockley, Keith R.; Freedman, Jonathan H.

    2015-01-01

    Background: Modern toxicology is shifting from an observational to a mechanistic science. As part of this shift, high-throughput toxicity assays are being developed using alternative, nonmammalian species to prioritize chemicals and develop prediction models of human toxicity. Methods: The nematode Caenorhabditis elegans (C. elegans) was used to screen the U.S. Environmental Protection Agency’s (EPA’s) ToxCast™ Phase I and Phase II libraries, which contain 292 and 676 chemicals, respectively, for chemicals leading to decreased larval development and growth. Chemical toxicity was evaluated using three parameters: a biologically defined effect size threshold, half-maximal activity concentration (AC50), and lowest effective concentration (LEC). Results: Across both the Phase I and Phase II libraries, 62% of the chemicals were classified as active ≤ 200 μM in the C. elegans assay. Chemical activities and potencies in C. elegans were compared with those from two zebrafish embryonic development toxicity studies and developmental toxicity data for rats and rabbits. Concordance of chemical activity was higher between C. elegans and one zebrafish assay across Phase I chemicals (79%) than with a second zebrafish assay (59%). Using C. elegans or zebrafish to predict rat or rabbit developmental toxicity resulted in balanced accuracies (the average value of the sensitivity and specificity for an assay) ranging from 45% to 53%, slightly lower than the concordance between rat and rabbit (58%). Conclusions: Here, we present an assay that quantitatively and reliably describes the effects of chemical toxicants on C. elegans growth and development. We found significant overlap in the activity of chemicals in the ToxCast™ libraries between C. elegans and zebrafish developmental screens. Incorporating C. elegans toxicological assays as part of a battery of in vitro and in vivo assays provides additional information for the development of models to predict a chemical’s potential toxicity to humans. Citation: Boyd WA, Smith MV, Co CA, Pirone JR, Rice JR, Shockley KR, Freedman JH. 2016. Developmental effects of the ToxCast™ Phase I and II chemicals in Caenorhabditis elegans and corresponding responses in zebrafish, rats, and rabbits. Environ Health Perspect 124:586–593; http://dx.doi.org/10.1289/ehp.1409645 PMID:26496690

  1. Odor and odorous chemical emissions from animal buildings: part 1 - project overview, collection methods, and quality control

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Livestock facilities have historically generated public concerns due to their emissions of odorous air and various chemical pollutants. Odor emission factors and identification of principal odorous chemicals are needed to better understand the problem. Applications of odor emission factors include i...

  2. Chemical and isotopic data collected from groundwater, surface-water, and atmospheric precipitation sites in Upper Kittitas County, Washington, 2010-12

    USGS Publications Warehouse

    Hinkle, Stephen R.; Ely, D. Matthew

    2013-01-01

    As part of a multidisciplinary U.S. Geological Survey study of water resources in Upper Kittitas County, Washington, chemical and isotopic data were collected from groundwater, surface-water, and atmospheric precipitation sites from 2010 to 2012. These data are documented here so that interested parties can quickly and easily find those chemical and isotopic data related to this study. The locations of the samples are shown on an interactive map of the study area. This report is dynamic; additional data will be added to it as they become available.

  3. Chemical composition of samples collected from waste rock dumps and other mining-related features at selected phosphate mines in southeastern Idaho, western Wyoming, and northern Utah

    USGS Publications Warehouse

    Moyle, Phillip R.; Causey, J. Douglas

    2001-01-01

    This report provides chemical analyses for 31 samples collected from various phosphate mine sites in southeastern Idaho (25), northern Utah (2), and western Wyoming (4). The sampling effort was undertaken as a reconnaissance and does not constitute a characterization of mine wastes. Twenty-five samples were collected from waste rock dumps, 2 from stockpiles, and 1 each from slag, tailings, mill shale, and an outcrop. All samples were analyzed for a suite of major, minor, and trace elements. Although the analytical data set for the 31 samples is too small for detailed statistical analysis, a summary of general observations is made.

  4. Profiling of the Tox21 Chemical Collection for Mitochondrial Function: I. Compounds that Decrease Mitochondrial Membrane Potential

    EPA Science Inventory

    Mitochondrial dysfunction has been implicated in the pathogenesis of a variety of disorders including cancer, diabetes, and neurodegenerative and cardiovascular diseases. Understanding how different environmental chemicals and drug-like molecules impact mitochondrial function rep...

  5. Collection of chemical-specific toxicological and pharmacokinetic data to improve risk assessments based on epidemiology: Example of Mn

    EPA Science Inventory

    Data limitations led to the application of default uncertainty factors in prior risk assessments for Mn. These limitations were instrumental in the EPA generation of an alternative tier II test rule under section 211 (b) of the Clean Air Act, (fuels and fuel additives) regarding ...

  6. Chemical comparison and acute toxicity of water accommodated fraction (WAF) of source and field collected Macondo oils from the Deepwater Horizon spill.

    PubMed

    Faksness, Liv-Guri; Altin, Dag; Nordtug, Trond; Daling, Per S; Hansen, Bjørn Henrik

    2015-02-15

    Two Source oils and five field collected oil residues from the Deepwater Horizon incident were chemically characterized. Water accommodated fractions (WAFs) of the Source oils and two of the field-weathered oils were prepared to evaluate the impact of natural weathering on the chemical composition and the acute toxicity of the WAFs. Toxicity test species representing different tropic levels were used (the primary producer Skeletonema costatum (algae) and the herbivorous copepod Acartia tonsa). The results suggest that the potential for acute toxicity is higher in WAFs from non-weathered oils than WAFs from the field weathered oils. The Source oils contained a large fraction of soluble and bioavailable components (such as BTEX (benzene, toluene, ethyl benzene, xylenes) and naphthalene), whereas in the surface collected oils these components were depleted by dissolution into the water column as the oil rose to the surface and by evaporative loss after reaching the sea surface. PMID:25534626

  7. Manganese (II) induces chemical hypoxia by inhibiting HIF-prolyl hydroxylase: Implication in manganese-induced pulmonary inflammation

    SciTech Connect

    Han, Jeongoh; Lee, Jong-Suk; Choi, Daekyu; Lee, Youna; Hong, Sungchae; Choi, Jungyun; Han, Songyi; Ko, Yujin; Kim, Jung-Ae; Mi Kim, Young; Jung, Yunjin

    2009-03-15

    Manganese (II), a transition metal, causes pulmonary inflammation upon environmental or occupational inhalation in excess. We investigated a potential molecular mechanism underlying manganese-induced pulmonary inflammation. Manganese (II) delayed HIF-1{alpha} protein disappearance, which occurred by inhibiting HIF-prolyl hydroxylase (HPH), the key enzyme for HIF-1{alpha} hydroxylation and subsequent von Hippel-Lindau(VHL)-dependent HIF-1{alpha} degradation. HPH inhibition by manganese (II) was neutralized significantly by elevated dose of iron. Consistent with this, the induction of cellular HIF-1{alpha} protein by manganese (II) was abolished by pretreatment with iron. Manganese (II) induced the HIF-1 target gene involved in pulmonary inflammation, vascular endothelial growth factor (VEGF), in lung carcinoma cell lines. The induction of VEGF was dependent on HIF-1. Manganese-induced VEGF promoted tube formation of HUVEC. Taken together, these data suggest that HIF-1 may be a potential mediator of manganese-induced pulmonary inflammation.

  8. In situ investigation of surface chemistry for chemically driven atomic layer epitaxy of II-VI semiconductor thin films

    NASA Astrophysics Data System (ADS)

    Han, Ming

    2000-10-01

    Atomic Layer Epitaxy (ALE) can provide atomic scale control of the growth of ultra thin semiconductor films. This thesis presents an overview of an in situ molecular-level study of surface chemistry for heteroepitaxy of II-VI semiconductor by using a binary reaction sequence with hydride and metalorganic precursors. The study focused primarily on developing a fundamental understanding of surface chemistry in a model material system: the growth of US on ZnSe (100). Dimethylcadmium and H2S precursors were sequentially dosed onto a c(2x2) ZnSe (100) substrate and characterization of the growth surface at each growth step was accomplished in the growth chamber under UHV conditions. The surface chemical composition was probed by Auger electron spectroscopy (AES) and low energy ion scattering spectroscopy (LEIS) and the surface order was determined by low energy electron diffraction (LEED). These measurements showed that, at a substrate temperature of ˜300 K, self-limiting reactions resulted in saturated chemisorption of one Cd and one S monolayer during each cycle of the binary reaction sequence, yielding the layer-by-layer growth of an ordered stoichiometric US film. We investigated surface chemistry of our model system in further detail using near edge X-ray fine structure (NEXAFS) spectroscopy and temperature programmed desorption (TPD) spectroscopy. NEXAFS and TPD results revealed that the growth surface is terminated by either a monolayer of surface methyl or hydrogen subsequent to saturation with either DMCd or H2S respectively, at ˜300 K. These surface terminating groups (CH3 or H) passivate the growth surface, preventing further uptake of the precursors once monolayer coverage is reached. However, surface CH3 or H is reactive to the alternative precursor, so the other constituent can be deposited subsequently. Therefore, both methyl and hydrogen termination provide satisfactory self-limiting reactions that allow the growth to proceed in a layer-by-layer manner. Heteroepitaxy of ZnS on Si(100) using a similar binary reaction sequence has also been proposed. The initial stage of our study has focused on the interactions of potential precursors with Si(100). Adsorption and desorption mechanisms of H2S on Si(100) have been investigated by using AES, TPD and LEED. The surface is saturated by 0.5 ML of H2S for all substrate exposure temperatures, i.e. -145°C -425°C. Desorption of hydrogen and diffusion of sulfur occur almost simultaneously after dissociative adsorption of H2S on Si(100). This process makes it impossible to form 1.0 ML of surface sulfur without a separate means of H-atom removal. Alternative approaches to initiating the growth of a II-VI semiconductor on Si(100), such as the use of a group III or group V intermediary layer, are discussed.

  9. Chemical analyses of surface water in Illinois, 1958-74; Volume II, Illinois River basin and Mississippi River tributaries north of Illinois River basin

    USGS Publications Warehouse

    Healy, R.W.; Toler, L.G.

    1978-01-01

    Samples of surface water were collected and analyzed by the Illinois Environmental Protection Agency and its predecessor, the Stream Pollution Control Bureau of the Illinois Department of Public Health. The results for the period 1958 to 1974 are presented in tabular form and the history of sampling and analytical methods are included for all sites where samples were collected at gaging stations or near enough that reliable discharge estimates could be made. The report is contained in three volumes. This volume (Volume II) includes Illinois River basin and Mississippi River tributaries north of Illinois River basin. (See also W78-10034 and W78-10036) (Woodard-USGS)

  10. Chemical and spectroscopic characterizations, ESI-QTOF mass spectrometric measurements and DFT studies of new complexes of palladium(II) with tryptamine and mefenamic acid

    NASA Astrophysics Data System (ADS)

    Carvalho, Marcos A.; Arruda, Eduardo G. R.; Profirio, Daniel M.; Gomes, Alexandre F.; Gozzo, Fábio C.; Formiga, André L. B.; Corbi, Pedro P.

    2015-11-01

    New palladium(II) complexes with tryptamine (Pd-tra) and mefenamic acid (Pd-mef) were prepared and characterized by chemical and spectroscopic methods. Elemental, ESI-QTOF mass spectrometric and thermogravimetric analyses of the compounds confirm the composition [PdCl2(tra)2] for Pd-tra and [Pd(mef)2(bipy)] for Pd-mef. Infrared data indicate the coordination of tryptamine to Pd(II) by the nitrogen atom of the amino group, while for mefenamic acid coordination occurs by the oxygen atom of carboxylate group in a monodentate form. The 1H, 13C and {15N,1H} NMR spectroscopic data confirm the nitrogen coordination of the NH2 group of trypatmine to Pd(II) in the Pd-tra complex and also the oxygen coordination of the carboxylate group of mefenamic acid to Pd(II) in the Pd-mef complex. Density functional theory (DFT) studies were applied to determine the difference in energy between the geometric isomers (cis/trans) of Pd-tra and to optimize the structure of the Pd-mef complex. Raman spectroscopic measurements reinforce the nitrogen coordination of tryptamine to Pd(II) in the Pd-tra complex and confirms the presence of the cis-[PdCl2(tra)2] isomer in the solid state. The complexes are insoluble in water.

  11. Electrochromic and colorimetric properties of nickel(II) oxide thin films prepared by aerosol-assisted chemical vapor deposition.

    PubMed

    Sialvi, Muhammad Z; Mortimer, Roger J; Wilcox, Geoffrey D; Teridi, Asri Mat; Varley, Thomas S; Wijayantha, K G Upul; Kirk, Caroline A

    2013-06-26

    Aerosol-assisted chemical vapor deposition (AACVD) was used for the first time in the preparation of thin-film electrochromic nickel(II) oxide (NiO). The as-deposited films were cubic NiO, with an octahedral-like grain structure, and an optical band gap that decreased from 3.61 to 3.48 eV on increase in film thickness (in the range 500-1000 nm). On oxidative voltammetric cycling in aqueous KOH (0.1 mol dm(-3)) electrolyte, the morphology gradually changed to an open porous NiO structure. The electrochromic properties of the films were investigated as a function of film thickness, following 50, 100, and 500 conditioning oxidative voltammetric cycles in aqueous KOH (0.1 mol dm(-3)). Light modulation of the films increased with the number of conditioning cycles. The maximum coloration efficiency (CE) for the NiO (transmissive light green, the "bleached" state) to NiOOH (deep brown, the colored state) electrochromic process was found to be 56.3 cm(2) C(-1) (at 450 nm) for films prepared by AACVD for 15 min followed by 100 "bleached"-to-colored conditioning oxidative voltammetric cycles. Electrochromic response times were <10 s and generally longer for the coloration than the bleaching process. The films showed good stability when tested for up to 10 000 color/bleach cycles. Using the CIE (Commission Internationale de l'Eclairage) system of colorimetry the color stimuli of the electrochromic NiO films and the changes that take place on reversibly oxidatively switching to the NiOOH form were calculated from in situ visible spectra recorded under electrochemical control. Reversible changes in the hue and saturation occur on oxidation of the NiO (transmissive light green) form to the NiOOH (deep brown) form, as shown by the track of the CIE 1931 xy chromaticity coordinates. As the NiO film is oxidized, a sharp decrease in luminance was observed. CIELAB L*a*b* coordinates were also used to quantify the electrochromic color states. A combination of a low L* and positive a* and b* values quantified the perceived deep brown colored state. PMID:23748903

  12. NEW YORK CITY BUS TERMINAL DIESEL EMISSIONS STUDY: MEASUREMENT AND COLLECTION OF DIESEL EXHAUST FOR CHEMICAL CHARACTERIZATION AND MUTAGENIC ACTIVITY

    EPA Science Inventory

    The paper is concerned with the impact of diesel emissions on the quality of the ambient air and the resulting effects on human health. The study was designed to chemically characterize and bioassay heavy-duty diesel engine exhaust as it exists in the ambient atmosphere. Diesel e...

  13. (Collection of North Pacific Ocean surface seawater samples for chemical analysis): Foreign trip report, January 26--February 27, 1988

    SciTech Connect

    Goddard, J.G.

    1988-03-04

    This trip was a continuation of the sampling program undertaken during 1984--1985 to study the seasonal and regional variability of CO/sub 2/ chemistry in high latitude deep water formation areas of the North Pacific. The work is conducted by Columbia University (Dr. Taro Takahashi, Principal Investigator) for the Department of Energy's Energy Systems Program managed by Oak Ridge National Laboratory. Aboard the PRESIDENT ARTHUR, surface seawater samples were collected at forty-one stations along the route from Oakland, California, to Keeling, Taiwan, via Guam. On the return trip, samples were collected from thirty-seven stations during transit from Keelung to Los Angeles, California.

  14. World Endometriosis Research Foundation Endometriosis Phenome and biobanking harmonization project: II. Clinical and covariate phenotype data collection in endometriosis research

    PubMed Central

    Vitonis, Allison F.; Vincent, Katy; Rahmioglu, Nilufer; Fassbender, Amelie; Buck Louis, Germaine M.; Hummelshoj, Lone; Giudice, Linda C.; Stratton, Pamela; Adamson, G. David; Becker, Christian M.; Zondervan, Krina T.; Missmer, Stacey A.

    2014-01-01

    Objective To harmonize the collection of nonsurgical clinical and epidemiologic data relevant to endometriosis research, allowing large-scale collaboration. Design An international collaboration involving 34 clinical/academic centers and three industry collaborators from 16 countries on five continents. Setting In 2013, two workshops followed by global consultation, bringing together 54 leaders in endometriosis research. Patients None. Intervention(s) Development of a self-administered endometriosis patient questionnaire (EPQ), based on [1] systematic comparison of questionnaires from eight centers that collect data from endometriosis cases (and controls/comparison women) on a medium to large scale (publication on >100 cases); [2] literature evidence; and [3] several global consultation rounds. Main Outcome Measure(s) Standard recommended and minimum required questionnaires to capture detailed clinical and covariate data. Result(s) The standard recommended (EPHect EPQ-S) and minimum required (EPHect EPQ-M) questionnaires contain questions on pelvic pain, subfertility and menstrual/reproductive history, hormone/medication use, medical history, and personal information. Conclusion(s) The EPQ captures the basic set of patient characteristics and exposures considered by the WERF EPHect Working Group to be most critical for the advancement of endometriosis research, but is also relevant to other female conditions with similar risk factors and/or symptomatology. The instruments will be reviewed based on feedback from investigators, and–after a first review after 1 year–triannually through systematic follow-up surveys. Updated versions will be made available through http://endometriosisfoundation.org/ephect. PMID:25256930

  15. Results of toxicity tests and chemical analyses conducted on sediments collected from the TNX Outfall Delta Operable Unit, July 1999

    SciTech Connect

    Specht, W.L.

    2000-02-11

    In order to provide unit specific toxicity data that will be used to address critical uncertainty in the ecological risk assessment (ERA) for the TNX Outfall Delta Operable Unit (TNXOD OU), sediments were collected from eight locations in the Inner Swamp portion of the operable unit and two unit specific background locations. These samples were analyzed for total mercury, total uranium, and sediment toxicity.

  16. [The influence of spray drying process conditions on physical, chemical properties and lung inhaling performance of Panax notoginseng saponins - tanshinone II A composite particles].

    PubMed

    Wang, Hua-Mei; Fu, Ting-Ming; Guo, Li-Wei

    2013-06-01

    This study is to report the influence of conditions in spray drying process on physical and chemical properties and lung inhaling performance of Panax notoginseng Saponins - Tanshinone II A composite particles. According to the physical and chemical properties of the two types of components within the composite particles, three solvent systems were selected including ethanol, ethanol : acetone (9 : 1, v/v) and ethanol : acetone (4 : 1, v/v), and three inlet temperature: 110 degrees C, 120 degrees C, 130 degrees C to prepare seven different composite particle samples; each sample was characterized using laser diffraction, scanning electron microscopy (SEM), dynamic vapour sorption (DVS) and atomic force microscope (AFM), and their aerodynamic behavior was evaluated by a Next Generation Impactor (NGI). The results indicate that under the conditions of using the mixed solvent system of ethanol--acetone volume ratio of 9 : 1, and the inlet temperature of 110 degrees C, the resulting composite particles showed rough surface, with more tanshinone II A distributing in the outer layer, such composite particles have the best lung inhaling performance and the fine particle fraction (FPF) close to 60%. Finally it is concluded that by adjusting the conditions in co-spray drying process, the distribution amount and existence form of tanshinone II A in the outer layer of the particles can be changed so that to enhance lung inhaling performance of the drug composite particles. PMID:23984530

  17. Organic Chemical Concentrations and Reproductive Biomarkers in Common Carp (Cyprinus carpio) Collected from Two Areas in Lake Mead, Nevada, May 1999-May 2000

    USGS Publications Warehouse

    Goodbred, Steven L.; Leiker, Thomas J.; Patiño, Reynaldo; Jenkins, Jill A.; Denslow, Nancy D.; Orsak, Erik; Rosen, Michael R.

    2007-01-01

    The U.S. Geological Survey, in cooperation with the U.S. Fish and Wildlife Service, National Park Service, Bureau of Reclamation, and Nevada Department of Wildlife, collected and assessed data to determine the general health and reproductive status of common carp (Cyprinus carpio) at two study areas in Lake Mead, Nevada, during May 1999-May 2000. These data will form the basis of interpretations and provide a comparison for continuing studies on the health of the ecosystem in Lake Mead. One study area, Las Vegas Bay, is in the western part of Lake Mead. Las Vegas Bay receives inflows from Las Vegas Wash, which is predominantly tertiary-treated wastewater effluent, and to a lesser extent stormwater runoff from Las Vegas, Henderson, and other nearby communities, and from ground water underlying Las Vegas Valley. The other study area, Overton Arm, is in the northern extent of Lake Mead. Overton Arm receives inflow from the Virgin and Muddy Rivers, which historically are not influenced by wastewater effluent. Both sexes of common carp were collected bimonthly for 12 months using boat-mounted electrofishing gear (a direct electric current is used to temporarily immobilize fish for capture) to determine their health and reproductive status and any relation between these factors and environmental contaminants. This report presents fish tissue chemistry, organic chemical compound concentrations, and biomarker data for 83 male common carp collected from Las Vegas Bay, similar organic chemistry results for 15 male common carp, and similar biomarker measures for 80 male common carp collected from Overton Arm. Tissue chemistry results also are presented for 16 female common carp and biomarker measures for 79 female common carp collected from Las Vegas Bay, and tissue chemistry results for 15 female common carp and biomarker measures for 81 female common carp collected from Overton Arm. Thirty-three organic chemical compounds plus total concentrations for four groups of compounds (chlordanes, polychlorinated biphenyls [PCBs], brominated diphenyl ethers [BDEs], and triclosans) were analyzed from extracts of whole-body tissue using gas chromatography/mass spectrometry in male common carp from Las Vegas Bay during May 1999 through May 2000. All 33 compounds were detected in at least one sample of whole-body tissue from male common carp collected in Las Vegas Bay. In Overton Arm, 37 organic compounds plus total concentrations of three groups of compounds (PCBs, BDEs, and triclosans) were analyzed in male common carp where 20 (54 percent) of the compounds were detected. Sixteen of the 33 compounds detected in male common carp from Las Vegas Bay and 10 compounds detected in males from Overton Arm have the potential to disrupt the endocrine system in fish in Lake Mead. During May and June 1999, the mean concentration of all organic compounds detected in male common carp was 670 micrograms per kilogram from Las Vegas Bay and 109 micrograms per kilogram from Overton Arm. Twenty-seven organic compounds plus total PCBs were analyzed from extracts of whole-body tissue in female common carp collected in Las Vegas Bay and Overton Arm during May 1999. Twenty-four (86 percent) of these compounds were detected in at least one sample of whole-body tissue from female common carp collected from Las Vegas Bay while 10 (36 percent) chemical compounds were detected in female common carp from Overton Arm during that same period. Median concentrations of all chemical compounds were higher in female common carp from Las Vegas Bay compared to those collected from Overton Arm except Dacthal (DCPA), which was similar between sites. Biomarker measures obtained for male and female common carp include gonadosomatic index (percentage of gonad weight to total body weight), plasma vitellogenin (a phospholipid protein normally produced by female common carp and other oviparous fish), and condition factor [body weight/(fork length)3]. Biomarker measures for male c

  18. Adsorption of aqueous Cd(II) and Pb(II) on activated carbon nanopores prepared by chemical activation of doum palm shell.

    PubMed

    Gaya, Umar Ibrahim; Otene, Emmanuel; Abdullah, Abdul Halim

    2015-01-01

    Non-uniformly sized activated carbons were derived from doum palm shell, a new precursor, by carbonization in air and activation using KOH, NaOH and ZnCl2. The activated carbon fibres were characterised by X-ray diffraction, N2 adsorption-desorption, scanning electron microscopy, particle size analysis and evaluated for Cd(II) and Pb(II) removal. The 40-50 nm size, less graphitic, mesoporous NaOH activated carbon yielded high adsorption efficiency, pointing largely to the influence surface area. The performance of the KOH based activated carbon was arguably explained for the first time in terms of crystallinity. The efficiencies of the mesoporous ZnCl2-formulated activated carbon diminished due to the presence of larger particles. Batch adsorption of divalent metals revealed dependence on adsorbent dose, agitation time, pH and adsorbate concentrations with high adsorption efficiencies at optimum operating parameters. The equilibrium profiles fitted Langmuir and Freundlich isotherms, and kinetics favoured pseudo-second order model. The study demonstrated the practicability of the removal of alarming levels of cadmium and lead ions from industrial effluents. PMID:26339560

  19. Novel biosorbent with high adsorption capacity prepared by chemical modification of white pine (Pinus durangensis) sawdust. Adsorption of Pb(II) from aqueous solutions.

    PubMed

    Salazar-Rabago, J J; Leyva-Ramos, R

    2016-03-15

    The natural sawdust (NS) from white pine (Pinus durangensis) was chemically modified by a hydrothermal procedure using citric, malonic and tartaric acids. The adsorption capacity of modified sawdust (MS) towards Pb(II) was considerably enhanced due to the introduction of carboxylic groups on the surface of MS during the modification, and the adsorption capacity was almost linearly dependent on the concentration of carboxylic sites. The NS surface was acidic, and the MS surface became more acidic after the modification. At T = 25 °C and pH = 5, the maximum adsorption capacity of the optimal MS towards Pb(II) was 304 mg/g, which is exceptionally high compared to NS and other MS reported previously. The adsorption capacity of MS was considerably reduced from 304 to 154 mg/g by decreasing the solution pH from 5 to 3 due to electrostatic interactions. The adsorption of Pb(II) on MS was reversible at pH = 2, but not at pH = 5. The contribution percentage of ion exchange to the overall adsorption capacity ranged from 70 to 99% and 10-66% at the initial pH of 3 and 5, respectively. Hence, the adsorption of Pb(II) on MS was mainly due to ion exchange at pH = 3 and to both ion exchange and electrostatic attraction at pH = 5. PMID:26773434

  20. Effects of angiotensin II, atrial natriuretic peptide and endothelin-1 on proliferation and steroidogenic output of bovine granulosa cells cultured in a chemically defined system.

    PubMed

    Montrezor, L H; Piccinato, C A; Collares, C V A; Vireque, A A; Silva, A A M Rosa E

    2015-01-01

    The role of local factors in the modulation of granulosa cell (GC) proliferation and differentiation is well described in the literature. The present work used a long-term bovine GC culture, in chemically defined medium without gonadotropins, to study the effects of angiotensin II (Ang II), atrial natriuretic peptide (ANP) and endothelin-1 (EDN1) on the steroidogenesis and cellular proliferation. Small follicles (3-5mm in diameter) from ovaries obtained in the slaughterhouse were selected according to their vascularization and follicular fluid color in order to isolate GC. Granulosa cells were plated at a density of 5×10(4)cells/well in supplemented alpha-MEM containing 3 levels (0, 10(-8)M and 10(-7)M) of Ang II, ANP, and EDN1 for up to 96h. Proliferation was evaluated by tritiated thymidine incorporation. The results showed that Ang II, ANP, and EDN1 modulate the steroidogenic output and proliferation index of GCs depending on the dose and time of culture. The selected vasoactive peptides increased androstenedione (A4) consumption in parallel with increased estradiol (E2). Although the peptides also promoted a significant increase in pregnenolone (P5) and progesterone (P4) production, the E2:P4 ratio was maintained at a high at most of the tested doses. Taken together, our in vitro data suggest that these vasoactive factors may have a direct effect on physiological follicular deviation, favoring dominance of the selected follicle. PMID:25500175

  1. Comparison of the chemical composition of Valeriana parviflora essential oils collected in the Venezuelan Andes in two different seasons.

    PubMed

    Fernández, Sammy; Rondón, María; Rojas, Janne; Morales, Antonio; Rojas-Fermin, Luis

    2015-04-01

    The essential oils obtained by hydrodistillation of the aerial parts of Valerianaparviflora (Trevir) BM Vadillo, an endemic species of the Venezuelan Andes, collected from the same location in two different seasons (dry and rainy) of the year, were analyzed by GC/MS. The essential oil obtained during the dry season showed linalool (11.9%), eugenol (8.9%), p-menth-l-en-9-al (8.7%) and α-terpineol (7.7%) as main components, while the oil obtained from the rainy season collection showed o-xylol (16.2%), 3-methyl isovaleric acid (10.6%) and geranial (9.5%) as major compounds. Some of the differences in the composition of these oils might be due to the climatic conditions at the time of harvesting. PMID:25973503

  2. The chemical abundances of the stellar populations in the Leo I and II dSph galaxies

    NASA Astrophysics Data System (ADS)

    Bosler, Tammy L.; Smecker-Hane, Tammy A.; Stetson, Peter B.

    2007-06-01

    We have obtained calcium abundances and radial velocities for 102 red giant branch (RGB) stars in the Leo I dwarf spheroidal galaxy (dSph) and 74 RGB stars in the Leo II dSph using the low-resolution spectrograph (LRIS) on the Keck I 10-m telescope. We report on the calcium abundances [Ca/H] derived from the strengths of the CaII triplet absorption lines at 8498, 8542 and 8662 Å in the stellar spectra using a new empirical CaII triplet calibration to [Ca/H]. The two galaxies have different average [Ca/H] values of -1.34 +/- 0.02 for Leo I and -1.65 +/- 0.02 for Leo II with intrinsic abundance dispersions of 1.2 and 1.0 dex, respectively. The typical random and total errors in derived abundances are 0.10 and 0.17 dex per star. For comparison to the existing literature, we also converted our CaII measurements to [Fe/H] on the scale of Carretta and Gratton (1997) though we discuss why this may not be the best determinant of metallicity; Leo I has a mean [Fe/H] = -1.34 and Leo II has a mean [Fe/H] = -1.59. The metallicity distribution function of Leo I is approximately Gaussian in shape with an excess at the metal-rich end, while that of Leo II shows an abrupt cut-off at the metal-rich end. The lower mean metallicity of Leo II is consistent with the fact that it has a lower luminosity, hence lower the total mass than Leo I; thus, the evolution of Leo II may have been affected more by mass lost in galactic winds. Our direct and independent measurement of the metallicity distributions in these dSph will allow a more accurate star-formation histories to be derived from future analysis of their colour-magnitude diagrams(CMDs). Data presented herein were obtained at the W.M. Keck Observatory, which is operated as a scientific partnership among the California Institute of Technology, the University of California and the National Aeronautics and Space Administration. The Observatory was made possible by the generous financial support of the W. M. Keck Foundation. E-mail: tlbosler@yahoo.com

  3. 77 FR 62532 - Agency Information Collection Activities; Proposed Collection; Comments Requested: Import/Export...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-10-15

    ...: Import/Export Declaration for List I and List II Chemicals; DEA Forms 486 and 486A ACTION: 30-Day Notice. The Department of Justice (DOJ), Drug Enforcement Administration (DEA) will be submitting the... Department sponsoring the collection: Form number: DEA Forms 486 and 486A. Component: Office of...

  4. 78 FR 19312 - Agency Information Collection Activities; Proposed Collection; Comments Requested: Import/Export...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-03-29

    ...: Import/Export Declaration for List I and List II Chemicals, DEA Forms 486 and 486A ACTION: 60-Day Notice. The Department of Justice (DOJ), Drug Enforcement Administration (DEA), will be submitting the... the Department of Justice sponsoring the collection: Form Number: DEA Forms 486 and 486A....

  5. Chemical Characterization of Individual Particles and Residuals of Cloud Droplets and Ice Crystals Collected On Board Research Aircraft in the ISDAC 2008 Study

    SciTech Connect

    Hiranuma, Naruki; Brooks, Sarah D.; Moffet, Ryan C.; Glen, Andrew; Laskin, Alexander; Gilles, Marry K.; Liu, Peter; MacDonald, A. M.; Strapp, J. Walter; McFarquhar, Greg

    2013-06-24

    Although it has been shown that size of atmospheric particles has a direct correlation with their ability to act as cloud droplet and ice nuclei, the influence of composition of freshly emitted and aged particles in nucleation processes is poorly understood. In this work we combine data from field measurements of ice nucleation with chemical imaging of the sampled particles to link aerosol composition with ice nucleation ability. Field measurements and sampling were conducted during the Indirect and Semidirect Aerosols Campaign (ISDAC) over Barrow, Alaska, in the springtime of 2008. In-situ ice nucleation measurements were conducted using a Continuous Flow Diffusion Chamber (CFDC). Measured number concentrations of ice nuclei (IN) varied from frequent values of 0.01 per liter to more than 10 per liter. Residuals of airborne droplets and ice crystals were collected through a counterflow virtual impactor (CVI). The compositions of individual atmospheric particles and the residuals were studied using Computer Controlled Scanning Electron Microscopy with Energy Dispersive X-ray analysis (CCSEM/EDX) and Scanning Transmission X-ray Microscopy coupled with Near Edge X-ray Absorption Fine Structure spectroscopy (STXM/NEXAFS). Chemical analysis of cloud particle residuals collected during an episode of high ice nucleation suggests that both size and composition may influence aerosol's ability to act as IN. The STXM/NEXAFS chemical composition maps of individual residuals have characteristic structures of either inorganic or black carbon cores coated by organic materials. In a separate flight, particle samples from a biomass burning plume were collected. Although it has previously been suggested that episodes of biomass burning contribute to increased numbers of highly effective ice nuclei, in this episode we observed that only a small fraction were effective ice nuclei. Most of the particles from the biomass plume episode were smaller in size and were composed of homogeneous organic material without identifiable cores.

  6. Dietary supplementation of curcumin enhances antioxidant and phase II metabolizing enzymes in ddY male mice: possible role in protection against chemical carcinogenesis and toxicity.

    PubMed

    Iqbal, Mohammad; Sharma, Som Datta; Okazaki, Yasumasa; Fujisawa, Masayoshi; Okada, Shigeru

    2003-01-01

    Dietary antioxidants protect laboratory animals against the induction of tumours by a variety of chemical carcinogens. Among possible mechanism of protection against chemical carcinogenesis could be mediated via-antioxidant-dependent induction of detoxifying enzymes. Curcumin, a yellow pigment from Curcuma longa, is a major component of turmeric and is commonly used as a spice and food colouring material and exhibits antiinflammatory antitumour, and antioxidant properties. In this study we therefore investigated the effect of dietary supplementation of curcumin on the activities of antioxidant and phase II-metabolizing enzymes involved in detoxification, and production of reactive oxygen species were quantified in ddY male mice. Dietary supplementation of curcumin (2%, w/v) to male ddY mice for 30 days significantly increased the activities of glutathione peroxidase, glutathione reductase, glucose-6-phosphate dehydrogenase and catalase to 189%, 179%, 189%, and 181% in liver and 143%, 134%, 167% and 115% in kidney respectively as compared with corresponding normal diet fed control (P<0.05-0.001). Parallel to these changes, curcumin feeding to mice also resulted in a considerable enhancement in the activity of phase II-metabolizing enzymes viz. glutathione S-transferase and quinone reductase to 1.7 and 1.8 times in liver and 1.1 and 1.3 times in kidney respectively as compared with corresponding normal diet fed control (P<0.05-0.01). In general, the increase in activities of antioxidant and phase II-metabolizing enzymes was more pronounced in liver as compared to kidney. The induction of such detoxifying enzymes by curcumin suggest the potential value of this compound as protective agent against chemical carcinogenesis and other forms of electrophilic toxicity. The significance of these results can be implicated in relation to cancer chemopreventive effects of curcumin against the induction of tumours in various target organs. PMID:12710595

  7. Organic, inorganic and total mercury determination in fish by chemical vapor generation with collection on a gold gauze and electrothermal atomic absorption spectrometry

    NASA Astrophysics Data System (ADS)

    Duarte, Fbio Andrei; Bizzi, Cezar Augusto; Antes, Fabiane Goldschmidt; Dressler, Valderi Luiz; Flores, rico Marlon de Moraes

    2009-06-01

    A method for organic, inorganic and total mercury determination in fish tissue has been developed using chemical vapor generation and collection of mercury vapor on a gold gauze inside a graphite tube and further atomization by electrothermal atomic absorption spectrometry. After drying and cryogenic grinding, potassium bromide and hydrochloric acid solution (1 mol L - 1 KBr in 6 mol L - 1 HCl) was added to the samples. After centrifugation, total mercury was determined in the supernatant. Organomercury compounds were selectively extracted from KBr solution using chloroform and the resultant solution was back extracted with 1% m/v L-cysteine. This solution was used for organic Hg determination. Inorganic Hg remaining in KBr solution was directly determined by chemical vapor generation electrothermal atomic absorption spectrometry. Mercury vapor generation from extracts was performed using 1 mol L - 1 HCl and 2.5% m/v NaBH 4 solutions and a batch chemical vapor generation system. Mercury vapor was collected on the gold gauze heated resistively at 80 C and the atomization temperature was set at 650 C. The selectivity of extraction was evaluated using liquid chromatography coupled to chemical vapor generation and determination by inductively coupled plasma mass spectrometry. The proposed method was applied for mercury analysis in shark, croaker and tuna fish tissues. Certified reference materials were used to check accuracy and the agreement was better than 95%. The characteristic mass was 60 pg and method limits of detection were 5, 1 and 1 ng g - 1 for organic, inorganic and total mercury, respectively. With the proposed method it was possible to analyze up to 2, 2 and 6 samples per hour for organic, inorganic and total Hg determination, respectively.

  8. Chemical studies of Chinese licorice-roots. I. Elucidation of five new flavonoid constituents from the roots of Glycyrrhiza glabra L. collected in Xinjiang.

    PubMed

    Kitagawa, I; Chen, W Z; Hori, K; Harada, E; Yasuda, N; Yoshikawa, M; Ren, J

    1994-05-01

    From the air-dried roots of Glycyrrhiza glabra L. (Leguminosae) collected in Xinjiang province, China ("Shinkyo-Kanzo" in Japanese), five new flavonoid compounds named glucoliquiritin apioside (1) (a flavonone bisdesmoside), prenyllicoflavone A (5) (a bisprenylflavone), shinflavone (7) (a prenylated pyranoflavanone), shinpterocarpin (9) and 1-methoxyphaseollin (12) (both pyranopterocarpans), were isolated together with eight known saponins, seven known flavonoid glycosides, and eleven flavonoids. The structures of the new compounds have been elucidated on the basis of their chemical and physicochemical properties. PMID:8069956

  9. Validation of DSMC results for chemically nonequilibrium air flows against measurements of the electron number density in RAM-C II flight experiment

    SciTech Connect

    Shevyrin, Alexander A.; Vashchenkov, Pavel V.; Bondar, Yevgeniy A.; Ivanov, Mikhail S.

    2014-12-09

    An ionized flow around the RAM C-II vehicle in the range of altitudes from 73 to 81 km is studied by the Direct Simulation Monte Carlo (DSMC) method with three models of chemical reactions. It is demonstrated that vibration favoring in reactions of dissociation of neutral molecules affects significantly the predicted values of plasma density in the shock layer, and good agreement between the results of experiments and DSMC computations can be achieved in terms of the plasma density as a function of the flight altitude.

  10. The population of planetary nebulae and H II regions in M 81. A study of radial metallicity gradients and chemical evolution

    NASA Astrophysics Data System (ADS)

    Stanghellini, L.; Magrini, L.; Villaver, E.; Galli, D.

    2010-10-01

    Context. M 81 is an ideal laboratory to investigate the galactic chemical and dynamical evolution through the study of its young and old stellar populations. Aims: We analyze the chemical abundances of planetary nebulae and H ii regions in the M 81 disk for insight on galactic evolution, and compare it with that of other galaxies, including the Milky Way. Methods: We acquired Hectospec/MMT spectra of 39 PNe and 20 H ii regions, with 33 spectra viable for temperature and abundance analysis. Our PN observations represent the first PN spectra in M 81 ever published, while several H ii region spectra have been published before, although without a direct electron temperature determination. We determine elemental abundances of helium, nitrogen, oxygen, neon, sulfur, and argon in PNe and H ii regions, and determine their averages and radial gradients. Results: The average O/H ratio of PNe compared to that of the H ii regions indicates a general oxygen enrichment in M 81 in the last ~10 Gyr. The PN metallicity gradient in the disk of M 81 is Δlog(O/H)/ΔRG = -0.055 ± 0.02 dex/kpc. Neon and sulfur in PNe have a radial distribution similar to that of oxygen, with similar gradient slopes. If we combine our H ii sample with the one in the literature we find a possible mild evolution of the gradient slope, with results consistent with gradient steepening with time. Additional spectroscopy is needed to confirm this trend. There are no type I PNe in our M 81 sample, consistently with the observation of only the brightest bins of the PNLF, the galaxy metallicity, and the evolution of post-AGB shells. Conclusions: Both the young and the old populations of M 81 disclose shallow but detectable negative radial metallicity gradient, which could be slightly steeper for the young population, thus not excluding a mild gradients steepening with the time since galaxy formation. During its evolution M 81 has been producing oxygen; its total oxygen enrichment exceeds that of other nearby galaxies. Full Tables 2 and 3 are only available in electronic form at the CDS via anonymous ftp to cdsarc.u-strasbg.fr (130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/521/A3

  11. Fractionally distilled SRC-I, SRC-II, EDS, H-Coal and ITSL direct coal liquefaction process materials: a comparative summary of chemical analysis and biological testing

    SciTech Connect

    Wright, C.W.; Later, D.W.; Dauble, D.D.; Wilson, B.W.

    1985-07-01

    This document reports and compares the results compiled from chemical analyses and biological testing of coal liquefaction process materials which were fractionally distilled, after production, into various comparable boiling-point range cuts. Comparative analyses were performed on solvent refined coal (SRC)-I, SRC-II, H-Coal, EDS an integrated two-stage liquefaction (ITSL) distillate materials. Mutagenicity and carcinogenicity assays were conducted in conjunction with chromatographic and mass spectrometric analyses to provide detailed, comparative, chemical and biological assessments. Where possible, results obtained from the distillate cuts are compared to those from coal liquefaction materials with limited boiling ranges. Work reported here was conducted by investigators in the Biology and Chemistry Department at the Pacific Northwest Laboratory (PNL), Richland, WA. 38 refs., 16 figs., 27 tabs.

  12. Wear Mechanisms of Carbon-Based Refractory Materials in SiMn Tap-HolesPart II: In Situ Observation of Chemical Reactions

    NASA Astrophysics Data System (ADS)

    Steenkamp, J. D.; Pistorius, P. Chris; Tangstad, M.

    2015-04-01

    The purpose of the study presented here is to determine to what extent chemical reactions between carbon-based refractory and slag or metal in the tap-hole of a SiMn furnace can contribute to wear of tap-hole refractory. The results of the study are reported in two parts. In Part I, thermodynamic calculations suggested that reaction between silicomanganese slag and carbon-based tap-hole refractory is possible, and experiments with nominally pure materials support this. However, practical refractory materials are by no means pure materials and contain secondary phases and porosity which can be expected to affect reaction with slag. In Part II, such reactions are examined experimentally, in cup and wettability tests, using commercially available carbon block and cold-ramming paste refractory materials and mainly industrial SiMn slag. Clear evidence was found of chemical reaction at approximately 1870 K (approximately 1600 C), forming SiC and, it appears, metal droplets. Both carbon block and ramming paste refractory reacted with slag, with preferential attack on and penetration into the binder phase rather than aggregate particles. The two types of carbon-based refractory materials showed similar extents of chemical reaction observed as wetting and penetration in the laboratory tests. The differences in refractory life observed practically in industrial furnaces should therefore be attributed to wear mechanisms other than pure chemical wear as studied in this work.

  13. Chemical analyses of soil samples collected from the Sandia National Laboratories/NM, Tonopah Test Range environs, 1994-2005.

    SciTech Connect

    Deola, Regina Anne; Oldewage, Hans D.; Herrera, Heidi M.; Miller, Mark Laverne

    2006-05-01

    From 1994 through 2005, the Environmental Management Department of Sandia National Laboratories (SNL) at the Tonopah Test Range (TTR), NV, has collected soil samples at numerous locations on-site, on the perimeter, and off-site for the purpose of determining potential impacts to the environs from operations at TTR. These samples were submitted to an analytical laboratory of metal-in-soil analyses. Intercomparisons of these results were then made to determine if there was any statistical difference between on-site, perimeter, and off-site samples, or if there were increasing or decreasing trends which indicated that further investigation may be warranted. This work provided the SNL Environmental Management Department with a sound baseline data reference against which to compare future operational impacts. In addition, it demonstrates the commitment that the Laboratories have to go beyond mere compliance to achieve excellence in its operations. This data is presented in graphical format with narrative commentaries on particular items of interest.

  14. Water-quality data-collection activities in Colorado and Ohio; Phase II, Evaluation of 1984 field and laboratory quality-assurance practices

    USGS Publications Warehouse

    Childress, C.J.; Chaney, T.M.; Myers, Donna; Norris, J.M.; Hren, Janet

    1987-01-01

    Serious questions have been raised by Congress about the usefulness of water quality data for addressing issues of regional and national scope and, especially, for characterizing the current quality of the Nation 's streams and groundwater. In response, the U.S. Geological Survey conducted a pilot study in Colorado and Ohio to: (1) determine the characteristics of current (1984) water quality data collection activities of Federal, regional, State, and local agencies, and academic institutions; and (2) determine how well the data from these activities, collected for various purposes and using different procedures, can be used to improve the ability to answer major broad scope questions, such as: what are (or were) natural or near-natural water quality conditions; what are existing water quality conditions; and, how water quality has changed and how the changes relate to human activities. Colorado and Ohio were chosen for the pilot study largely because they represent regions with different types of water quality concerns and programs. The study has been divided into three phases, the objectives of which are: Phase I - Inventory water quality data collection programs, including costs, and identify those programs that met a set of broad criteria for producing data that are potentially appropriate for water quality assessments of regional and national scope. Phase II - Evaluate the quality assurance of field and laboratory procedures used in producing the data from programs that met the broad criteria of Phase I. Phase III - Compile the qualifying data and evaluate the adequacy of this data base for addressing selected water quality questions of regional and national scope. (Author 's abstract)

  15. Chemical characterization of individual particles and residuals of cloud droplets and ice crystals collected on board research aircraft in the ISDAC 2008 study

    NASA Astrophysics Data System (ADS)

    Hiranuma, N.; Brooks, S. D.; Moffet, R. C.; Glen, A.; Laskin, A.; Gilles, M. K.; Liu, P.; MacDonald, A. M.; Strapp, J. W.; McFarquhar, G. M.

    2013-06-01

    Ambient particles and the dry residuals of mixed-phase cloud droplets and ice crystals were collected during the Indirect and Semi-Direct Aerosol Campaign (ISDAC) near Barrow, Alaska, in spring of 2008. The collected particles were analyzed using Computer Controlled Scanning Electron Microscopy with Energy Dispersive X-ray analysis and Scanning Transmission X-ray Microscopy coupled with Near Edge X-ray Absorption Fine Structure spectroscopy to identify physico-chemical properties that differentiate cloud-nucleating particles from the total aerosol population. A wide range of individually mixed components was identified in the ambient particles and residuals including organic carbon compounds, inorganics, carbonates, and black carbon. Our results show that cloud droplet residuals differ from the ambient particles in both size and composition, suggesting that both properties may impact the cloud-nucleating ability of aerosols in mixed-phase clouds. The percentage of residual particles which contained carbonates (47%) was almost four times higher than those in ambient samples. Residual populations were also enhanced in sea salt and black carbon and reduced in organic compounds relative to the ambient particles. Further, our measurements suggest that chemical processing of aerosols may improve their cloud-nucleating ability. Comparison of results for various time periods within ISDAC suggests that the number and composition of cloud-nucleating particles over Alaska can be influenced by episodic events bringing aerosols from both the local vicinity and as far away as Siberia.

  16. Chromosome aberration and sister chromatid exchange tests in Chinese hamster ovary cells in vitro: II. Results with 20 chemicals

    SciTech Connect

    Loveday, K.S.; Lugo, M.H. ); Resnick, M.A.; Anderson, B.E.; Zeiger, E. )

    1989-01-01

    Twenty chemicals were tested for their ability to induce sister chromatid exchanges (SCEs) and chromosomal aberrations (ABs) in cultured Chinese hamster ovary cells (CHO). These chemicals were tested with and without an added metabolic activation system (rat liver S9 fraction). Four chemicals were negative in both assays, 1 induced ABs only, and 15 were positive for SCEs; 6 of these 15 also induced ABs. The effect of cell harvest time on the ability to detect the induction of chromosomal aberrations was examined for six chemicals. Five of these had caused at least one of the following cell cycle delay, aberrations observed in first division metaphase cells in SCE assay, or a weak response in the standard AB assay (10-12-hr growth period). Three chemicals, chlorinated trisodium phosphate, 1,2-dibromo-3-chloropropane, and tetrakis(hydroxymethyl)phosphonium chloride, were positive using both the standard and extended harvest times. N-Nitrosodimethylamine and diphenhydramine HCl were only positive using an extended harvest time, and malonaldehyde was negative using both standard and extended harvest times.

  17. Binary classification of a large collection of environmental chemicals from estrogen receptor assays by quantitative structure-activity relationship and machine learning methods.

    PubMed

    Zang, Qingda; Rotroff, Daniel M; Judson, Richard S

    2013-12-23

    There are thousands of environmental chemicals subject to regulatory decisions for endocrine disrupting potential. The ToxCast and Tox21 programs have tested ∼8200 chemicals in a broad screening panel of in vitro high-throughput screening (HTS) assays for estrogen receptor (ER) agonist and antagonist activity. The present work uses this large data set to develop in silico quantitative structure-activity relationship (QSAR) models using machine learning (ML) methods and a novel approach to manage the imbalanced data distribution. Training compounds from the ToxCast project were categorized as active or inactive (binding or nonbinding) classes based on a composite ER Interaction Score derived from a collection of 13 ER in vitro assays. A total of 1537 chemicals from ToxCast were used to derive and optimize the binary classification models while 5073 additional chemicals from the Tox21 project, evaluated in 2 of the 13 in vitro assays, were used to externally validate the model performance. In order to handle the imbalanced distribution of active and inactive chemicals, we developed a cluster-selection strategy to minimize information loss and increase predictive performance and compared this strategy to three currently popular techniques: cost-sensitive learning, oversampling of the minority class, and undersampling of the majority class. QSAR classification models were built to relate the molecular structures of chemicals to their ER activities using linear discriminant analysis (LDA), classification and regression trees (CART), and support vector machines (SVM) with 51 molecular descriptors from QikProp and 4328 bits of structural fingerprints as explanatory variables. A random forest (RF) feature selection method was employed to extract the structural features most relevant to the ER activity. The best model was obtained using SVM in combination with a subset of descriptors identified from a large set via the RF algorithm, which recognized the active and inactive compounds at the accuracies of 76.1% and 82.8% with a total accuracy of 81.6% on the internal test set and 70.8% on the external test set. These results demonstrate that a combination of high-quality experimental data and ML methods can lead to robust models that achieve excellent predictive accuracy, which are potentially useful for facilitating the virtual screening of chemicals for environmental risk assessment. PMID:24279462

  18. Report on NCI symposium: comparison of mechanisms of carcinogenesis by radiation and chemical agents. II. Cellular and animal models

    SciTech Connect

    Fry, R.J.M.

    1984-01-01

    The point at which the common final pathway for induction of cancer by chemical carcinogens and ionizing radiation has not been identified. Although common molecular targets are suggested by recent findings about the role of oncogenes, the mechanism by which the deposition of radiation energy and the formation of adducts or other DNA lesions induced by chemicals affects the changes in the relevant targets may be quite different. The damage to DNA that plays no part in the transformation events, but that influences the stability of the genome, and therefore, the probability of subsequent changes that influence tumorigenesis may be more readily induced by some agents than others. Similarly, the degree of cytotoxic effects that disrupt tissue integrity and increase the probability of expression of initiated cells may be dependent on the type of carcinogen. Also, evidence was presented that repair of the initial lesions could be demonstrated after exposure to low-LET radiation but not after exposure to chemical carcinogens.

  19. Chemicals of emerging concern in water and bottom sediment in Great Lakes areas of concern, 2010 to 2011-Collection methods, analyses methods, quality assurance, and data

    USGS Publications Warehouse

    Lee, Kathy E.; Langer, Susan K.; Menheer, Michael A.; Foreman, William T.; Furlong, Edward T.; Smith, Steven G.

    2012-01-01

    The U.S. Geological Survey (USGS) cooperated with the U.S. Environmental Protection Agency and the U.S. Fish and Wildlife Service on a study to identify the occurrence of chemicals of emerging concern (CECs) in water and bottom-sediment samples collected during 2010–11 at sites in seven areas of concern (AOCs) throughout the Great Lakes. Study sites include tributaries to the Great Lakes in AOCs located near Duluth, Minn.; Green Bay, Wis.; Roches­ter, N.Y.; Detroit, Mich.; Toledo, Ohio; Milwaukee, Wis.; and Ashtabula, Ohio. This report documents the collection meth­ods, analyses methods, quality-assurance data and analyses, and provides the data for this study. Water and bottom-sediment samples were analyzed at the USGS National Water Quality Laboratory in Denver, Colo., for a broad suite of CECs. During this study, 135 environmental and 23 field dupli­cate samples of surface water and wastewater effluent, 10 field blank water samples, and 11 field spike water samples were collected and analyzed. Sixty-one of the 69 wastewater indicator chemicals (laboratory method 4433) analyzed were detected at concentrations ranging from 0.002 to 11.2 micrograms per liter. Twenty-eight of the 48 pharmaceuticals (research method 8244) analyzed were detected at concentrations ranging from 0.0029 to 22.0 micro­grams per liter. Ten of the 20 steroid hormones and sterols analyzed (research method 4434) were detected at concentrations ranging from 0.16 to 10,000 nanograms per liter. During this study, 75 environmental, 13 field duplicate samples, and 9 field spike samples of bottom sediment were collected and analyzed for a wide variety of CECs. Forty-seven of the 57 wastewater indicator chemicals (laboratory method 5433) analyzed were detected at concentrations ranging from 0.921 to 25,800 nanograms per gram. Seventeen of the 20 steroid hormones and sterols (research method 6434) analyzed were detected at concentrations ranging from 0.006 to 8,921 nanograms per gram. Twelve of the 20 pharmaceuticals (research method 8244) analyzed were detected at concentrations ranging from 2.35 to 453.5 nanograms per gram. Six of the 11 antidepressants (research method 9008) analyzed were detected at concentrations ranging from 2.79 to 91.6 nanograms per gram.

  20. Highly sensitive sensing of zinc(II) by development and characterization of a PVC-based fluorescent chemical sensor

    NASA Astrophysics Data System (ADS)

    Aksuner, Nur; Henden, Emur; Yenigul, Berrin; Yilmaz, Ibrahim; Cukurovali, Alaaddin

    2011-03-01

    A sensor membrane with excellent performance based on 1-methyl-1-phenyl-3-[1-hydroxyimino-2-(succinimido)ethyl]cyclobutane has been developed for the determination of zinc(II) ions. The sensing membrane is capable of determining zinc(II) with an outstanding high selectivity over a dynamic range between 8.0 10 -8 and 1.6 10 -4 mol L -1 with a limit of detection of 2.5 10 -8 mol L -1 (1.6 ?g L -1). It can be easily and completely regenerated by using 0.1 mol L -1 EDTA solution. The optical sensor developed here was found to be stable, cost effective, easy to prepare, and has unique selectivity towards Zn 2+ ion with respect to common metal ions. The proposed sensor was then applied for the determination of zinc in tap water and hair samples with satisfactory results.

  1. Soft chemicals synthesis of a high-pressure phase of molybdenum trioxide: MoO{sub 3}-II

    SciTech Connect

    Baker, B.; Feist, T.P.; McCarron, E.M.

    1995-10-01

    Topotactic dehydration of either the white molybdenum trioxide monohydrate, MoO{sub 3}{center_dot}H{sub 2}O, or the hemihydrate MoO{sub 3}{center_dot}{1/2}H{sub 2}O, provides a convenient synthetic route to a high-pressure phase of molybdenum trioxide, MoO{sub 3-}II. The structural filiations between the various molybdenum trioxide hydrates phases are delineated, and simple mechanistic models for the transformations are proposed.

  2. Differential chemical probing of a group II self-splicing intron identifies bases involved in tertiary interactions and supports an alternative secondary structure model of domain V.

    PubMed Central

    Costa, M; Christian, E L; Michel, F

    1998-01-01

    Dimethyl sulfate modification was used to probe for tertiary structural elements in the group II intron PI.LSU/2 from the mitochondrial pre-ribosomal RNA of the brown alga Pylaiella littoralis. Modification of the lariat form of the intron under conditions that allow both native folding and conformational homogeneity is found to be generally consistent with secondary and tertiary structural features identified previously for group II ribozymes. A comparison of chemical probing at temperatures just below and above the first melting transition illustrates the cooperative unfolding of tertiary structure and identifies novel candidates for tertiary interactions in addition to defining elements of secondary structure. Substitution of the GAAA terminal loop of domain V is shown to be compatible with retention of conformational homogeneity (despite the loss of an important tertiary interaction), but produces a concise methylation footprint in domain I at the site previously shown to harbor the receptor for that loop. The analysis also identified two nucleotide positions in domain V with novel secondary and potential tertiary structural roles. The proposed refinement of domain V secondary structure is supported by an expanded comparative analysis of group II sequences and bears increased resemblance to U2:U6 snRNA pairing in the spliceosome. PMID:9740125

  3. Chemical and biological properties of diesel exhaust particles collected during selected segments of a simulated driving cycle

    SciTech Connect

    Bechtold, W.E.; Dutcher, J.S.; Mokler, B.V.; Lopez, J.A.; Wolf, I.; Li, A.P.; Henderson, T.R.; McClellan, R.O.

    1984-06-01

    Particle emissions, percentage of organic extractable materials, and mutagenicities of extracts from a diesel engine operating on a test stand have been determined for the full Federal Test Procedure driving cycle and several individual segments thereof. Particle samples were collected using a computer controlled high volume sampler. Extracts of the exhaust particles were screened for the potent mutagens nitropyrene/nitrofluoranthenes by mass spectrometry/mass spectrometry (MS/MS). Results indicate that a long acceleration from 0-55 mph produced approximately seven times more particles per second than the full cycle. Also, the 0- to 55-mph acceleration and a subsequent 55-mph cruise produced significantly higher amounts of mutagens than other segments or the full FTP cycle. A direct correlation of both NOx levels and temperature with mutagenicity was noted (r . 0.89 and r . 0.89). The specific activities of the extracts showed decreases or remained unchanged when assayed in TA-98 NR or TA-98 1,8 DNP6, nitroreductase deficient strains of TA-98. Three extracts were found to have high levels of nitropyrenes/nitrofluoranthenes, and two of the three had high specific activities in TA-98.

  4. Chemical analyses of soil samples collected from the Sandia National Laboratories, Kauai Test Facility, HI, 1999-2007.

    SciTech Connect

    Miller, Mark Laverne

    2007-11-01

    In 1999, 2002, and 2007, the Environmental Programs and Assurance Department of Sandia National Laboratories (SNL) at the Kauai Test Facility (KTF), HI, has collected soil samples at numerous locations on-site, on the perimeter, and off-site for determining potential impacts to the environs from operations at KTF. These samples were submitted to an analytical laboratory for metal-in-soil analyses. Intercomparisons of these results were then made to determine if there was any statistical difference between on-site, perimeter, and off-site samples, or if there were increasing or decreasing trends that indicated that further investigation might be warranted. This work provided the SNL Environmental Programs and Assurance Department with a sound baseline data reference against which to compare future operational impacts. In addition, it demonstrates the commitment that the Laboratories have to go beyond mere compliance to achieve excellence in its operations. This data is presented in graphical format with narrative commentaries on particular items of interest.

  5. Chemical analyses of soil samples collected from the Sandia National Laboratories, New Mexico environs, 1993-2005.

    SciTech Connect

    Deola, Regina Anne; Oldewage, Hans D.; Herrera, Heidi; Miller, Mark Laverne

    2006-03-01

    From 1993 through 2005, the Environmental Management Department of Sandia National Laboratories in Albuquerque, New Mexico (SNL/NM), has collected soil and sediment samples at numerous locations on-site, on the perimeter, and off-site for the purpose of determining potential impacts to the environs from operations at the Laboratories. These samples were submitted to an analytical laboratory for metal-in-soil analyses. Intercomparisons of these results were then made to determine if there was any statistical difference between on-site, perimeter, and off-site samples, or if there were year-to-year increasing or decreasing trends which indicated that further investigation may be warranted. This work provided the SNL Environmental Management Department with a sound baseline data reference against which to assess potential current operational impacts or to compare future operational impacts. In addition, it demonstrates the commitment that the Laboratories have to go beyond mere compliance to achieve excellence in its operations. This data is presented in graphical format with narrative commentaries on particular items of interest.

  6. Chemical and colloidal analyses of natural seep water collected from the exploratory studies facility inside Yucca Mountain, Nevada, USA.

    PubMed

    Cizdziel, James V; Guo, Caixia; Steinberg, Spencer M; Yu, Zhongbo; Johannesson, Karen H

    2008-02-01

    Yucca Mountain is being considered as a geological repository for the USA's spent nuclear fuel and high-level nuclear waste. Numerous groundwater seeps appeared during March 2005 within the exploratory studies facility (ESF), a tunnel excavated in the mountain. Because of the relevance to radionuclide transport and unsaturated zone-modeling studies, we analyzed the seep samples for major anions and cations, rare earth elements, and colloids. Major ion species and elemental concentrations in seep samples reflect interaction of the water with the volcanic rock and secondary calcites. Elemental fractograms from flow-injection field-flow fractionation ICP-MS scans detected Br, Ca, Cl, Cu, Fe, I, Mg, Si, Sr, W, and U at void fractions, suggesting they may be present in the form of dissolved anions. Colloids approximately 10 nm in hydrodynamic diameter, possibly calcite, were also present in the seepage samples. Geochemical calculations indicate, however, these may be an artifact (not present in the groundwater) which arose because of loss of CO2 during sample collection and storage. PMID:17505890

  7. Chemical Products in the Home, Workshop and Garden. Proceed with Caution; Consumer Safety in the Home, II.

    ERIC Educational Resources Information Center

    Saskatchewan Consumer and Commercial Affairs, Regina.

    The average home has chemical products to clean floors, kill insects, clean ovens, thin paint, remove grease, and perform countless other chores. Many consumers remain unaware of the dangers these products bring into the home. This booklet provides information on the safe use, storage, and disposal of these products. The compounds found in

  8. Chemical Products in the Home, Workshop and Garden. Proceed with Caution; Consumer Safety in the Home, II.

    ERIC Educational Resources Information Center

    Saskatchewan Consumer and Commercial Affairs, Regina.

    The average home has chemical products to clean floors, kill insects, clean ovens, thin paint, remove grease, and perform countless other chores. Many consumers remain unaware of the dangers these products bring into the home. This booklet provides information on the safe use, storage, and disposal of these products. The compounds found in…

  9. Biological profiling of the ToxCast Phase II Chemical Library in Primary Human Cell Co-Culture Systems

    EPA Science Inventory

    The U.S. EPAs ToxCast research project was developed to address the need for high-throughput testing of chemicals and a pathway-based approach to hazard screening. Phase I of ToxCast tested over 300 unique compounds (mostly pesticides and antimicrobials). With the addition of Ph...

  10. Toxicology studies of a chemical mixture of 25 groundwater contaminants. II. Immunosuppression in B6C3F1 mice

    SciTech Connect

    Germolec, D.R.; Yang, R.S.; Ackermann, M.F.; Rosenthal, G.J.; Boorman, G.A.; Blair, P.; Luster, M.I. )

    1989-10-01

    Concern over the potential adverse health effects of chemically contaminated groundwater has existed for many years. In general, these studies have focused on retrospective epidemiological studies for cancer risk. In the present studies, immune function was monitored in female B6C3F1 mice exposed to a chemical mixture in drinking water for either 14 or 90 days. The mixture consisted of 25 common groundwater contaminants frequently found near toxic waste dumps, as determined by EPA surveys. None of the animals developed overt signs of toxicity such as body or liver weight changes. Mice exposed to the highest dose of this mixture for 14 or 90 days showed immune function changes which could be related to rapidly proliferating cells, including suppression of hematopoietic stem cells and of antigen-induced antibody-forming cells. Some of these responses, e.g., granulocyte-macrophage colony formation, were also suppressed at lower concentrations of the chemical mixture. There were no effects on T cell function or T and B cell numbers in any of the treatment groups. Altered resistance to challenge with an infectious agent also occurred in mice given the highest concentration, which correlated with the immune function changes. Paired-water studies indicated that the immune effects were related to chemical exposure and not to decreased water intake. These results suggest that long-term exposure to contaminated groundwater may represent a risk to the immune system in humans.

  11. Biological profiling of the ToxCast Phase II Chemical Library in Primary Human Cell Co-Culture Systems

    EPA Science Inventory

    The U.S. EPA’s ToxCast research project was developed to address the need for high-throughput testing of chemicals and a pathway-based approach to hazard screening. Phase I of ToxCast tested over 300 unique compounds (mostly pesticides and antimicrobials). With the addition of Ph...

  12. Predicting chemically-induced skin reactions. Part II: QSAR models of skin permeability and the relationships between skin permeability and skin sensitization

    PubMed Central

    Alves, Vinicius M.; Muratov, Eugene; Fourches, Denis; Strickland, Judy; Kleinstreuer, Nicole; Andrade, Carolina H.; Tropsha, Alexander

    2015-01-01

    Skin permeability is widely considered to be mechanistically implicated in chemically-induced skin sensitization. Although many chemicals have been identified as skin sensitizers, there have been very few reports analyzing the relationships between molecular structure and skin permeability of sensitizers and non-sensitizers. The goals of this study were to: (i) compile, curate, and integrate the largest publicly available dataset of chemicals studied for their skin permeability; (ii) develop and rigorously validate QSAR models to predict skin permeability; and (iii) explore the complex relationships between skin sensitization and skin permeability. Based on the largest publicly available dataset compiled in this study, we found no overall correlation between skin permeability and skin sensitization. In addition, cross-species correlation coefficient between human and rodent permeability data was found to be as low as R2=0.44. Human skin permeability models based on the random forest method have been developed and validated using OECD-compliant QSAR modeling workflow. Their external accuracy was high (Q2ext = 0.73 for 63% of external compounds inside the applicability domain). The extended analysis using both experimentally-measured and QSAR-imputed data still confirmed the absence of any overall concordance between skin permeability and skin sensitization. This observation suggests that chemical modifications that affect skin permeability should not be presumed a priori to modulate the sensitization potential of chemicals. The models reported herein as well as those developed in the companion paper on skin sensitization suggest that it may be possible to rationally design compounds with the desired high skin permeability but low sensitization potential. PMID:25560673

  13. Predicting chemically-induced skin reactions. Part II: QSAR models of skin permeability and the relationships between skin permeability and skin sensitization

    SciTech Connect

    Alves, Vinicius M.; Muratov, Eugene; Fourches, Denis; Strickland, Judy; Kleinstreuer, Nicole; Tropsha, Alexander

    2015-04-15

    Skin permeability is widely considered to be mechanistically implicated in chemically-induced skin sensitization. Although many chemicals have been identified as skin sensitizers, there have been very few reports analyzing the relationships between molecular structure and skin permeability of sensitizers and non-sensitizers. The goals of this study were to: (i) compile, curate, and integrate the largest publicly available dataset of chemicals studied for their skin permeability; (ii) develop and rigorously validate QSAR models to predict skin permeability; and (iii) explore the complex relationships between skin sensitization and skin permeability. Based on the largest publicly available dataset compiled in this study, we found no overall correlation between skin permeability and skin sensitization. In addition, cross-species correlation coefficient between human and rodent permeability data was found to be as low as R{sup 2} = 0.44. Human skin permeability models based on the random forest method have been developed and validated using OECD-compliant QSAR modeling workflow. Their external accuracy was high (Q{sup 2}{sub ext} = 0.73 for 63% of external compounds inside the applicability domain). The extended analysis using both experimentally-measured and QSAR-imputed data still confirmed the absence of any overall concordance between skin permeability and skin sensitization. This observation suggests that chemical modifications that affect skin permeability should not be presumed a priori to modulate the sensitization potential of chemicals. The models reported herein as well as those developed in the companion paper on skin sensitization suggest that it may be possible to rationally design compounds with the desired high skin permeability but low sensitization potential. - Highlights: • It was compiled the largest publicly-available skin permeability dataset. • Predictive QSAR models were developed for skin permeability. • No concordance between skin sensitization and skin permeability has been found. • Structural rules for optimizing sensitization and penetration were established.

  14. Predicting chemically-induced skin reactions. Part II: QSAR models of skin permeability and the relationships between skin permeability and skin sensitization.

    PubMed

    Alves, Vinicius M; Muratov, Eugene; Fourches, Denis; Strickland, Judy; Kleinstreuer, Nicole; Andrade, Carolina H; Tropsha, Alexander

    2015-04-15

    Skin permeability is widely considered to be mechanistically implicated in chemically-induced skin sensitization. Although many chemicals have been identified as skin sensitizers, there have been very few reports analyzing the relationships between molecular structure and skin permeability of sensitizers and non-sensitizers. The goals of this study were to: (i) compile, curate, and integrate the largest publicly available dataset of chemicals studied for their skin permeability; (ii) develop and rigorously validate QSAR models to predict skin permeability; and (iii) explore the complex relationships between skin sensitization and skin permeability. Based on the largest publicly available dataset compiled in this study, we found no overall correlation between skin permeability and skin sensitization. In addition, cross-species correlation coefficient between human and rodent permeability data was found to be as low as R(2)=0.44. Human skin permeability models based on the random forest method have been developed and validated using OECD-compliant QSAR modeling workflow. Their external accuracy was high (Q(2)ext=0.73 for 63% of external compounds inside the applicability domain). The extended analysis using both experimentally-measured and QSAR-imputed data still confirmed the absence of any overall concordance between skin permeability and skin sensitization. This observation suggests that chemical modifications that affect skin permeability should not be presumed a priori to modulate the sensitization potential of chemicals. The models reported herein as well as those developed in the companion paper on skin sensitization suggest that it may be possible to rationally design compounds with the desired high skin permeability but low sensitization potential. PMID:25560673

  15. Chemical composition and sources of PM2.5 and TSP collected at Qinghai Lake during summertime

    NASA Astrophysics Data System (ADS)

    Zhang, Ningning; Cao, Junji; Liu, Suixin; Zhao, ZhuZi; Xu, Hongmei; Xiao, Shun

    2014-03-01

    PM2.5 and total suspended particulate (TSP) samples were collected from June to September 2010 at Qinghai Lake, northeastern Tibetan Plateau. The concentrations of major water-soluble ions, 10 elements, elemental carbons (ECs) and organic carbons (OCs) were quantified. Mass concentrations of PM2.5 and TSP were 21.27 ± 10.70 μg m- 3 and 41.47 ± 20.25 μg m- 3, respectively, and the mean ratio of PM2.5/TSP was 0.51. The greatest anion and cation in both PM2.5 and TSP samples were SO42 - and Ca2 +, respectively. Crustal elements, such as Ca, Fe and K, were the main elements in our aerosol samples, and their enrichment factors (EFs) were lower than 10. EFs for Pb, As, and Zn were greater than 10, indicating that they were influenced by anthropogenic sources. EC concentrations were 0.33 ± 0.17 μg m- 3 and 0.47 ± 0.28 μg m- 3, whereas OC concentrations were 1.49 ± 0.63 μg m- 3 and 2.30 ± 0.95 μg m- 3 in PM2.5 and TSP, respectively. Based on the calculated ratios of EC/TC and K+/EC, most of the ECs were found to be related to biomass burning emissions. Because of the pollution from local sources, the ratios of OC/EC were 4.77 ± 1.32 and 5.23 ± 1.39 in PM2.5 and TSP, respectively, which were lower than those of other remote sites. Salt particles produced by the salty lake reacted with acid gases and caused most of the nitrates and a small fraction of sulfate to be distributed in coarse mode; Cl deficit was also observed in our aerosol samples. Results of backward trajectories and correlation analysis show that the concentrations of SO4 2-, OCs, As, Pb, and Zn, were influenced by the long-distance transport from eastern China.

  16. Characterization of Chemical Sputtering Using the Mark II DIMES Porous Plug Injector in Attached and Semi-detached Divertor Plasmas of DIII-D

    SciTech Connect

    McLean, A. G.; Davis, J. W.; Stangeby, P. C.; Allen, S. L.; Boedo, J. A.; Bray, B. D.; Brezinsek, S.; Brooks, N. H.; Fenstermacher, M. E.; Groth, M.; Haasz, A. A.; Hollmann, E. M.; Isler, Ralph C; Lasnier, C. J.; Mu, Y.; Petrie, T. W.; Rudakov, D. L.; Watkins, J. G.; West, W. P.; Whyte, D. G.; Wong, C. P. C.

    2009-01-01

    An improved, self-contained gas injection system for the divertor material evaluation system (DIMES) on DIII-D has been employed for in situ study of chemical erosion in the tokamak divertor environment. To minimize perturbation to local plasma, the Mark II porous plug injector (PPI) releases methane through a porous graphite surface at the outer strike point at a rate precisely controlled by a micro-orifice flow restrictor to be approximately equal as that predicted for intrinsic chemical sputtering. Effective photon efficiencies resulting from CH(4) are found to be 58 +/- 12 in an attached divertor (n(e) similar to 1.5 x 10(13)/cm(3), T(e) similar to 25 eV, T(surf)similar to 450 K), and 94 +/- 20 in a semi-detached cold divertor (n(e) similar to 6.0 x 10(13)/cm(3), T(e) similar to 2-3 eV, T(surf) similar to 350 K). These values are significantly more than previous measurements in similar plasma conditions, indicating the importance of the injection rate and local re-erosion for the integrity of this analysis. The contribution of chemical versus physical sputtering to the source of C(+) at the target is assessed through simultaneous measurement of CII line, and CD plus CH-band emissions during release of CH(4) from the Pill, then compared with that seen in intrinsic sputtering. (C) 2009 Elsevier B.V. All rights reserved.

  17. Radial metallicity gradients in spiral galaxies from H II regions and planetary nebulae: probing galactic chemical evolution

    NASA Astrophysics Data System (ADS)

    Stanghellini, Letizia

    2015-08-01

    Radial metallicity gradients, typically observed in spiral galaxies, are excellent constraints for chemical evolution models. The contemporary studies of the two stellar populations, whose progenitors have formed at different times, yield to the chemical and time constraining of the models. In this context, planetary nebula and HII region analysis proved to be ideal two-epochs test populations. We present an assortment of galaxies whose oxygen abundances have been determined both with weak- and strong-line methods, and whose radial metallicity gradients and their evolution in time have disclosed very interesting correlations with the galaxy characteristics. New results from our Gemini/GMOS observations, and a review of the best literature data, set the stage for a better understanding of spiral galaxy evolution.

  18. Integrated chemical/biochemical sample collection, pre-concentration, and analysis on a digital microfluidic lab-on-a-chip platform

    NASA Astrophysics Data System (ADS)

    Fair, Richard B.; Khlystov, A.; Srinivasan, Vijay; Pamula, Vamsee K.; Weaver, Kathryn N.

    2004-12-01

    An ideal on-site chemical/biochemical analysis system must be inexpensive, sensitive, fully automated and integrated, reliable, and compatible with a broad range of samples. The advent of digital microfluidic lab-on-a-chip (LoC) technology offers such a detection system due to the advantages in portability, reduction of the volumes of the sample and reagents, faster analysis times, increased automation, low power consumption, compatibility with mass manufacturing, and high throughput. We describe progress towards integrating sample collection onto a digital microfluidic LoC that is a component of a cascade impactor device. The sample collection is performed by impacting airborne particles directly onto the surface of the chip. After the collection phase, the surface of the chip is washed with a micro-droplet of solvent. The droplet will be digitally directed across the impaction surface, dissolving sample constituents. Because of the very small droplet volume used for extraction of the sample from a wide colection area, the resulting solution is realatively concentrated and the analytes can be detected after a very short sampling time (1 min) due to such pre-concentration. After the washing phase, the droplet is mixed with specific reagents that produce colored reaction products. The concentration of the analyte is quantitatively determined by measuring absorption at target wavelengths using a simple light emitting diode and photodiode setup. Specific applications include automatic measurements of major inorganic ions in aerosols, such as sulfate, nitrate and ammonium, with a time resolution of 1 min and a detection limit of 30 nm/m3. We have already demonstrated the detection and quantification of nitroaromatic explosives without integrating the sample collection. Other applications being developed include airborne bioagent detection.

  19. Collisions of small ice particles under microgravity conditions. II. Does the chemical composition of the ice change the collisional properties?

    NASA Astrophysics Data System (ADS)

    Hill, C. R.; Heißelmann, D.; Blum, J.; Fraser, H. J.

    2015-03-01

    Context. Understanding the collisional properties of ice is important for understanding both the early stages of planet formation and the evolution of planetary ring systems. Simple chemicals such as methanol and formic acid are known to be present in cold protostellar regions alongside the dominant water ice; they are also likely to be incorporated into planets which form in protoplanetary disks, and planetary ring systems. However, the effect of the chemical composition of the ice on its collisional properties has not yet been studied. Aims: Collisions of 1.5 cm ice spheres composed of pure crystalline water ice, water with 5% methanol, and water with 5% formic acid were investigated to determine the effect of the ice composition on the collisional outcomes. Methods: The collisions were conducted in a dedicated experimental instrument, operated under microgravity conditions, at relative particle impact velocities between 0.01 and 0.19 ms-1, temperatures between 131 and 160 K and a pressure of around 10-5 mbar. Results: A range of coefficients of restitution were found, with no correlation between this and the chemical composition, relative impact velocity, or temperature. Conclusions: We conclude that the chemical composition of the ice (at the level of 95% water ice and 5% methanol or formic acid) does not affect the collisional properties at these temperatures and pressures due to the inability of surface wetting to take place. At a level of 5% methanol or formic acid, the structure is likely to be dominated by crystalline water ice, leading to no change in collisional properties. The surface roughness of the particles is the dominant factor in explaining the range of coefficients of restitution.

  20. Multidimensional Chemical Modeling of Young Stellar Objects. II. Irradiated Outflow Walls in a High-Mass Star-Forming Region

    NASA Astrophysics Data System (ADS)

    Bruderer, S.; Benz, A. O.; Doty, S. D.; van Dishoeck, E. F.; Bourke, T. L.

    2009-07-01

    Observations of the high-mass star-forming region AFGL 2591 reveal a large abundance of CO+, a molecule known to be enhanced by far-ultraviolet (FUV) and X-ray irradiation. In chemical models assuming a spherically symmetric envelope, the volume of gas irradiated by protostellar FUV radiation is very small due to the high extinction by dust. The abundance of CO+ is thus underpredicted by orders of magnitude. In a more realistic model, FUV photons can escape through an outflow region and irradiate gas at the border to the envelope. Thus, we introduce the first two-dimensional axisymmetric chemical model of the envelope of a high-mass star-forming region to explain the CO+ observations as a prototypical FUV tracer. The model assumes an axisymmetric power-law density structure with a cavity due to the outflow. The local FUV flux is calculated by a Monte Carlo radiative transfer code taking scattering on dust into account. A grid of precalculated chemical abundances, introduced in the first part of this series of papers, is used to quickly interpolate chemical abundances. This approach allows us to calculate the temperature structure of the FUV-heated outflow walls self-consistently with the chemistry. Synthetic maps of the line flux are calculated using a raytracer code. Single-dish and interferometric observations are simulated and the model results are compared to published and new JCMT and Submillimeter Array (SMA) observations. The two-dimensional model of AFGL 2591 is able to reproduce the JCMT single-dish observations and also explains the nondetection by the SMA. We conclude that the observed CO+ line flux and its narrow width can be interpreted by emission from the warm and dense outflow walls irradiated by protostellar FUV radiation.

  1. Collective properties of neutron-star X-ray binary populations of galaxies. II. Pre-low-mass X-ray binary properties, formation rates, and constraints

    SciTech Connect

    Bhadkamkar, H.; Ghosh, P.

    2014-04-01

    We continue our exploration of the collective properties of neutron-star X-ray binaries in the stellar fields (i.e., outside globular clusters) of normal galaxies. In Paper I of this series, we considered high-mass X-ray binaries (HMXBs). In this paper (Paper II), we consider low-mass X-ray binaries (LMXBs), whose evolutionary scenario is very different from that of HMXBs. We consider the evolution of primordial binaries up to the stage where the neutron star just formed in the supernova explosion of the primary is in a binary with its low-mass, unevolved companion, and this binary has circularized tidally, producing what we call a pre-low-mass X-ray binary (pre-LMXB). We study the constraints on the formation of such pre-LMXBs in detail (since these are low-probability events), and calculate their collective properties and formation rates. To this end, we first consider the changes in the binary parameters in the various steps involved, viz., the common-envelope phase, the supernova, and the tidal evolution. This naturally leads to a clarification of the constraints. We then describe our calculation of the evolution of the distributions of primordial binary parameters into those of pre-LMXB parameters, following the standard evolutionary scenario for individual binaries. We display the latter as both bivariate and monovariate distributions, discuss their essential properties, and indicate the influences of some essential factors on these. Finally, we calculate the formation rate of these pre-LMXBs. The results of this paper will be used in a subsequent one to compute the expected X-ray luminosity function of LMXBs.

  2. Collective Properties of Neutron-star X-Ray Binary Populations of Galaxies. II. Pre-low-mass X-Ray Binary Properties, Formation Rates, and Constraints

    NASA Astrophysics Data System (ADS)

    Bhadkamkar, H.; Ghosh, P.

    2014-04-01

    We continue our exploration of the collective properties of neutron-star X-ray binaries in the stellar fields (i.e., outside globular clusters) of normal galaxies. In Paper I of this series, we considered high-mass X-ray binaries (HMXBs). In this paper (Paper II), we consider low-mass X-ray binaries (LMXBs), whose evolutionary scenario is very different from that of HMXBs. We consider the evolution of primordial binaries up to the stage where the neutron star just formed in the supernova explosion of the primary is in a binary with its low-mass, unevolved companion, and this binary has circularized tidally, producing what we call a pre-low-mass X-ray binary (pre-LMXB). We study the constraints on the formation of such pre-LMXBs in detail (since these are low-probability events), and calculate their collective properties and formation rates. To this end, we first consider the changes in the binary parameters in the various steps involved, viz., the common-envelope phase, the supernova, and the tidal evolution. This naturally leads to a clarification of the constraints. We then describe our calculation of the evolution of the distributions of primordial binary parameters into those of pre-LMXB parameters, following the standard evolutionary scenario for individual binaries. We display the latter as both bivariate and monovariate distributions, discuss their essential properties, and indicate the influences of some essential factors on these. Finally, we calculate the formation rate of these pre-LMXBs. The results of this paper will be used in a subsequent one to compute the expected X-ray luminosity function of LMXBs.

  3. Field-collected permethrin-resistant Aedes aegypti from central Thailand contain point mutations in the domain IIS6 of the sodium channel gene (KDR).

    PubMed

    Srisawat, Raweewan; Komalamisra, Narumon; Apiwathnasorn, Chamnarn; Paeporn, Pungasem; Roytrakul, Sittiruk; Rongsriyam, Yupha; Eshita, Yuki

    2012-11-01

    One of the mechanisms responsible for pyrethroid resistance in mosquitoes is mutations in domain IIS6 of voltage-gated sodium channel gene (kdr). Aedes aegypti larvae were collected from the central provinces of Thailand (Bangkok, Prachin Buri and Ratchaburi) and colonized until they became adults. Partial fragment of kdr of permethrin-resistant mosquitoes were amplified by RT-PCR and sequenced. Among the four nucleotide mutations detected, two mutations resulted in two amino acid substitutions, S(TCC) 989 P(CCC) and V(GTA)1016 G(GGA). Among 94 permethrin-resistant mosquitoes, the SS genotype (SS/VV) was found to predominate (n = 74), followed by SR (SP/VG) (n = 15) and RR (PP/ GG) genotypes (n = 5), with the resistant allele frequency ranging from 0.03 to 0.17. As pyrethroid insecticides are currently being advocated for use in Thailand, investigations of pyrethroid resistance in other regions of the country are needed to prevent potential cross-resistance among different types of insecticides. PMID:23413701

  4. Comparison between ultrafine and fine particulate matter collected in Lebanon: Chemical characterization, in vitro cytotoxic effects and metabolizing enzymes gene expression in human bronchial epithelial cells.

    PubMed

    Borgie, Mireille; Dagher, Zeina; Ledoux, Frédéric; Verdin, Anthony; Cazier, Fabrice; Martin, Perrine; Hachimi, Adam; Shirali, Pirouz; Greige-Gerges, Hélène; Courcot, Dominique

    2015-10-01

    During the last few years, the induction of toxicological mechanisms by atmospheric ultrafine particles (UFP) has become one of the most studied topics in toxicology and a subject of huge debates. Fine particles (FP) and UFP collected at urban and rural sites in Lebanon were studied for their chemical composition and toxicological effects. UFP were found more enriched in trace elements, secondary inorganic ions, total carbon and organic compounds than FP. For toxicological analysis, BEAS-2B cells were exposed for 24, 48 and 72 h to increasing concentrations of FP, water-UFP suspension (UFPw) and UFP organic extract (UFPorg). Our findings showed that UFP caused earlier alterations of mitochondrial metabolism and membrane integrity from the lowest concentrations. Moreover, a significant induction of CYP1A1, CYP1B1 and AhRR genes expression was showed after cells exposure to UFPorg and to a lesser extent to UFPw and FP samples. PMID:26093079

  5. Chemical trends of the luminescence in wide band gap II 1-xMn xVI semimagnetic semiconductors

    NASA Astrophysics Data System (ADS)

    Benecke, C.; Busse, W.; Gumlich, H.-E.

    1990-04-01

    Time resolved emission and excitation spectroscopy is used to investigate the Mn correlated luminescence in wide band gap II-VI compounds, i.e. Zn 1-xMn xS, Cd 1-xMn xSe, Zn 1-xMn xTe and Cd 1-xMn xTe. Additional Information has been obtained with CdxZnyMnzTe( x+ y+ z=1) in checking the luminescence by variation of the ratio of the cations Cd and Zn. Generally speaking, at least two distinct emissions bands can be observed for each II 1- xMn xVI compound. One emissions band is attributed to the internal transition 4T 1(G)→ 6A 1(S) of the 3d 5 electron of the Mn 2+ on regular metal sites with energies of about ≈2 eV. The other emission band is found to occur in the near infrared range of about ≈1.3 eV. This emission band is tentatively interpreted as a transition of Mn 2+ ions on interstitial sites or in small Mn chalcogenide clusters, both interpretations assuming cubic symmetry. This model is supported by the existence of low energy excitation bands and by the great similarity of the shape of the two emission bands which lead to comparable Huang-Rhys factors and effective phonon energies. Also the established trend in the experimental data of the II-VI compounds under consideration confirm this interpretation. For both the IR and the yellow Mn 2+ center, the Racah parameters B and C and the crystal field parameter Dq are determined on the basis of experimental data. As a result, the energy of both the emission and the excitation bands is predominantly determined by the sorrounding anions. These bands shift to higher energies when the anions are changed in the fixed order: Te→Se→S. Regularly, there is also a spectral shift when Zn is replaced by Cd, which is smaller than the shift due to the variation of onions.

  6. A forgotten collection: the Libyan ethnobotanical exhibits (1912-14) by A. Trotter at the Museum O. Comes at the University Federico II in Naples, Italy

    PubMed Central

    2012-01-01

    Background The Ethnobotanical Collection from the Libyan territories of the botanist Alessandro Trotter is included in the Oratio Comes Botanical Museum at the Faculty of Agraria at the University Federico II in Naples. Trotter explored different territories of Libya, mainly Tripolitania, between 1912-1924, collecting plant specimens and the drugs most frequently sold in the markets. The Libyan herbarium currently includes over 2300 sheets of mounted and accessioned plants. The drugs, mostly acquired by Trotter from Tripolitanian markets, were identified and packed in 87 paper sheets or boxes. Trotter added ethnobotanical information for each species when available. Methods A database of the herbarium species and the drugs has been carried out, after a taxonomic update. Nomenclature has been revised according to the African flowering plants database and the World Checklist of selected plant families, and a comparison with currently available ethnopharmacological data from North African has been attempted. Results In this study, ethnopharmacological data related to about 80 species of flowering plants and to 4 lichens are presented. The plants are mainly from Mediterranean or Sub-Saharan habitats and belong to 37 different families; Lamiaceae was the most cited family, with 10 accessions. Generally, the aerial parts of the plants are the most frequently used (28 species), followed by leaves (15 species), flowers and seeds (9 species), fruits (7 species) and hypogean organs (roots, rhizomes, tubers: 5 species). Plants were generally processed in very simple ways: infusion or decoction of the plants were prepared and orally administered or used for topical applications. A wide range of conditions was treated, ranging from mental disorders to skin affections. All the organs of human body are considered, but the pathologies of gastro-intestinal tract, respiratory system and those related to traumatic accidents were the most frequently mentioned. The comparison with the recent ethnopharmacological research in Maghreb and its neighboring countries reveals a high correspondence; almost all the plants cited by Trotter are still used in the folk medicine of at least one of the North African countries, and the therapeutic uses of each plant appear consistent over time. Conclusions The information collected by Trotter is an important contribution to tracing plant utilization in Libyan folk medicine over the last century. PMID:22264313

  7. Quantum chemical approach for condensed-phase thermochemistry (II): Applications to formation and combustion reactions of liquid organic molecules

    NASA Astrophysics Data System (ADS)

    Ishikawa, Atsushi; Nakai, Hiromi

    2015-03-01

    The harmonic solvation model (HSM), which was recently developed for evaluating condensed-phase thermodynamics by quantum chemical calculations (Nakai and Ishikawa, 2014), was applied to formation and combustion reactions of simple organic molecules. The conventional ideal gas model (IGM) considerably overestimated the entropies of the liquid molecules. The HSM could significantly improve this overestimation; mean absolute deviations for the Gibbs energies of the formation and combustion reactions were (49.6, 26.7) for the IGM and (9.7, 5.4) for the HSM in kJ/mol.

  8. Sorption preconcentration of mercury(II) on silica gel chemically modified by 2,5-dimercapto-1,3,4-thiadiazole

    SciTech Connect

    Simonova, L.N.; Kudryavtsev, G.V.; Bruskina, I.M.; Ispravnikova, V.V.

    1987-11-20

    To solve problems of environment protection, effective methods for the analytical control of the content of toxic substances, including mercury, are required. Mercury must be preconcentrated because of the low levels of its content in natural waters. One of the effective methods of preconcentration with simultaneous conservation of mercury is the use of chelate-forming sorbents. Sorbents based on silica gel with grafted N,S-containing dithiocarbamate and 2-aminocyclopent-1-enedithiocarbamic acid groups are popular. These sorbents have all the positive properties of the inorganic matrix, while the chelate-forming group grafted onto them ensures selectivity of sorption. The aim of this work was to study the sorption conditions and the subsequent determination of mercury(II) in natural waters using a sorbent based on silichrome, chemically modified by 2,5-dimercapto-1,3,4-thiadiazole (bismuthol I).

  9. Structural and optical characterization of type-II InAs/InAs1-xSbx superlattices grown by metalorganic chemical vapor deposition

    NASA Astrophysics Data System (ADS)

    Steenbergen, E. H.; Huang, Y.; Ryou, J.-H.; Ouyang, L.; Li, J.-J.; Smith, D. J.; Dupuis, R. D.; Zhang, Y.-H.

    2011-08-01

    Strain-balanced type-II InAs/InAs1-xSbx superlattices with various compositions (x = 0.22, 0.23, 0.37) and different layer thicknesses (tInAs = 7 nm, tInAsSb = 3.3, 2.3, 2.0 nm, respectively) have been grown by metalorganic chemical vapor deposition on GaSb substrates. X-ray diffraction revealed narrow satellite peaks (full-width-half-maximum of <100 arc sec), indicative of uniform superlattice periodicity and excellent crystallinity, which was also corroborated by cross-sectional transmission electron microscopy observations. Despite relaxation, low-temperature photoluminescence measurements showed peaks at 6.7 μm and 5.8 μm, while photoconductance results showed strong spectral response up to 200 K, when the photoresponse onset was 8.6 μm.

  10. Chemical abundance analysis of symbiotic giants - II. AE Ara, BX Mon, KX TrA, and CL Sco

    NASA Astrophysics Data System (ADS)

    Gałan, Cezary; Mikołajewska, Joanna; Hinkle, Kenneth H.

    2015-02-01

    Knowledge of the elemental abundances of symbiotic giants is essential to address the role of chemical composition in the evolution of symbiotic binaries, to map their parent population, and to trace their mass transfer history. However, there are few symbiotic giants for which the photospheric abundances are fairly well determined. This is the second in a series of papers on chemical composition of symbiotic giants determined from high-resolution (R ˜ 50 000) near-IR spectra. Results are presented for the late-type giant star in the AE Ara, BX Mon, KX TrA, and CL Sco systems. Spectrum synthesis employing standard local thermal equilibrium (LTE) analysis and stellar atmosphere models were used to obtain photospheric abundances of CNO and elements around the iron peak (Sc, Ti, Fe, and Ni). Our analysis resulted in sub-solar metallicities in BX Mon, KX TrA, and CL Sco by [Fe/H] ˜ -0.3 or -0.5 depending on the value of microturbulence. AE Ara shows metallicity closer to solar by ˜ 0.2 dex. The enrichment in 14N isotope found in all these objects indicates that the giants have experienced the first dredge-up. In the case of BX Mon first dredge-up is also confirmed by the low 12C/13C isotopic ratio of ˜ 8.

  11. Water and Sediment Chemical Data and Data Summary for Samples Collected in 1999 and 2001 in the Goodpaster River Basin, Big Delta B-2 Quadrangle, Alaska

    USGS Publications Warehouse

    Wang, Bronwen; Gough, Larry; Wanty, Richard; Vohden, Jim; Crock, Jim; Day, Warren

    2006-01-01

    We report the chemical analysis for water and sediment collected from the Big Delta B-2 quadrangle. These data are part of a study located in the Big Delta B-2 quadrangle that focused on the integration of geology and bedrock geochemistry on with the biogeochemistry of water, sediments, soil, and vegetation. The discovery of the Pogo lode gold deposit in the northwest corner of the quadrangle was the impetus for this study. The study objectives were to create a geologic map, evaluate the bedrock geochemical influence on the geochemical signature of the surficial environment, and define landscape-level predevelopment geochemical baselines. Important to baseline development is an evaluation of what, if any, geochemical difference exists between the mineralized and non-mineralized areas within a watershed or between mineralized and non-mineralized watersheds. The analytic results for the bedrock, soils, and vegetation are reported elsewhere. Presented here, with minimal interpretation, is the analytic data for the water and sediment samples collected in the summers of 1999 and 2001, and a summary statistics of these analyses.

  12. Part I. Synthesis of metal hydroborates as potential chemical vapor deposition precursors. Part II. Chemical vapor deposition of titanium-doped magnesium diboride thin films

    NASA Astrophysics Data System (ADS)

    Kim, Do Young

    2007-12-01

    New compounds Cp*V(B3H8)2, Cp*Cr(B 3H8)2, and Cp*2Co2(B 6H14) have been synthesized by treating the pentamethylcyclopentadienyl complexes [Cp*VCl2]3, [Cp*CrCl2]2, and [Cp*CoCl]2 with NaB3H8. Cp*V(B3 H8)2 and Cp*Cr(B3H8) 2 have the same ligand sets but different molecular structures: the vanadium compound contains two bidentate B3H8 ligands whereas the chromium compound has one bidentate B3H8 ligand and one B3H8 ligand bound in an unprecedented fashion via two geminal hydrogen atoms. The different binding modes of the B3H8- group in these compounds are consequences of the number of available empty valence orbitals on the metal centers. The dinuclear complex Cp*2Co2(B 6H14) can be viewed as a "bi-borallyl" complex or as an eight-vertex hypho cluster. The solid state reaction of MgBr2 and NaB3H 8 at 20°C, followed by sublimation at 80°C and 0.05 Torr, affords Mg(B3H8)2, as a white solid. Similar reactions with MgBr2·Et2O and MgBr2(Me 2O)1.5 afford the crystalline ether adducts Mg(B3H 8)2(Et2O)2 and Mg(B3H 8)2(Me2O)2, respectively. In the solution state reactions of MgBr2 with NaB3H8, the presence of excess solvent results in the formation of non-volatile, probably ionic, magnesium compounds of the type [MgLx][B3H 8]2. Mg(B3H8)2(Et2 O)2 and Mg(B3H8)2(Me 2O)2 are the first crystallographically characterized magnesium complex of the B3H8- ligand. Owing to their volatility, Mg(B3H8)2(Et2O) 2 and Mg(B3H8)2(Me2O) 2 are potential precursors for the deposition of MgB2 thin films, although preliminary efforts to grow thin films from them under CVD conditions, have not yet produced stoichiometric MgB2 films. Treatment of MCl3(thf)3 (M = Ti, Cr, or Mo) or MnCl2 with the sodium salt of N,N-dimethyldiboranamide, Na(H3BNMe2BH3), in diethyl ether, followed by sublimation at 45-70°C, affords crystals of the new divalent complexes M(H3BNMe2BH3)2, where M is Ti, Cr, Mn, or Mo, all of which have been characterized by single crystal X-ray diffraction. In all four compounds, the metal center is coordinated to two chelating [H3BNMe2BH3]-ligands. Each BH3 group binds to the metal center by means of two hydrogen bridges, leaving one terminal hydrogen atom on each BH3 group; the H atoms that bridge to the metal center form slightly longer B-H bonds than the terminal H atoms on the same boron centers, as expected. The metal center in each compound forms eight M-H contacts, whose M-H distances are equal within experimental error. The Ti, Cr, and Mo compounds adopt square-planar geometries in which the dihedral angle between ligand planes is 0°. In contrast, in the Mn compound, which adopts a structure intermediate between a tetrahedron and a square plane, the two ligand planes define a dihedral angle of 46.5(2)°; this unusual dihedral angle maximizes interligand H···H distances. The solid state reaction of MgBr2 with Na(H3BNMe 2BH3) yields the monomeric, magnesium complex Mg(H3 BNMe2BH3)2. Its ether adducts Mg(H 3BNMe2BH3)2(thf) and Mg(H3BNMe 2BH3)2(dme), and the mixed ligand complex Cp*Mg(H 3BNMe2BH3)(thf), have also been prepared. Significantly, the binary complex Mg(H3BNMe2BH3)2 has a vapor pressure of 800 mTorr at 25°C, which makes it the most volatile magnesium complex known. The solid state reaction of MCl3 and Na(H3BNMe 2BH3) and subsequent sublimation in vacuum affords the dinuclear complexes, M2(H3BNMe2BH3) 6 (M = Y or Dy). X-ray crystallographic studies show that, in both compounds, two metal centers are connected by two bridging H3BNMe2BH 3 ligands; each metal center also bears two terminal diboranamide groups, which are chelating. Similar reactions conducted in thf solution yield the monomeric thf adducts M(H3BNMe2BH3) 3(thf) (M = Y or Dy). These molecules, which possess a boron-to-metal ratio of 6, are readily volatile below 100°C and are potential CVD precursors for the low-temperature growth of LnB6 thin films. The first low-temperature chemical vapor depositions of doped MgB 2 phases have been achieved by passing the precursor Mg(H3BNMe 2BH3)2 over a surface in the presence of a catalyst that accelerates the rate of the CVD growth reaction. Transition metal hydroborates can serve as effective catalysts, of which Ti(H3BNMe2BH 3)2 is the most attractive so far because it leads to the lowest level of Mg site substitution; the resulting film stoichiometry is Mg0.8Ti0.2B2. Although the metal substitution renders the films non-superconducting above 4 K, the results clearly point the way to the development of technologically-attractive CVD processes to grow superconducting MgB2 thin films at temperatures below 400°C.

  13. Non-empirical quantum chemical studies on electron transfer reactions in trans- and cis-diamminedichloroplatinum(II) complexes.

    PubMed

    Kuduk-Jaworska, Janina; Chojnacki, Henryk; Jański, Jerzy J

    2011-09-01

    The search was made for theoretical confirmation of hypothesis that mechanism of cisplatin cytotoxicity is based on dissociative electron transfer (ET) processes. Applying quantum chemical calculations based on supermolecular approach, the reactions mimicking presumed steps of cisplatin activation were evaluated. The electronic structure of model systems: cis- and transplatin with free electrons, hydrated electrons, and water, was studied by using density functional (DFT) within the Huzinaga basis set and GAUSSIAN-09 package. The respective energy was evaluated with the use of B3LYP density hybrid functional. The calculations were performed for gas phase and water solution; the solvent effects were studied by using the polarizable continuum model. Analysis of the energetic and structural parameters of cisplatin vs. transplatin behavior in the model systems leads to conclusion: there are two possible ways of cisplatin biotransformation, hydrolysis and hydrated electron impact, dependent on the medium redox state. PMID:21559964

  14. Branched conformational properties of macromolecules in close relation to chemical synthesis. II. Influence of excluded volume interactions

    NASA Astrophysics Data System (ADS)

    Burchard, Walther; Schweins, Ralf; Werner, Marcel

    2015-09-01

    The description of perturbed particle conformations needs as a prerequisite the algorithm of unperturbed chains which is outlined in Paper I [J. Chem. Phys. 143, 114906 (2015)]. The mean square segment length = b 2 n 2 ν with ν = 0.588 for linear chains in a good solvent is used as an approximation also for branched samples. The mean square radius of gyration is easily derived, but for the hydrodynamic, the segment distribution by Domb et al. [Proc. Phys. Soc., London 85, 624 (1965)] is required. Both radii can analytically be expressed by Gamma functions. For the angular dependence of scattered light, the Fourier transform of the Domb distribution for self-avoiding random walk is needed, which cannot be obtained as an analytical function and was derived by numerical integration. The summation over all segment length in the particle was performed with an analytic fit-curve for the Fourier transform and was carried out numerically. Results were derived (i) for uniform and polydisperse linear chains, (ii) or f-functional randomly branched polymers and their monodisperse fractions, (iii) for random A3B2 co-polymers, and (iv) for AB2 hyper-branched samples. The deviation of the Gaussian approximation with the variance of = b 2 n 2 ν slightly overestimates the excluded volume interaction but still remains a fairly good approximation for region of qRg < 10.

  15. Chemical relevance of the copper(II)— L-carnosine system in aqueous solution: A thermodynamic and spectrophotometric study

    NASA Astrophysics Data System (ADS)

    Daniele, Pier G.; Prenesti, Enrico; Zelano, Vincenzo; Ostacoli, Giorgio

    1993-08-01

    The copper(II)— L-carnosine (L -) system has been re-investigated in aqueous solution, at I = 0.1 mol dm -1, different temperatures (5⩽ t⩽45°C) and with metal to ligand ratios ranging from 3:1 to 1:3. Both potentiometry and visible spectrophotometry were employed. From an overall consideration of all experiments, [CuLH] 2+, [CuL] +, [CuLH -1]°, [Cu 2L 2H -2]° and [Cu 2LH -1] 2+ were recognized as the species which provide the best interpretation of experimental data. The complex formation constants, determined at different temperatures, allowed us to obtain reliable values of Δ H° and good estimates of Δ C° p. From visible spectrophotometric measurements, carried out at different pH and metal to ligand ratios, it was possible to calculate the electronic spectrum of each complex formed in solution. A structure is also proposed for each species, on the basis of thermodynamic and spectral results.

  16. Branched conformational properties of macromolecules in close relation to chemical synthesis. II. Influence of excluded volume interactions.

    PubMed

    Burchard, Walther; Schweins, Ralf; Werner, Marcel

    2015-09-21

    The description of perturbed particle conformations needs as a prerequisite the algorithm of unperturbed chains which is outlined in Paper I [J. Chem. Phys. 143, 114906 (2015)]. The mean square segment length ⟨r(2)(n)⟩=b(2)n(2ν) with ν = 0.588 for linear chains in a good solvent is used as an approximation also for branched samples. The mean square radius of gyration is easily derived, but for the hydrodynamic, the segment distribution by Domb et al. [Proc. Phys. Soc., London 85, 624 (1965)] is required. Both radii can analytically be expressed by Gamma functions. For the angular dependence of scattered light, the Fourier transform of the Domb distribution for self-avoiding random walk is needed, which cannot be obtained as an analytical function and was derived by numerical integration. The summation over all segment length in the particle was performed with an analytic fit-curve for the Fourier transform and was carried out numerically. Results were derived (i) for uniform and polydisperse linear chains, (ii) or f-functional randomly branched polymers and their monodisperse fractions, (iii) for random A3B2 co-polymers, and (iv) for AB2 hyper-branched samples. The deviation of the Gaussian approximation with the variance of ⟨r(2)(n)⟩=b(2)n(2ν) slightly overestimates the excluded volume interaction but still remains a fairly good approximation for region of qR(g) < 10. PMID:26395738

  17. Trapping of muscle relaxant methocarbamol degradation product by complexation with copper(II) ion: spectroscopic and quantum chemical studies.

    PubMed

    Mansour, Ahmed M; Shehab, Ola R

    2014-07-15

    Structural properties of methocarbamol (Mcm) were extensively studied both experimentally and theoretically using FT IR, (1)H NMR, UV-Vis., geometry optimization, Mulliken charge, and molecular electrostatic potential. Stability arises from hyper-conjugative interactions, charge delocalization and H-bonding was analyzed using natural bond orbital (NBO) analysis. Mcm was decomposed in ethanol/water mixture at 80°C to guaifenesin [(RS)-3-(2-methoxyphenoxy)propane-1,2-diol] and carbamate ion [NH2COO(-)], where the degradation mechanism was explained by trapping the carbamate ion via the complexation with copper(II) ion. The structure of the isolated complex ([Cu(NH2COO)2(H2O)]⋅4H2O) was elucidated by spectral, thermal, and magnetic tools. Electronic spectra were discussed by TD-DFT and the descriptions of frontier molecular orbitals and the relocations of the electron density were determined. Calculated g-tensor values showed best agreement with experimental values from EPR when carried out using both the B3LYP and B3PW91 functional. PMID:24674917

  18. Trapping of muscle relaxant methocarbamol degradation product by complexation with copper(II) ion: Spectroscopic and quantum chemical studies

    NASA Astrophysics Data System (ADS)

    Mansour, Ahmed M.; Shehab, Ola R.

    2014-07-01

    Structural properties of methocarbamol (Mcm) were extensively studied both experimentally and theoretically using FT IR, 1H NMR, UV-Vis., geometry optimization, Mulliken charge, and molecular electrostatic potential. Stability arises from hyper-conjugative interactions, charge delocalization and H-bonding was analyzed using natural bond orbital (NBO) analysis. Mcm was decomposed in ethanol/water mixture at 80 °C to guaifenesin [(RS)-3-(2-methoxyphenoxy)propane-1,2-diol] and carbamate ion [NH2COO-], where the degradation mechanism was explained by trapping the carbamate ion via the complexation with copper(II) ion. The structure of the isolated complex ([Cu(NH2COO)2(H2O)]ṡ4H2O) was elucidated by spectral, thermal, and magnetic tools. Electronic spectra were discussed by TD-DFT and the descriptions of frontier molecular orbitals and the relocations of the electron density were determined. Calculated g-tensor values showed best agreement with experimental values from EPR when carried out using both the B3LYP and B3PW91 functional.

  19. Single particle chemical composition, state of mixing and shape of fresh and aged Saharan dust in Morocco and at Cape Verde Islands during SAMUM I and II

    NASA Astrophysics Data System (ADS)

    Kandler, Konrad; Emmel, Carmen; Ebert, Martin; Lieke, Kirsten; Müller-Ebert, Dörthe; Schütz, Lothar; Weinbruch, Stephan

    2010-05-01

    The Saharan Mineral Dust Experiment (SAMUM) is focussed to the understanding of the radiative effects of mineral dust. During the SAMUM 2006 field campaign at Tinfou, southern Morocco, chemical and mineralogical properties of fresh desert aerosol was measured. The winter campaign of Saharan Mineral Dust Experiment II in 2008 was based in Praia, Island of Santiago, Cape Verde. This second field campaign was dedicated to the investigation of transported Saharan Mineral Dust. Ground-based and airborne measurements were performed in the winter season, where mineral dust from the Western Sahara and biomass burning aerosol from the Sahel region occurred. Samples were collected with a miniature impactor system, a sedimentation trap, a free-wing impactor, and a filter sampler. Beryllium discs as well as carbon coated nickel discs, carbon foils, and nuclepore and fiber filters were used as sampling substrates. The size-resolved particle aspect ratio and the chemical composition are determined by scanning electron microscopy and energy-dispersive X-ray microanalysis of single particles. Mineralogical bulk composition is determined by X-ray diffraction analysis. In Morocco, three size regimes are identified in the aerosol: Smaller than 500 nm in diameter, the aerosol consists of sulfates and mineral dust. Larger than 500 nm up to 50 µm, mineral dust dominates, consisting mainly of silicates, and - to a lesser extent - carbonates and quartz. Larger than 50 µm, approximately half of the particles consist of quartz. Time series of the elemental composition show a moderate temporal variability of the major compounds. Calcium-dominated particles are enhanced during advection from a prominent dust source in Northern Africa (Chott El Djerid and surroundings). More detailed results are found in Kandler et al. (2009) At Praia, Cape Verde, the boundary layer aerosol consists of a superposition of mineral dust, marine aerosol and ammonium sulfate, soot, and other sulfates as well as mixtures of these components. During low-dust periods, the aerosol is dominated by sea salt. During dust events, mineral dust dominates the particle mass (more than 90 %). Particles smaller 500 nm in diameter always show a significant abundance of ammonium sulfate. Comparing a high dust period at Cape Verde with the total data from Morocco, it is found that the atomic ratio distributions of Al/Si, K/Si and Fe/Si for the single particles are very similar for the dust component. This indicates that the dominating silicate minerals are the same. In contrast, the content of calcium rich minerals at Cape Verde is significantly lower than in Morocco which is in agreement with the source regions for the Cape Verde dust (E Mali and W Niger) derived from trajectory analysis. The sulfur content of super-micron aerosol particles at Cape Verde scales with the particle surface, indicating the presence of sulfate coatings. For the submicron particles, the sulfur content scales with particle volume, which can be attributed to the large amount of particles identified as ammonium sulfate. In contrast to findings in Japan (Zhang et al., 2006), no internal mixtures between pristine seasalt and mineral dust are present during this dust period at Cape Verde. However, for a significant number of particles a small amount of sodium and chlorine is associated with internal mixtures of dust and sulfate, what may indicate that these particles started as internal mixture of dust with a sea water droplet before taking up more sulfur from the gas phase. In general, the shape of the particles in Morocco and Cape Verde is rather similar: The distributions of the two-dimensional aspect ratio of an ellipse fitted to each particle's shape for the total aerosol show no significant differences. A median value of 1.6 is found for both locations. References Kandler, K., Schütz, L., Deutscher, C., Hofmann, H., Jäckel, S. and co-authors 2009. Tellus 61B, 32-50. Zhang, D., Iwasaka, Y., Matsuki, A., Ueno, K. and Matsuzaki, T. 2006. Atmos. Environ. 40, 1205-1215. Financial support by the Deutsche Forschungsgemeinschaft (research group SAMUM, FOR539) is gratefully acknowledged. We thank TACV - Cabo Verde Airlines and Mr. António Lima Fortes for logistic support.

  20. Critical evaluation of Jet-A spray combustion using propane chemical kinetics in gas turbine combustion simulated by KIVA-II

    NASA Technical Reports Server (NTRS)

    Nguyen, H. L.; Ying, S.-J.

    1990-01-01

    Numerical solutions of the Jet-A spray combustion were obtained by means of the KIVA-II computer code after Jet-A properties were added to the 12 chemical species the program had initially contained. Three different reaction mechanism models are considered. The first model consists of 131 reactions and 45 species; it is evaluated by comparing calculated ignition delay times with available shock tube data, and it is used in the evaluation of the other two simplified models. The simplified mechanisms consider 45 reactions and 27 species and 5 reactions and 12 species, respectively. In the prediction of pollutants NOx and CO, the full mechanism of 131 reactions is considered to be more reliable. The numerical results indicate that the variation of the maximum flame temperature is within 20 percent as compared with that of the full mechanism of 131 reactions. The chemical compositions of major components such as C3H8, H2O, O2, CO2, and N2 are of the same order of magnitude. However, the concentrations of pollutants are quite different.

  1. On ammonia binding to the oxygen-evolving complex of photosystem II: a quantum chemical study.

    PubMed

    Schraut, Johannes; Kaupp, Martin

    2014-06-10

    A recent EPR study (M. Perrez Navarro et al., Proc. Natl. Acad. Sci. 2013, 110, 15561) provided evidence that ammonia binding to the oxygen-evolving complex (OEC) of photosystem II in its S2 state takes place at a terminal-water binding position (W1) on the "dangler" manganese center MnA. This contradicted earlier interpretations of (14)N electron-spin-echo envelope modulation (ESEEM) and extended X-ray absorption fine-structure (EXAFS) data, which were taken to indicate replacement of a bridging oxo ligand by an NH2 unit. Here we have used systematic broken-symmetry density functional theory calculations on large (ca. 200 atom) model clusters of an extensive variety of substitution patterns and core geometries to examine these contradictory pieces of evidence. Computed relative energies clearly favor the terminal substitution pattern over bridging-ligand arrangements (by about 20-30 kcal mol(-1)) and support W1 as the preferred binding site. Computed (14)N EPR nuclear-quadrupole coupling tensors confirm previous assumptions that the appreciable asymmetry may be accounted for by strong, asymmetric hydrogen bonding to the bound terminal NH3 ligand (mainly by Asp61). Indeed, bridging NH2 substitution would lead to exaggerated asymmetries. Although our computed structures confirm that the reported elongation of an Mn-Mn distance by about 0.15 Å inferred from EXAFS experiments may only be reproduced by bridging NH2 substitution, it seems possible that the underlying EXAFS data were skewed by problems due to radiation damage. Overall, the present data clearly support the suggested terminal NH3 coordination at the W1 site. The finding is significant for the proposed mechanistic scenarios of OEC catalysis, as this is not a water substrate site, and effects of this ammonia binding on catalysis thus must be due to more indirect influences on the likely substrate binding site at the O5 bridging-oxygen position. PMID:24806267

  2. DFT calculations of 15N NMR shielding constants, chemical shifts and complexation shifts in complexes of rhodium(II) tetraformate with some nitrogenous organic ligands

    NASA Astrophysics Data System (ADS)

    Leniak, Arkadiusz; Jaźwiński, Jarosław

    2015-03-01

    Benchmark calculations of 15N NMR shielding constants for a set of model complexes of rhodium(II) tetraformate with nine organic ligands using the Density Functional Theory (DFT) methods have been carried out. The calculations were performed by means of several methods: the non-relativistic, relativistic scalar ZORA, and spin-orbit ZORA approaches at the CGA-PBE/QZ4P theory level, and the GIAO NMR method using the B3PW91 functional with the 6-311++G(2d,p) basis set for C, H, N, O atoms and the Stuttgart basis set for the Rh atom. The geometry of compounds was optimised either by the same basis set as for the NMR calculations or applying the B3LYP functional with the 6-31G(2d) basis set for C, H, N, O atoms and LANL2DZ for the Rh atom. Computed 15N NMR shielding constants σ were compatible with experimental 15N chemical shifts δ of complexes exhibiting similar structure and fulfil the linear equation δ = aσ + b. The a and b parameters for all data sets have been estimated by means of linear regression analysis. In contrast to the correlation method giving "scaled" chemical shifts, the conversion of shielding constants to chemical shifts with respect to the reference shielding of CH3NO2 provided very inaccurate "raw" δ values. The application of the former to the calculation of complexation shifts Δδ (Δδ = δcompl - δlig) reproduced experimental values qualitatively or semi-quantitatively. The non-relativistic B3PW91/[6-311++G(2d,p), Stuttgart] theory level reproduced the NMR parameters as good as the more expensive relativistic CGA-PBE//QZ4P ZORA approaches.

  3. THE CHEMICAL ABUNDANCES OF STARS IN THE HALO (CASH) PROJECT. II. A SAMPLE OF 14 EXTREMELY METAL-POOR STARS ,

    SciTech Connect

    Hollek, Julie K.; Sneden, Christopher; Shetrone, Matthew; Frebel, Anna; Roederer, Ian U.; Beers, Timothy C.; Kang, Sung-ju; Thom, Christopher E-mail: chris@astro.as.utexas.edu E-mail: afrebel@cfa.harvard.edu E-mail: beers@pa.msu.edu E-mail: cthom@stsci.edu

    2011-11-20

    We present a comprehensive abundance analysis of 20 elements for 16 new low-metallicity stars from the Chemical Abundances of Stars in the Halo (CASH) project. The abundances have been derived from both Hobby-Eberly Telescope High Resolution Spectrograph snapshot spectra (R {approx}15, 000) and corresponding high-resolution (R {approx}35, 000) Magellan Inamori Kyocera Echelle spectra. The stars span a metallicity range from [Fe/H] from -2.9 to -3.9, including four new stars with [Fe/H] < -3.7. We find four stars to be carbon-enhanced metal-poor (CEMP) stars, confirming the trend of increasing [C/Fe] abundance ratios with decreasing metallicity. Two of these objects can be classified as CEMP-no stars, adding to the growing number of these objects at [Fe/H]< - 3. We also find four neutron-capture-enhanced stars in the sample, one of which has [Eu/Fe] of 0.8 with clear r-process signatures. These pilot sample stars are the most metal-poor ([Fe/H] {approx}< -3.0) of the brightest stars included in CASH and are used to calibrate a newly developed, automated stellar parameter and abundance determination pipeline. This code will be used for the entire {approx}500 star CASH snapshot sample. We find that the pipeline results are statistically identical for snapshot spectra when compared to a traditional, manual analysis from a high-resolution spectrum.

  4. The early-type galaxies NGC 1407 and NGC 1400 - II. Star formation and chemical evolutionary history

    NASA Astrophysics Data System (ADS)

    Spolaor, Max; Forbes, Duncan A.; Proctor, Robert N.; Hau, George K. T.; Brough, Sarah

    2008-04-01

    We present a possible star formation and chemical evolutionary history for two early-type galaxies NGC 1407 and NGC 1400. They are the two brightest galaxies of the NGC 1407 (or Eridanus-A) group, one of the 60 groups studied as part of the Group Evolution Multi-wavelength Study. Our analysis is based on new high signal-to-noise ratio spatially resolved integrated spectra obtained at the ESO 3.6-m telescope, out to ~0.6 (NGC 1407) and ~1.3(NGC 1400) effective radii. Using Lick/IDS indices, we estimate luminosity-weighted ages, metallicities and α-element abundance ratios. Colour radial distributions from HST/ACS and Subaru Suprime-Cam multiband wide-field imaging are compared to colours predicted from spectroscopically determined ages and metallicities using single stellar population (SSP) models. The galaxies formed over half of their mass in a single short-lived burst of star formation (>=100Msolaryr-1) at redshift z >= 5. This likely involved an outside-in mechanism with supernova-driven galactic winds, as suggested by the flatness of the α-element radial profiles and the strong negative metallicity gradients. Our results support the predictions of the revised version of the monolithic collapse model for galaxy formation and evolution. We speculate that, since formation, the galaxies have evolved quiescently and that we are witnessing the first infall of NGC 1400 in the group.

  5. Fluid and chemical flux in and out of sediments hosting methane hydrate deposits on Hydrate Ridge, OR, II: Hydrological processes

    NASA Astrophysics Data System (ADS)

    Tryon, M. D.; Brown, K. M.; Torres, M. E.

    2002-08-01

    Multiple, long-term measurements of aqueous and chemical flux through regions of active fluid seeps and gas vents on Hydrate Ridge, Cascadia accretionary prism, were accomplished during 1998 and 1999 as part of the international TECFLUX project. These measurements indicate that flow is highly heterogeneous in both time and space with areas of inflow, outflow, and outflow of fluids of both altered and seawater-like composition. While tectonics is the dominant underlying driving force in fluid expulsion, we suggest that much of the shallow expression of this flow is modulated by more complex hydrological processes. These dynamic processes may include gas expulsion-driven pumping and aqueous entrainment in migrating gas, buoyancy-driven fracturing of overlying sediments, rapid changes in the permeability distribution due to injection of gas and the formation of gas hydrates, migrating flow conduits, and tidally driven flow oscillations. By placing the flow rate observations obtained during the two field seasons in the context of the distribution and nature of the seepage sites, we develop a conceptual model of the spatial and temporal interactions between various processes that appear be active at Hydrate Ridge. We further discuss: (1) evidence for the existence of a subsurface gas transport system and discuss the mechanisms which maintain it, (2) estimates of the in situ permeability of seep settings and evidence for, and the mechanisms controlling temporal changes in permeability, and (3) changes in seep output fluid chemistry which may relate to the above hydrological processes.

  6. DNA interstrand cross-links of an antitumor trinuclear platinum(II) complex: thermodynamic analysis and chemical probing.

    PubMed

    Malina, Jaroslav; Farrell, Nicholas P; Brabec, Viktor

    2011-06-01

    The trinuclear platinum compound [{trans-PtCl(NH(3))(2)}(2)(?-trans-Pt(NH(3))(2){NH(2)(CH(2))(6)NH(2)}(2))](4+) (BBR3464) belongs to the polynuclear class of platinum-based anticancer agents. These agents form in DNA long-range (Pt,Pt) interstrand cross-links, whose role in the antitumor effects of BBR3464 predominates. Our results show for the first time that the interstrand cross-links formed by BBR3464 between two guanine bases in opposite strands separated by two base pairs (1,4-interstrand cross-links) exist as two distinct conformers, which are not interconvertible, not only if these cross-links are formed in the 5'-5', but also in the less-usual 3'-3' direction. Analysis of the conformers by differential scanning calorimetry, chemical probes of DNA conformation, and minor groove binder Hoechst 33258 demonstrate that each of the four conformers affects DNA in a distinctly different way and adopts a different conformation. The results also support the thesis that the molecule of antitumor BBR3464 when forming DNA interstrand cross-links may adopt different global structures, including different configurations of the linker chain of BBR3464 in the minor groove of DNA. Our findings suggest that the multiple DNA interstrand cross-links available to BBR3464 may all contribute substantially to its cytotoxicity. PMID:21557487

  7. PHYSIOLOGICAL ONTOGENY : A. CHICKEN EMBRYOS. II. CATABOLISM. CHEMICAL CHANGES IN FERTILE EGGS DURING INCUBATION. SELECTION OF STANDARD CONDITIONS.

    PubMed

    Murray, H A

    1925-09-20

    As this paper goes to press a complete review of the chemistry of the fertile egg will be appearing (19). The author, Mr. J. Needham, was kind enough to allow me to inspect his manuscript and thus avail myself of the comprehensive bibliography and discussion. It is surprising that no biochemists have estimated the changing water content of the egg during incubation. Many of the analyses reported in Needham's review were expressed in per cent of total weight or per cent of dry solid, and consequently are of questionable value, since these latter functions are themselves changing; the former due to water evaporation and the latter through the addition of shell constituents and the burning of oxidizable organic compounds. Moreover, there has been no statistical treatment of the results, and the reliability of the average, figures obtained has consequently been difficult to estimate. Tangl's work, quoted throughout this paper, except for its lack of statistical treatment is more enlightening. However, his concept of the so called "Energy of Embryogenesis" which he propounds, seems to me misleading and unwarranted. What Tangl measured was the amount and the caloric value of the solid material burned and thus the quantity of energy lost during the embryonic period. The latter is equivalent to the usual measurements of catabolism. In the case of the embryo it is not basal metabolism which is being estimated, since the conditions are not basal. The embryo is absorbing and assimilating nutriment all the while at a relatively rapid rate. The calorific value of the oxidized solid, which is in truth the amount of energy lost during a certain chosen interval, in Tangl's judgment stands for the energy of embryogenesis; i.e., the energy of development (growth + differentiation). We believe that this conception is erroneous. The two processes, anabolism and catabolism, occur together and undoubtedly have some relationship, but surely one is not a measure of the other. In a starving animal, and so probably in a starving embryo, there is a considerable amount of so called basal metabolism. Thus if the "Embryogenetic Energy" were measured under these conditions a figure would be obtained for which there was no growth to correspond, or in other words there would be a value for something which did not exist. It will be seen in our later communications that the changes with age of metabolic rate and growth rate do not coincide. The amount of catabolism under certain circumstances does not accelerate growth or anabolism, but seems rather to be a limiting factor. It is as if when the absorbed energy were constant an increase of catabolism would make inroads upon the amount of energy which otherwise would remain for storage (growth). If, as Pembrey's (20) experiments would tend to show, there is an increase of metabolism in the oldest embryos when the outside temperature is lowered, one would find at the end of incubation in such cases that there was a greater amount of so called "Energy of Development" but smaller embryo. It seems that the potential energy amassed as growth comes from that remaining after the needs of the body have been satisfied. The results of the experiments described in this paper have formed the basis for judgment in the selection of suitable standard conditions for the incubation of hen's eggs. Standardization was necessary so that in future experiments the more important environmental factors might be kept uniform within a certain appropriate range and therefore not be held accountable for deviations observed in the embryos. Henceforth in this series of papers the term "standard incubation conditions" will signify that (1) the temperature was constantly at 38.8 +/- 0.4 degrees C., (2) the humidity at 67.5 +/- 2.5 per cent, (3) there was a continuous flow of warm air into the incubator to provide the necessary circulation, and (4) the eggs were rolled once a day within the constant temperature room. The incubator, a double-walled copper cabinet, stands in a constant temperature room, the fluctuations of which are +/- 1.0 degrees C. The space between the walls of the incubator is filled with water which serves as a buffer to outer variations. It might be repeated that all the eggs are from White Leghorn hens, are incubated 2 days after laying, and that they are kept cold during the interval necessary for transportation. With the figures from our chemical analyses and metabolic rate experiments, it was possible to calculate values for the concentration of total solids, fat, and nitrogen throughout the incubation period. These data were necessary as a general chemical background for further work. The results of the calculations are obviously rough. Because of the great variability of the eggs a satisfactory degree of accuracy could not have been attained without a very large number of analyses supplemented by complete statistical treatment. The necessity for such a comprehensive study was not evident, and it is our belief that the approximations reached in this paper are sufficiently close to serve our present purposes. The chief facts that have been ascertained in this investigation are (1) Loss of water by the egg during incubation is a function of the atmospheric humidity in its immediate environment. More rapid circulation of air lowers the humidity around the egg and thus increases evaporation. Other facts influencing evaporation are (a) atmospheric temperature, (b) thickness and surface area of the shell, and (c) conditions within the egg, the most important of which, it is suggested, is the amount of heat produced by the embryo. The latter factor, in turn, depends upon its size and age, and a significant change does not become apparent until the last 3 or 4 days of incubation, that is to say, when the embryo is of sufficient mass to exert a measurable force. (2) The surface area of the eggs in sq. cm. may be approximately represented by the formula S = K W(2/3), where K = 5.07 +/- 0.10, and W = the weight of the whole egg in gm. (3) There is a loss of weight by the shell during incubation. This is most noticeable near the end of the cycle, when the loss seems to parallel in general the weight of the embryo. (4) There is also a loss of solid matter during incubation. Chemical analyses indicate that about 98 per cent of the material oxidized is fat. This conclusion is corroborative of previous work by Hasselbalch, Hasselbalch and Bohr, and Tangl. (5) Carbon dioxide may be measured with relative accuracy. When it is assumed that it is derived from the oxidation of fat, satisfactory corroboration of the chemical analyses is obtained. These experiments have furnished the data from which the values have been calculated for total solids, fats, and protein in the whole egg throughout incubation. The figures may be used later for comparison with the concentration of these substances within the embryo. PMID:19872226

  8. Phenotype-driven chemical screening in zebrafish for compounds that inhibit collective cell migration identifies multiple pathways potentially involved in metastatic invasion

    PubMed Central

    Gallardo, Viviana E.; Varshney, Gaurav K.; Lee, Minnkyong; Bupp, Sujata; Xu, Lisha; Shinn, Paul; Crawford, Nigel P.; Inglese, James; Burgess, Shawn M.

    2015-01-01

    ABSTRACT In the last decade, high-throughput chemical screening has become the dominant approach for discovering novel compounds with therapeutic properties. Automated screening using in vitro or cultured cell assays have yielded thousands of candidate drugs for a variety of biological targets, but these approaches have not resulted in an increase in drug discovery despite major increases in expenditures. In contrast, phenotype-driven screens have shown a much stronger success rate, which is why we developed an in vivo assay using transgenic zebrafish with a GFP-marked migrating posterior lateral line primordium (PLLp) to identify compounds that influence collective cell migration. We then conducted a high-throughput screen using a compound library of 2160 annotated bioactive synthetic compounds and 800 natural products to identify molecules that block normal PLLp migration. We identified 165 compounds that interfere with primordium migration without overt toxicity in vivo. Selected compounds were confirmed in their migration-blocking activity by using additional assays for cell migration. We then proved the screen to be successful in identifying anti-metastatic compounds active in vivo by performing orthotopic tumor implantation assays in mice. We demonstrated that the Src inhibitor SU6656, identified in our screen, can be used to suppress the metastatic capacity of a highly aggressive mammary tumor cell line. Finally, we used CRISPR/Cas9-targeted mutagenesis in zebrafish to genetically validate predicted targets of compounds. This approach demonstrates that the migrating PLLp in zebrafish can be used for large-scale, high-throughput screening for compounds that inhibit collective cell migration and, potentially, anti-metastatic compounds. PMID:25810455

  9. Phenotype-driven chemical screening in zebrafish for compounds that inhibit collective cell migration identifies multiple pathways potentially involved in metastatic invasion.

    PubMed

    Gallardo, Viviana E; Varshney, Gaurav K; Lee, Minnkyong; Bupp, Sujata; Xu, Lisha; Shinn, Paul; Crawford, Nigel P; Inglese, James; Burgess, Shawn M

    2015-06-01

    In the last decade, high-throughput chemical screening has become the dominant approach for discovering novel compounds with therapeutic properties. Automated screening using in vitro or cultured cell assays have yielded thousands of candidate drugs for a variety of biological targets, but these approaches have not resulted in an increase in drug discovery despite major increases in expenditures. In contrast, phenotype-driven screens have shown a much stronger success rate, which is why we developed an in vivo assay using transgenic zebrafish with a GFP-marked migrating posterior lateral line primordium (PLLp) to identify compounds that influence collective cell migration. We then conducted a high-throughput screen using a compound library of 2160 annotated bioactive synthetic compounds and 800 natural products to identify molecules that block normal PLLp migration. We identified 165 compounds that interfere with primordium migration without overt toxicity in vivo. Selected compounds were confirmed in their migration-blocking activity by using additional assays for cell migration. We then proved the screen to be successful in identifying anti-metastatic compounds active in vivo by performing orthotopic tumor implantation assays in mice. We demonstrated that the Src inhibitor SU6656, identified in our screen, can be used to suppress the metastatic capacity of a highly aggressive mammary tumor cell line. Finally, we used CRISPR/Cas9-targeted mutagenesis in zebrafish to genetically validate predicted targets of compounds. This approach demonstrates that the migrating PLLp in zebrafish can be used for large-scale, high-throughput screening for compounds that inhibit collective cell migration and, potentially, anti-metastatic compounds. PMID:25810455

  10. Long-term observation of water-soluble chemical components and acid-digested metals in the total suspended particles collected at Okinawa, Japan

    NASA Astrophysics Data System (ADS)

    Handa, D.; Okada, K.; Kuroki, Y.; Nakama, Y.; Nakajima, H.; Somada, Y.; Ijyu, M.; Azechi, S.; Oshiro, Y.; Nakaema, F.; Miyagi, Y.; Arakaki, T.; Tanahara, A.

    2011-12-01

    The economic growth and population increase in recent Asia have been increasing air pollution. Emission rate of air pollutants from Asia, in particular oxides of nitrogen, surpassed those from North America and Europe and should continue to exceed them for decades. Okinawa Island is situated approximately 1500 km south of Tokyo, Japan, 2000 km southeast of Beijing, China, and 1000 km south of South Korea. Its location is ideal in observing East Asia's air quality because maritime air mass prevails during summer, while continental air mass dominates during fall, winter, and spring. The maritime air mass data can be seen as background clean air and can be compared with continental air masses which have been affected by anthropogenic activities. We collected total suspended particles (TSP) on quartz filters by using a high volume air sampler at the Cape Hedo Atmosphere and Aerosol Monitoring Station (CHAAMS), Okinawa, Japan during August 2005 and August 2010. Sampling duration was one week for each sample. We determined the concentrations of water-soluble anions, cations, water-soluble organic carbon (WSOC) and acid-digested metals in TSP samples using ion chromatography, atomic absorption spectrometry, total organic carbon analyzer and Inductively Coupled Plasma Mass spectrometry (ICP-MS), respectively. Seasonal variation of water-soluble chemical components and acid-digested metals showed that the concentrations were the lowest in summer, higher in fall and winter, and the highest in spring. When air mass came from Asian continent, the concentrations of water-soluble chemical components and acid-digested metals were much higher compared to the other directions, suggesting long-range transport of air pollutants from Asian continent. Also, when the air mass came from Asian continent (75-100% dominant), the mean concentrations of non-sea salt sulfate and nitrate increased ca. 1.8 times and ca. 3.7 times, respectively between 2005 and 2010, and the ratio of nitrate to non-sea salt sulfate increased ca. 50% which suggested that automobile exhaust emission increased. In addition, the concentration of soil-originated components such as iron and aluminum increased ca. 2.6 times and ca. 3.0 times, suggesting a probable desertification. We also report the calculated background concentrations of water-soluble chemical components and acid-digested metals at Okinawa, Japan.

  11. Chemical abundances of planetary nebulae from optical recombination lines - II. Abundances derived from collisionally excited lines and optical recombination lines

    NASA Astrophysics Data System (ADS)

    Liu, Y.; Liu, X.-W.; Barlow, M. J.; Luo, S.-G.

    2004-10-01

    In Paper I, we presented spectrophotometric measurements of emission lines from the ultraviolet (UV) to the far-infrared for 12 Galactic planetary nebulae (PNe) and derived nebular thermal and density structures using a variety of plasma diagnostics. The measurements and plasma diagnostic results are used in the current paper to determine elemental abundances in these nebulae. Abundance analyses are carried out using both strong collisionally excited lines (CELs) and weak optical recombination lines (ORLs) from heavy element ions. Assuming electron temperatures and densities derived from HI recombination spectra (line and continuum), we are able to determine the ORL C abundance relative to hydrogen for all the PNe in our sample, N and O abundances for 11 of them and Ne abundances for nine of them. In all cases, ORL abundances are found to be systematically higher than the corresponding values deduced from CELs. In NGC 40, the discrepancy between the abundances derived from the two types of emission line reaches a factor of 17 for oxygen. For the other 10 PNe, the discrepancies for oxygen vary from 1.6 to 3.1. In general, collisionally excited infrared fine-structure lines, which have excitation energies less than 103 K and consequently emissivities that are insensitive to electron temperature and temperature fluctuations, yield ionic abundances comparable to those derived from optical/UV CELs. For a given nebula, the discrepancies between the ORL and CEL abundances are of similar magnitude for different elements. In other words, relative abundance ratios such as C/O, N/O and Ne/O deduced from the traditional method based on strong CELs are comparable to those yielded by ORLs, for a wide range of ORL to CEL oxygen abundance ratios, varying from near unity to over a factor of 20. We have also determined ORL abundances relative to hydrogen for the third-row element magnesium for 11 nebulae in our sample. In strong contrast to the cases for second-row elements, Mg abundances derived from the MgII 3d-4f λ4481 ORL are nearly constant for all the PNe analysed so far and agree within the uncertainties with the solar photospheric value. In accordance with results from previous studies, the ORL to CEL abundance ratio is correlated with the difference between the electron temperatures derived from the [OIII] forbidden-line ratio, on the one hand, and from the hydrogen recombination Balmer discontinuity, on the other. We find that the discrepancy between the ORL and CEL abundances is correlated with nebular absolute diameter, surface brightness, the electron density derived from [SII] CELs, and excitation class. The results confirm that the dichotomy of temperatures and heavy elemental abundances determined from the two types of emission line, which has been widely observed in PNe, is a strong function of nebular evolution, as first pointed out by Garnett and Dinerstein. Our analyses show that temperature fluctuations and/or density inhomogeneities are incapable of explaining the large discrepancies between the heavy elemental abundances and electron temperatures determined from the two types of emission line. Our analyses support the bi-abundance model of Liu et al., who have proposed that PNe contain another previously unseen component of ionized gas which, highly enriched in heavy elements, has an electron temperature of <~103 K and emits strongly in recombination lines but not in CELs. Our determinations of low average emission temperatures from the observed line intensity ratios of HeI and OII ORLs lend further support to this scenario.

  12. Chemical weathering of a soil chronosequence on granitoid alluvium: II. Mineralogic and isotopic constraints on the behavior of strontium

    USGS Publications Warehouse

    Bullen, T.; White, A.; Blum, A.; Harden, J.; Schulz, M.

    1997-01-01

    The use of strontium isotopes to evaluate mineral weathering and identify sources of base cations in catchment waters requires an understanding of the behavior of Sr in the soil environment as a function of time. Our approach is to model the temporal evolution of 87Sr/86Sr of the cation exchange pool in a soil chronosequence developed on alluvium derived from central Sierra Nevada granitoids during the past 3 Ma. With increasing soil age, 87Sr/86Sr of ammonium-acetate extractable Sr initially decreases from values typical of K-feldspar to those of plagioclase and hornblende and then remains constant, even though plagioclase and hornblende are absent from the soils after approximately 1 Ma of weathering. The temporal variation of 87Sr/86Sr of exchangeable Sr is modeled by progressively equilibrating Sr derived from mineral weathering and atmospheric deposition with Sr on exchange sites as waters infiltrate a soil column. Observed decreases in quartz-normalized modal abundances of plagioclase, hornblende, and K-feldspar with time, and the distinct 87Sr/86Sr values of these minerals can be used to calculate Sr flux from weathering reactions. Hydrobiotites in the soils have nearly constant modal abundances, chemistry, and 87Sr/86Sr over the chronosequence and provide negligible Sr input to weathering solutions. The model requires time and soil horizon-dependent changes in the amount of exchangeable Sr and the efficiency of Sr exchange, as well as a biologic cycling term. The model predicts that exchangeable Sr initially has 87Sr/86Sr identical to that of K-feldspar, and thus could be dominated by Sr leached from K-feldspar following deposition of the alluvium. The maximum value of 87Sr/86Sr observed in dilute stream waters associated with granitoids of the Yosemite region is likewise similar to that of the K-feldspars, suggesting that K-feldspar and not biotite may be the dominant source of radiogenic Sr in the streams. This study reveals that, when attempting to use Strontium isotopes to identify sources of base cations in catchment waters and biomass, both preferential leaching of Sr from minerals during incipient soil development and changing Sr exchange efficiency must be considered along with chemical contributions due to mineral dissolution. Copyright ?? 1997 Elsevier Science Ltd.

  13. Environmental chemical data for perishable sediments and soils collected in New Orleans, Louisiana, and along the Louisiana Delta following Hurricanes Katrina and Rita, 2005

    USGS Publications Warehouse

    Witt, Emitt C.; Shi, Honglan; Karstensen, Krista A.; Wang, Jianmin; Adams, Craig D.

    2008-01-01

    In October 2005, nearly one month after Hurricanes Katrina and Rita, a team of scientists from the U.S. Geological Survey and the Missouri University of Science and Technology deployed to southern Louisiana to collect perishable environmental data resulting from the impacts of these storms. Perishable samples collected for this investigation are subject to destruction or ruin by removal, mixing, or natural decay; therefore, collection is time-critical following the depositional event. A total of 238 samples of sediment, soil, and vegetation were collected to characterize chemical quality. For this analysis, 157 of the 238 samples were used to characterize trace element, iron, total organic carbon, pesticide, and polychlorinated biphenyl concentrations of deposited sediment and associated shallow soils. In decreasing order, the largest variability in trace element concentration was detected for lead, vanadium, chromium, copper, arsenic, cadmium, and mercury. Lead was determined to be the trace element of most concern because of the large concentrations present in the samples ranging from 4.50 to 551 milligrams per kilogram (mg/kg). Sequential extraction analysis of lead indicate that 39.1 percent of the total lead concentration in post-hurricane sediment is associated with the iron-manganese oxide fraction. This fraction is considered extremely mobile under reducing environmental conditions, thereby making lead a potential health hazard. The presence of lead in post-hurricane sediments likely is from redistribution of pre-hurricane contaminated soils and sediments from Lake Pontchartrain and the flood control canals of New Orleans. Arsenic concentrations ranged from 0.84 to 49.1 mg/kg. Although Arsenic concentrations generally were small and consistent with other research results, all samples exceeded the U.S. Environmental Protection Agency’s Human Health Medium-Specific Screening Level of 0.39 mg/kg. Mercury concentrations ranged from 0.02 to 1.30 mg/kg. Comparing the mean mercury concentration present in post-hurricane samples with regional background data from the U.S. Geological Survey National Geochemical Dataset, indicates that mercury concentrations in post-hurricane sediment generally are larger. Sequential extraction analysis of 51 samples for arsenic indicate that 54.5 percent of the total arsenic concentration is contained in the extremely mobile iron-manganese oxide fraction. Pesticide and polychlorinated biphenyl Arochlor concentrations in post-hurricane samples were small. Prometon was the most frequently detected pesticide with concentrations ranging from 2.4 to 193 micrograms per kilogram (µg/kg). Methoxychlor was present in 22 samples with a concentration ranging from 3.5 to 3,510 µg/kg. Although methoxychlor had the largest detected pesticide concentration, it was well below the U.S. Environmental Protection Agency’s High-Priority Screening Level for residential soils. Arochlor congeners were not detected for any sample above the minimum detection level of 7.9 µg/kg.

  14. Strain-balanced InAs/GaSb type-II superlattice structures and photodiodes grown on InAs substrates by metalorganic chemical vapor deposition

    NASA Astrophysics Data System (ADS)

    Huang, Yong; Ryou, Jae-Hyun; Dupuis, Russell D.; Zuo, Daniel; Kesler, Benjamin; Chuang, Shun-Lien; Hu, Hefei; Kim, Kyou-Hyun; Ting Lu, Yen; Hsieh, K. C.; Zuo, Jian-Min

    2011-07-01

    We propose and demonstrate strain-balanced InAs/GaSb type-II superlattices (T2SLs) grown on InAs substrates employing GaAs-like interfacial (IF) layers by metalorganic chemical vapor deposition (MOCVD) for effective strain management, simplified growth scheme, improved materials crystalline quality, and reduced substrate absorption. The in-plane compressive strain from the GaSb layers in the T2SLs on the InAs was completely balanced by the GaAs-like IF layers formed by controlled precursor carry-over and anion exchange effects, avoiding the use of complicated IF layers and precursor switching schemes that were used for the MOCVD growth of T2SLs on GaSb. An infrared (IR) p-i-n photodiode structure with 320-period InAs/GaSb T2SLs on InAs was grown and the fabricated devices show improved performance characteristics with a peak responsivity of ˜1.9 A/W and a detectivity of ˜6.78 × 109 Jones at 8 μm at 78 K. In addition, the InAs buffer layer and substrate show a lower IR absorption coefficient than GaSb substrates in most of the mid- and long-IR spectral range.

  15. 40 CFR 125.95 - As an owner or operator of a Phase II existing facility, what must I collect and submit when I...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... activities; (2) You must submit to the Director the information required in 40 CFR 122.21(r)(2), (r)(3) and... your NPDES permit application in accordance with the time frames specified in 40 CFR 122.21(d)(2). (ii... qualifications (e.g., in the fields of geology, engineering, and/or biology, etc.) depending upon the...

  16. 40 CFR 125.95 - As an owner or operator of a Phase II existing facility, what must I collect and submit when I...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... activities; (2) You must submit to the Director the information required in 40 CFR 122.21(r)(2), (r)(3) and... your NPDES permit application in accordance with the time frames specified in 40 CFR 122.21(d)(2). (ii... qualifications (e.g., in the fields of geology, engineering, and/or biology, etc.) depending upon the...

  17. 40 CFR 125.95 - As an owner or operator of a Phase II existing facility, what must I collect and submit when I...

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... activities; (2) You must submit to the Director the information required in 40 CFR 122.21(r)(2), (r)(3) and... your NPDES permit application in accordance with the time frames specified in 40 CFR 122.21(d)(2). (ii... and entrainment (e.g., related to climate and weather differences, spawning, feeding and water...

  18. 40 CFR 125.95 - As an owner or operator of a Phase II existing facility, what must I collect and submit when I...

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... activities; (2) You must submit to the Director the information required in 40 CFR 122.21(r)(2), (r)(3) and... your NPDES permit application in accordance with the time frames specified in 40 CFR 122.21(d)(2). (ii... and entrainment (e.g., related to climate and weather differences, spawning, feeding and water...

  19. 40 CFR 125.95 - As an owner or operator of a Phase II existing facility, what must I collect and submit when I...

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... activities; (2) You must submit to the Director the information required in 40 CFR 122.21(r)(2), (r)(3) and... your NPDES permit application in accordance with the time frames specified in 40 CFR 122.21(d)(2). (ii... and entrainment (e.g., related to climate and weather differences, spawning, feeding and water...

  20. Injectable PLA-based in situ forming implants for controlled release of Ivermectin a BCS Class II drug: solvent selection based on physico-chemical characterization.

    PubMed

    Camargo, J A; Sapin, A; Nouvel, C; Daloz, D; Leonard, M; Bonneaux, F; Six, J-L; Maincent, P

    2013-01-01

    In situ forming implants (ISI) prepared from biodegradable polymers such as poly(D,L-lactide) (PLA) and biocompatible solvents can be used to obtain sustained drug release after parenteral administration. The aim of this work was to study the effect of several biocompatible solvents with different physico-chemical properties on the release of ivermectin (IVM), an antiparasitic BCS II drug, from in situ forming PLA-based implants. The solvents evaluated were N-methyl-2-pyrrolidone (NMP), 2-pyrrolidone (2P), triacetine (TA) and benzyl benzoate (BB). Hansen's solubility parameters of solvents were used to explain polymer/solvent interactions leading to different rheological behaviours. The stability of the polymer and drug in the solvents were also evaluated by size exclusion and high performance liquid chromatography, respectively. The two major factors determining the rate of IVM release from ISI were miscibility of the solvent with water and the viscosity of the polymer solutions. In general, the release rate increased with increasing water miscibility of the solvent and decreasing viscosity in the following order NMP>2P>TA>BB. Scanning electron microscopy revealed a relationship between the rate of IVM release and the surface porosity of the implants, release being higher as implant porosity increased. Finally, drug and polymer stability in the solvents followed the same trends, increasing when polymer-solvent affinities and water content in solvents decreased. IVM degradation was accelerated by the acid environment generated by the degradation of the polymer but the drug did not affect PLA stability. PMID:22397675

  1. Binary Classification of a Large Collection of Environmental Chemicals from Estrogen Receptor Assays by Quantitative Structure-Activity Relationship and Machine Learning Methods

    EPA Science Inventory

    ABSTRACT: There are thousands of environmental chemicals subject to regulatory decisions for endocrine disrupting potential. A promising approach to manage this large universe of untested chemicals is to use a prioritization filter that combines in vitro assays with in silico QSA...

  2. Historical estimates of external gamma exposure and collective external gamma exposure from testing at the Nevada Test Site. I. Test series through HARDTACK II, 1958

    SciTech Connect

    Anspaugh, L.R.; Church, B.W.

    1985-12-01

    In 1959, the Test Manager's Committee to Establish Fallout Doses calculated estimated external gamma exposure at populated locations based upon measurements of external gamma-exposure rate. Using these calculations and estimates of population, we have tabulated the collective estimated external gamma exposures for communities within established fallout patterns. The total collective estimated external gamma exposure is 85,000 person-R. The greatest collective exposures occurred in three general areas: Saint George, Utah; Ely, Nevada; and Las Vegas, Nevada. Three events, HARRY (May 19, 1953), BEE (March 22, 1955), and SMOKY (August 31, 1957), accounted for over half of the total collective estimated external gamma exposure. The bases of the calculational models for external gamma exposure of ''infinite exposure,'' ''estimated exposure,'' and ''one year effective biological exposure'' are explained. 4 figs., 7 tabs.

  3. Historical estimates of external gamma exposure and collective external gamma exposure from testing at the Nevada Test Site. I. Test series through HARDTACK II, 1958

    SciTech Connect

    Anspaugh, L.R.; Church, B.W.

    1986-07-01

    In 1959, the Test Manager's Committee to Establish Fallout Doses calculated estimated external gamma exposure at populated locations based upon measurements of external gamma-exposure rate. Using these calculations and estimates of population, we have tabulated the collective estimated external gamma exposures for communities within established fallout patterns. The total collective estimated external gamma exposure is 85,000 person-R. The greatest collective exposures occurred in three general areas: Saint George, UT; Ely, NV; and Las Vegas, NV. Three events, HARRY (19 May 1953), BEE (22 March 1955), and SMOKY (31 August 1957), accounted for more than half the total collective estimated external gamma exposure. The bases of the calculational models for external gamma exposure of infinite exposure, estimated exposure, and 1-yr effective biological exposure are explained.

  4. Inplementation of an automated signal processing approach for the analysis of chemical spectral signatures collected from FT-IR mounted in an aircraft

    SciTech Connect

    Kroutil, Robert T

    2008-01-01

    The automated detection of chemical spectral signatures using a passive infrared Fourier Transform Infrared (FT-IR) Spectrometer mounted in an aircraft is a difficult challenge due to the small total infrared energy contribution of a particular chemical species compared to the background signature. The detection of spectral signatures is complicated by the fact that a large, widely varying infrared background is present that is coupled with the presence of a number of chemical interferents in the atmosphere. This paper describes a mathematical technique that has been demonstrated to automatically detect specific chemical species in an automated processing environment. The data analysis methodology has been demonstrated to be effective using data of low spectral resolution at low aircraft altitudes. An overview of the implementation and basic concepts of the approach are presented.

  5. Microseismic roof fall warning system development: field trials and commercial prototype fabrication. Volume II. Appendix C: coal mine data collection summary. Open file report (final) Aug 77-Dec 79

    SciTech Connect

    Fisher Jr, C.

    1980-05-30

    A microseismic roof fall warning system was field tested in Western and Eastern coal mines in the United States to better define the capabilities and limitations of the microseismic method in predicting roof fall. Microseismic event and energy type data were obtained and documented for 23 coal mine roof falls. Field test results indicate that both the microseismic event and energy methods, as applied, have a high probability for successful application in a commercially practical roof fall warning system. Volume II summarizes the data collected.

  6. THE SPLASH SURVEY: INTERNAL KINEMATICS, CHEMICAL ABUNDANCES, AND MASSES OF THE ANDROMEDA I, II, III, VII, X, AND XIV DWARF SPHEROIDAL GALAXIES {sup ,}

    SciTech Connect

    Kalirai, Jason S.; Beaton, Rachael L.; Majewski, Steven R.; Ostheimer, James C.; Patterson, Richard J.; Geha, Marla C.; Gilbert, Karoline M.; Guhathakurta, Puragra; Kirby, Evan N.

    2010-03-10

    We present new Keck/DEIMOS spectroscopic observations of hundreds of individual stars along the sightline to the first three of the Andromeda (M31) dwarf spheroidal (dSph) galaxies to be discovered, And I, II, and III, and combine them with recent spectroscopic studies by our team of three additional M31 dSphs, And VII, X, and XIV, as a part of the SPLASH Survey (Spectroscopic and Photometric Landscape of Andromeda's Stellar Halo). Member stars of each dSph are isolated from foreground Milky Way dwarf stars and M31 field contamination using a variety of photometric and spectroscopic diagnostics. Our final spectroscopic sample of member stars in each dSph, for which we measure accurate radial velocities with a median uncertainty (random plus systematic errors) of 4-5 km s{sup -1}, includes 80 red giants in And I, 95 in And II, 43 in And III, 18 in And VII, 22 in And X, and 38 in And XIV. The sample of confirmed members in the six dSphs is used to derive each system's mean radial velocity, intrinsic central velocity dispersion, mean abundance, abundance spread, and dynamical mass. This combined data set presents us with a unique opportunity to perform the first systematic comparison of the global properties (e.g., metallicities, sizes, and dark matter masses) of one-third of Andromeda's total known dSph population with Milky Way counterparts of the same luminosity. Our overall comparisons indicate that the family of dSphs in these two hosts have both similarities and differences. For example, we find that the luminosity-metallicity relation is very similar between L {approx} 10{sup 5} and 10{sup 7} L{sub sun}, suggesting that the chemical evolution histories of each group of dSphs are similar. The lowest luminosity M31 dSphs appear to deviate from the relation, possibly suggesting tidal stripping. Previous observations have noted that the sizes of M31's brightest dSphs are systematically larger than Milky Way satellites of similar luminosity. At lower luminosities between L = 10{sup 4} and 10{sup 6} L{sub sun}, we find that the sizes of dSphs in the two hosts significantly overlap and that four of the faintest M31 dSphs are smaller than Milky Way counterparts. The first dynamical mass measurements of six M31 dSphs over a large range in luminosity indicate similar mass-to-light ratios compared to Milky Way dSphs among the brighter satellites, and smaller mass-to-light ratios among the fainter satellites. Combined with their similar or larger sizes at these luminosities, these results hint that the M31 dSphs are systematically less dense than Milky Way dSphs. The implications of these similarities and differences for general understanding of galaxy formation and evolution are summarized.

  7. Subject Indexing and Citation Indexing--Part I: Clustering Structure in the Cystic Fibrosis Document Collection [and] Part II: An Evaluation and Comparison.

    ERIC Educational Resources Information Center

    Shaw, W. M., Jr.

    1990-01-01

    These two articles discuss clustering structure in the Cystic Fibrosis Document Collection, which is derived from the National Library of Medicine's MEDLINE file. The exhaustivity of four subject representations and two citation representations is examined, and descriptor-weight thresholds and similarity thresholds are used to compute

  8. Subject Indexing and Citation Indexing--Part I: Clustering Structure in the Cystic Fibrosis Document Collection [and] Part II: An Evaluation and Comparison.

    ERIC Educational Resources Information Center

    Shaw, W. M., Jr.

    1990-01-01

    These two articles discuss clustering structure in the Cystic Fibrosis Document Collection, which is derived from the National Library of Medicine's MEDLINE file. The exhaustivity of four subject representations and two citation representations is examined, and descriptor-weight thresholds and similarity thresholds are used to compute…

  9. Computer analysis of human esophageal peristalsis and lower esophageal sphincter pressure. II. An interactive system for on-line data collection and analysis.

    PubMed

    Castell, J A; Castell, D O

    1986-11-01

    A computer program has been written to directly read and analyze esophageal manometric tracings on-line using low-cost off-the-shelf microcomputer hardware. The system consists of an Apple IIe microcomputer and an Interactive Microwave Inc. ADALAB Data Acquisition System with an AI13 fast A/D Multiplexer. The primary program is in BASIC with ASSEMBLY language subroutines for data collection. Data are collected through the voltage output of a Hewlett-Packard recorder at 30 points per second on four channels for lower esophageal sphincter pressures (LESP) and three channels for peristaltic waves. Computer-determined values for LESP and wave parameters showed excellent correlation with mean values as read by five individuals experienced in esophageal manometry. PMID:3769705

  10. Chemicals of emerging concern in water and bottom sediment in the Great Lakes Basin, 2012: collection methods, analytical methods, quality assurance, and study data

    USGS Publications Warehouse

    Lee, Kathy E.; Langer, Susan K.; Menheer, Michael A.; Hansen, Donald S.; Foreman, William T.; Furlong, Edward T.; Jorgenson, Zachary G.; Choy, Steven J.; Moore, Jeremy N.; Banda, JoAnn; Gefell, Daniel J.

    2015-01-01

    During this study, 53 environmental samples, 4 field duplicate samples, and 8 field spike samples of bottom sediment and laboratory matrix-spike samples were analyzed for a wide variety of CECs at the USGS National Water Quality Laboratory using laboratory schedule 5433 for wastewater indicators; research method 6434 for steroid hormones, sterols, and bisphenol A; and research method 9008 for human-use pharmaceuticals and antidepressants. Forty of the 57 chemicals analyzed using laboratory schedule 5433 had detectable concentrations ranging from 1 to 49,000 micrograms per kilogram. Fourteen of the 20 chemicals analyzed using research method 6434 had detectable concentrations ranging from 0.04 to 24,940 nanograms per gram. Ten of the 20 chemicals analyzed using research method 9008 had detectable concentrations ranging from 0.59 to 197.5 micrograms per kilogram. Five of the 11 chemicals analyzed using research method 9008 had detectable concentrations ranging from 1.16 to 25.0 micrograms per kilogram.

  11. Design of I2-II-IV-VI4 Semiconductors through Element-substitution: the Thermodynamic Stability Limit and Chemical Trend

    NASA Astrophysics Data System (ADS)

    Chen, Shiyou; Wang, Congcong; Xiang, Hongjun; Gong, Xin-Gao; Walsh, Aron; Wei, Su-Huai

    2015-03-01

    Through element substitution in kesterite Cu2ZnSnS4orCu2ZnSnSe4, a class of I2-II-IV-VI4 semiconductors can be designed as novel functional materials. Using the first-principles calculations, we show that this element-substitution design is thermodynamically limited, i.e., although I2-II-IV-VI4 with I =Cu, Ag, II =Zn, Cd, Hg, IV =Si, Ge, Sn and VI =S, Se, Te are stable quaternary compounds, those with II =Mg, Ca, Sr, Ba, IV =Ti, Zr, Hf, and VI =O are unstable against the phase-separation into the competing binary and ternary compounds. Three main phase-separation pathways are revealed. In general, we show that if the secondary II-VI or I2-IV-VI3 phases prefer to have non-tetrahedral structures, then the I2-II-IV-VI4 semiconductors tend to phase separate. This finding can be used as a guideline for future design of new quaternary semiconductors.

  12. Chemical Transformation Simulator

    EPA Science Inventory

    The Chemical Transformation Simulator (CTS) is a web-based, high-throughput screening tool that automates the calculation and collection of physicochemical properties for an organic chemical of interest and its predicted products resulting from transformations in environmental sy...

  13. Integrated Procurement Management System, Version II

    NASA Technical Reports Server (NTRS)

    Collier, L. J.

    1985-01-01

    Integrated Procurement Management System, Version II (IPMS II) is online/ batch system for collecting developing, managing and disseminating procurementrelated data at NASA Johnson Space Center. Portions of IPMS II adaptable to other procurement situations.

  14. High-Frequency (13)C and (29)Si NMR Chemical Shifts in Diamagnetic Low-Valence Compounds of Tl(I) and Pb(II): Decisive Role of Relativistic Effects.

    PubMed

    Vícha, Jan; Marek, Radek; Straka, Michal

    2016-02-15

    The (13)C and (29)Si NMR signals of ligand atoms directly bonded to Tl(I) or Pb(II) heavy-element centers are predicted to resonate at very high frequencies, up to 400 ppm for (13)C and over 1000 ppm for (29)Si, outside the typical experimental NMR chemical-shift ranges for a given type of nuclei. The large (13)C and (29)Si NMR chemical shifts are ascribed to sizable relativistic spin-orbit effects, which can amount to more than 200 ppm for (13)C and more than 1000 ppm for (29)Si, values unexpected for diamagnetic compounds of the main group elements. The origin of the vast spin-orbit contributions to the (13)C and (29)Si NMR shifts is traced to the highly efficient 6p → 6p* metal-based orbital magnetic couplings and related to the 6p orbital-based bonding together with the low-energy gaps between the occupied and virtual orbital subspaces in the subvalent Tl(I) and Pb(II) compounds. New NMR spectral regions for these compounds are suggested based on the fully relativistic density functional theory calculations in the Dirac-Coulomb framework carefully calibrated on the experimentally known NMR data for Tl(I) and Pb(II) complexes. PMID:26820039

  15. Estimation of the chemical-induced eye injury using a Weight-of-Evidence (WoE) battery of 21 artificial neural network (ANN) c-QSAR models (QSAR-21): part II: corrosion potential.

    PubMed

    Verma, Rajeshwar P; Matthews, Edwin J

    2015-03-01

    This is part II of an in silico investigation of chemical-induced eye injury that was conducted at FDA's CFSAN. Serious eye damage caused by chemical (eye corrosion) is assessed using the rabbit Draize test, and this endpoint is an essential part of hazard identification and labeling of industrial and consumer products to ensure occupational and consumer safety. There is an urgent need to develop an alternative to the Draize test because EU's 7th amendment to the Cosmetic Directive (EC, 2003; 76/768/EEC) and recast Regulation now bans animal testing on all cosmetic product ingredients and EU's REACH Program limits animal testing for chemicals in commerce. Although in silico methods have been reported for eye irritation (reversible damage), QSARs specific for eye corrosion (irreversible damage) have not been published. This report describes the development of 21 ANN c-QSAR models (QSAR-21) for assessing eye corrosion potential of chemicals using a large and diverse CFSAN data set of 504 chemicals, ADMET Predictor's three sensitivity analyses and ANNE classification functionalities with 20% test set selection from seven different methods. QSAR-21 models were internally and externally validated and exhibited high predictive performance: average statistics for the training, verification, and external test sets of these models were 96/96/94% sensitivity and 91/91/90% specificity. PMID:25510831

  16. Harnessing Technology to Improve Clinical Trials: Study of Real-Time Informatics to Collect Data, Toxicities, Image Response Assessments, and Patient-Reported Outcomes in a Phase II Clinical Trial

    PubMed Central

    Pietanza, M. Catherine; Basch, Ethan M.; Lash, Alex; Schwartz, Lawrence H.; Ginsberg, Michelle S.; Zhao, Binsheng; Shouery, Marwan; Shaw, Mary; Rogak, Lauren J.; Wilson, Manda; Gabow, Aaron; Latif, Marcia; Lin, Kai-Hsiung; Wu, Qinfei; Kass, Samantha L.; Miller, Claire P.; Tyson, Leslie; Sumner, Dyana K.; Berkowitz-Hergianto, Alison; Sima, Camelia S.; Kris, Mark G.

    2013-01-01

    Purpose In clinical trials, traditional monitoring methods, paper documentation, and outdated collection systems lead to inaccuracies of study information and inefficiencies in the process. Integrated electronic systems offer an opportunity to collect data in real time. Patients and Methods We created a computer software system to collect 13 patient-reported symptomatic adverse events and patient-reported Karnofsky performance status, semi-automated RECIST measurements, and laboratory data, and we made this information available to investigators in real time at the point of care during a phase II lung cancer trial. We assessed data completeness within 48 hours of each visit. Clinician satisfaction was measured. Results Forty-four patients were enrolled, for 721 total visits. At each visit, patient-reported outcomes (PROs) reflecting toxicity and disease-related symptoms were completed using a dedicated wireless laptop. All PROs were distributed in batch throughout the system within 24 hours of the visit, and abnormal laboratory data were available for review within a median of 6 hours from the time of sample collection. Manual attribution of laboratory toxicities took a median of 1 day from the time they were accessible online. Semi-automated RECIST measurements were available to clinicians online within a median of 2 days from the time of imaging. All clinicians and 88% of data managers felt there was greater accuracy using this system. Conclusion Existing data management systems can be harnessed to enable real-time collection and review of clinical information during trials. This approach facilitates reporting of information closer to the time of events, and improves efficiency, and the ability to make earlier clinical decisions. PMID:23630218

  17. Development of quantitative structure-activity relationship (QSAR) models to predict the carcinogenic potency of chemicals. II. Using oral slope factor as a measure of carcinogenic potency.

    PubMed

    Wang, Nina Ching Yi; Venkatapathy, Raghuraman; Bruce, Robert Mark; Moudgal, Chandrika

    2011-03-01

    The overall risk associated with exposure to a chemical is determined by combining quantitative estimates of exposure to the chemical with their known health effects. For chemicals that cause carcinogenicity, oral slope factors (OSFs) and inhalation unit risks are used to quantitatively estimate the carcinogenic potency or the risk associated with exposure to the chemical by oral or inhalation route, respectively. Frequently, there is a lack of animal or human studies in the literature to determine OSFs. This study aims to circumvent this problem by developing quantitative structure-activity relationship (QSAR) models to predict the OSFs of chemicals. The OSFs of 70 chemicals based on male/female human, rat, and mouse bioassay data were obtained from the United States Environmental Protection Agency's Integrated Risk Information System (IRIS) database. A global QSAR model that considered all 70 chemicals as well as species and/or sex-specific QSARs were developed in this study. Study results indicate that the species and sex-specific QSARs (r(2)>0.8, q(2)>0.7) had a better predictive abilities than the global QSAR developed using data from all species and sexes (r(2)=0.77, q(2)=0.73). The QSARs developed in this study were externally validated, and demonstrated reasonable predictive abilities. PMID:20951756

  18. TOPoS . II. On the bimodality of carbon abundance in CEMP stars Implications on the early chemical evolution of galaxies

    NASA Astrophysics Data System (ADS)

    Bonifacio, P.; Caffau, E.; Spite, M.; Limongi, M.; Chieffi, A.; Klessen, R. S.; François, P.; Molaro, P.; Ludwig, H.-G.; Zaggia, S.; Spite, F.; Plez, B.; Cayrel, R.; Christlieb, N.; Clark, P. C.; Glover, S. C. O.; Hammer, F.; Koch, A.; Monaco, L.; Sbordone, L.; Steffen, M.

    2015-07-01

    Context. In the course of the Turn Off Primordial Stars (TOPoS) survey, aimed at discovering the lowest metallicity stars, we have found several carbon-enhanced metal-poor (CEMP) stars. These stars are very common among the stars of extremely low metallicity and provide important clues to the star formation processes. We here present our analysis of six CEMP stars. Aims: We want to provide the most complete chemical inventory for these six stars in order to constrain the nucleosynthesis processes responsible for the abundance patterns. Methods: We analyse both X-Shooter and UVES spectra acquired at the VLT. We used a traditional abundance analysis based on OSMARCS 1D local thermodynamic equilibrium (LTE) model atmospheres and the turbospectrum line formation code. Results: Calcium and carbon are the only elements that can be measured in all six stars. The range is -5.0 ≤ [Ca/H] <-2.1 and 7.12 ≤ A(C) ≤ 8.65. For star SDSS J1742+2531 we were able to detect three Fe i lines from which we deduced [Fe/H] = -4.80, from four Ca ii lines we derived [Ca/H] = -4.56, and from synthesis of the G-band we derived A(C) = 7.26. For SDSS J1035+0641 we were not able to detect any iron lines, yet we could place a robust (3σ) upper limit of [Fe/H] < -5.0 and measure the Ca abundance, with [Ca/H] = -5.0, and carbon, A(C) = 6.90, suggesting that this star could be even more metal-poor than SDSS J1742+2531. This makes these two stars the seventh and eighth stars known so far with [Fe/H] < -4.5, usually termed ultra-iron-poor (UIP) stars. No lithium is detected in the spectrum of SDSS J1742+2531 or SDSS J1035+0641, which implies a robust upper limit of A(Li) < 1.8 for both stars. Conclusions: Our measured carbon abundances confirm the bimodal distribution of carbon in CEMP stars, identifying a high-carbon band and a low-carbon band. We propose an interpretation of this bimodality according to which the stars on the high-carbon band are the result of mass transfer from an AGB companion, while the stars on the low-carbon band are genuine fossil records of a gas cloud that has also been enriched by a faint supernova (SN) providing carbon and the lighter elements. The abundance pattern of the UIP stars shows a large star-to-star scatter in the [X/Ca] ratios for all elements up to aluminium (up to 1 dex), but this scatter drops for heavier elements and is at most of the order of a factor of two. We propose that this can be explained if these stars are formed from gas that has been chemically enriched by several SNe, that produce the roughly constant [X/Ca] ratios for the heavier elements, and in some cases the gas has also been polluted by the ejecta of a faint SN that contributes the lighter elements in variable amounts. The absence of lithium in four of the five known unevolved UIP stars can be explained by a dominant role of fragmentation in the formation of these stars. This would result either in a destruction of lithium in the pre-main-sequence phase, through rotational mixing or to a lack of late accretion from a reservoir of fresh gas. The phenomenon should have varying degrees of efficiency. Based on observations obtained at ESO Paranal Observatory, programme 091.D-0288, 091.D-0305, 189.D-0165.Appendix A is available in electronic form at http://www.aanda.orgTables 4 is only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/579/A28

  19. Chemical abundances in the protoplanetary disc LV 2 (Orion): clues to the causes of the abundance anomaly in H II regions

    NASA Astrophysics Data System (ADS)

    Tsamis, Y. G.; Walsh, J. R.; Vílchez, J. M.; Péquignot, D.

    2011-04-01

    Optical integral field spectroscopy of the archetype protoplanetary disc LV 2 in the Orion nebula is presented, taken with the Very Large Telescope (VLT) FLAMES/Argus fibre array. The detection of recombination lines (RLs) of C II and O II from this class of objects is reported, and the lines are utilized as abundance diagnostics. The study is complemented with the analysis of Hubble Space Telescope (HST) Faint Object Spectrograph ultraviolet and optical spectra of the target contained within the Argus field of view. By subtracting the local nebula background the intrinsic spectrum of the proplyd is obtained and its elemental composition is derived for the first time. The proplyd is found to be overabundant in carbon, oxygen and neon compared to the Orion nebula and the Sun. The simultaneous coverage over LV 2 of the C III]λ1908 and [O III]λ5007 collisionally excited lines (CELs) and C II and O II RLs has enabled us to measure the abundances of C2 + and O2 + for LV 2 with both sets of lines. The two methods yield consistent results for the intrinsic proplyd spectrum, but not for the proplyd spectrum contaminated by the generic nebula spectrum, thus providing one example where the long-standing abundance anomaly plaguing metallicity studies of H II regions has been resolved. These results would indicate that the standard forbidden-line methods used in the derivation of light metal abundances in H II regions in our own and other galaxies underestimate the true gas metallicity.

  20. Long-term chemical carcinogenesis experiments for identifying potential human cancer hazards: collective database of the National Cancer Institute and National Toxicology Program (1976-1991).

    PubMed Central

    Huff, J; Haseman, J

    1991-01-01

    The carcinogenicity database used for this paper originated in the late 1960s by the National Cancer Institute (NCI) and since 1978 has been continued and made more comprehensive by the National Toxicology Program (NTP). The extensive files contain, among other sets of information, detailed pathology data on more than 400 long-term (most often 24-month) chemical carcinogenesis studies, comprising nearly 1600 individual experiments having at least 10 million tissue sections that have been evaluated for toxicity and carcinogenicity.(ABSTRACT TRUNCATED AT 250 WORDS) PMID:1820269

  1. Collecting Volcanic Gas Samples

    Steven Ingebritsen (lower right, in blue hat) kneels in the warm mud as he collects samples of the gases emitted from the fumaroles on the north side of Crater Rock on Mount Hood. The samples are taken back to the laboratory for an analysis of the gases' chemical composition. By routinely collecting...

  2. Kinetic theory of spin-polarized systems in electric and magnetic fields with spin-orbit coupling. II. RPA response functions and collective modes

    NASA Astrophysics Data System (ADS)

    Morawetz, K.

    2015-12-01

    The spin and density response functions in the random phase approximation are derived by linearizing the kinetic equation including a magnetic field, the spin-orbit coupling, and mean fields with respect to an external electric field. Different polarization functions appear describing various precession motions showing Rabi satellites due to an effective Zeeman field. The latter turns out to consist of the mean-field magnetization, the magnetic field, and the spin-orbit vector. The collective modes for charged and neutral systems are derived and a threefold splitting of the spin waves dependent on the polarization and spin-orbit coupling is shown. The dielectric function including spin-orbit coupling, polarization, and magnetic fields is presented analytically for long wavelengths and in the static limit. The dynamical screening length as well as the long-wavelength dielectric function shows an instability in charge modes, which are interpreted as spin segregation and domain formation. The spin response describes a crossover from damped oscillatory behavior to exponentially damped behavior dependent on the polarization and collision frequency. The magnetic field causes ellipsoidal trajectories of the spin response to an external electric field and the spin-orbit coupling causes a rotation of the spin axes. The spin-dephasing times are extracted and discussed in dependence on the polarization, magnetic field, spin-orbit coupling, and single-particle relaxation times.

  3. Science research annual, volume II: a collection of science staff memoranda and letters from the Illinois Legislature Council - January-June 1980. Annual report Jan 80-Sep 81

    SciTech Connect

    Dutton, J.A.

    1981-09-01

    This volume contains a collection of correspondence and contributions from the Illinois Legislative Council. The memoranda, which have been organized into research reports, answer requests from individual legislators for information on specific science, technology, and public policy issues, and include information sources and pertinent legislation of the 81st Illinois General Assembly. Topics covered are as follows: abortion information; accidental deer slaughter; regulation of airport noise pollution; historical artifacts preservation; asbestos health hazards; automobile repair legislation; HLA blood tests; financial aid for catastrophic illness; cost comparison of coal and nuclear power; mandates for coroners versus medical examiners; dialysis patient programs; drug paraphernalia legislation; electric generating capacity of Fox River dams; energy efficiency in appliances; euthanasia; farmland preservation; licenses for fish dealers; gasohol definition, grants, and other states' laws; medical precautions at football games; the Ames, Iowa methane plant; metric sales laws; proposed mining regulations; nuclear power referenda; nuclear waste disposal; pharmaceutical assistance and renewable prescriptions for the aged; licensing of radiation device operators; scientific creationism; solar energy grants and loans; funding for solar energy programs; sulfur dioxide standards; and visual aid programs.

  4. Chemical composition, antioxidant and antimicrobial activities of essential oil obtained from Ferula assa-foetida oleo-gum-resin: effect of collection time.

    PubMed

    Kavoosi, Gholamreza; Rowshan, Vahid

    2013-06-15

    The properties of essential oils obtained from Ferula assa-foetida oleo-gum-resins (OGRs) collectioned in three collections times in 15 June (OGR1), 30 June (OGR2) and 15 July (OGR3) 2011 was investigated. Essential oil from OGR1 was constituted high levels of (E)-1-propenyl sec-butyl disulfide (23.9%) and 10-epi-γ-eudesmol (15.1%). Essential oil from OGR2 was constituted high levels of (Z)-1-propenyl sec-butyl disulfide (27.7%) and (E)-1-propenyl sec-butyl disulfide (20.3%). Essential oil from OGR3 was constituted high levels of β-pinene (47.1%) and α-pinene (21.3%). Inhibitory concentration (IC50) for radical scavenging were 0.012-0.035, 0.025-0.047 and 0.035-0.066 mg/ml of essential oil obtained from OGR1, OGR2 and OGR3, respectively. Minimal inhibitory concentration (MIC) for Gram-positive and Gram-negative bacteria and fungi grpwth were 0.028-0.111, 0.027-0.107 and 0.018-0.058 mg/ml of essential oil obtained from OGR1, OGR2 and OGR3, respectively. Essential oils obtained from different OGRs have different composition and biological activity thus have different applications in food and health industry. PMID:23497874

  5. Relationships between anthropogenic chemical contaminant exposure and associated changes in reproductive parameters in male English sole (Parophrys vetulus) collected from Hylebos Waterway, Puget Sound, Washington.

    PubMed

    Sol, Sean Y; Johnson, Lyndal L; Boyd, Daryle; Olson, O Paul; Lomax, Dan P; Collier, Tracy K

    2008-11-01

    Effects of chemical contaminant exposure on gonadal development in adult male English sole (Parophrys vetulus) from Hylebos Waterway and Colvos Passage, Puget Sound, Washington were investigated. Hylebos Waterway sediment is contaminated with polycyclic aromatic hydrocarbons (PAHs) and organochlorines (OCs), and Colvos Passage, a nearby nonurban area, is minimally contaminated. Fish from Hylebos Waterway had higher concentrations of both PAHs and OCs in tissues than fish from Colvos Passage. Overall, little correlation was observed between PAH exposure and biological parameters, but strong correlations were observed between OCs and the biological parameters. Migration of fish from less contaminated areas into the Hylebos Waterway during the reproductive season might have influenced these results, based on temporal changes in fish age and contaminant concentrations. PMID:18274819

  6. Pseudo-first-order reaction of chemically and biologically formed green rusts with HgII and C₁₅H₁₅N₃O₂: effects of pH and stabilizing agents (phosphate, silicate, polyacrylic acid, and bacterial cells).

    PubMed

    Remy, P-Ph; Etique, M; Hazotte, A A; Sergent, A-S; Estrade, N; Cloquet, C; Hanna, K; Jorand, F P A

    2015-03-01

    The kinetics of Hg(II) and methyl red (MR) reduction by hydroxycarbonate green rust (GR1) and by hydroxysulfate green rust (GR2) were studied in the presence of naturally occurring organic and inorganic ligands (phosphate, polyacrylic acid, bacterial cells, silicate). The reducing ability of biogenic hydroxycarbonate green rust (GR1bio), obtained after microbial reduction of lepidocrocite by Shewanella putrefaciens, was also investigated and compared to those of chemically synthesized GR1 and GR2 (GR1ab and GR2ab). Pseudo first-order rate constants (kobs) of Hg(II) reduction (at pH 7.0, 8.2, and 9.5) and MR reduction (at pH 7.0) were determined and were normalized to the structural Fe(II) content of GRs (kFeII) and to the estimated concentration of surface Fe(II) sites (kS). The kS values ranged from 0.3 L mmol(-1) min(-1) to 43 L mmol(-1) min(-1) for the Hg reduction, and from 0.007 L mmol(-1) min(-1) to 3.4 L mmol(-1) min(-1) for the MR reduction. No significant discrepancy between GRab and GRbio was observed in term of reactivity. However, the reduction kinetics of MR was generally slower than the Hg(II) reduction kinetics for all tested GRs. While a slight difference in Hg(II) reduction rate was noted whatever the pH values (7.0, 8.2, or 9.5), the reduction of MR was significantly affected in the presence of ligands. A decrease by a factor of 2-200, depending on the type of ligand used, was observed. These data give new insights into the reactivity of GRs in the presence of co-occurring organic and inorganic ligands, and have major implications in the characterization of contaminated systems as well as water treatment processes. PMID:25543237

  7. Environmental risks of chemicals and genetically modified organisms: a comparison. Part II: Sustainability and precaution in risk assessment and risk management.

    PubMed

    Steinhäuser, K G

    2001-01-01

    The principles of precaution and sustainability require more consideration in the assessment of environmental risks posed by chemicals and genetically modified organisms. Instead of applying risk reduction measures when there are serious indications for damage, full scientific certainty is often waited for before taking action. The precautionary principle particularly should be applied in those cases in which the extent and probability of damage are uncertain, e.g. in the case of persistent chemicals which are additionally bioaccumulative or highly mobile. Based on these principles, environmental action targets for risks associated with GMOs and chemicals can be developed. Risk management not only includes statutory measures but also instruments designed to influence behaviour indirectly are important to achieve the goals. Particularly for risks of GMOs which provoke fear, risk communication is important. Some rules to which attention should be paid in communication with the public are presented. PMID:11505907

  8. Feasibility study of sub-10-nm-half-pitch fabrication by chemically amplified resist processes of extreme ultraviolet lithography: II. Stochastic effects

    NASA Astrophysics Data System (ADS)

    Kozawa, Takahiro; Santillan, Julius Joseph; Itani, Toshiro

    2015-03-01

    Line edge roughness (LER) rapidly increases in the sub-10-nm-half-pitch region of resist processes used for the fabrication of semiconductor devices. Sub-10-nm fabrication with high throughput is a challenging task. In this study, the stochastic effects (LER and stochastic defect generation) of chemically amplified resist processes in the sub-10-nm-half-pitch node were investigated, assuming the use of extreme ultraviolet (EUV) lithography. The latent images were calculated by a Monte Carlo method on the basis of the sensitization and reaction mechanisms of chemically amplified EUV resists. 7-nm-half-pitch fabrication by chemically amplified resist processes is considered to be feasible. However, significant improvement in the efficiencies of the conversion processes from optical images to resist images is required.

  9. Chemical modification of class II G protein-coupled receptor ligands: frontiers in the development of peptide analogs as neuroendocrine pharmacological therapies.

    PubMed

    Chapter, Megan C; White, Caitlin M; DeRidder, Angela; Chadwick, Wayne; Martin, Bronwen; Maudsley, Stuart

    2010-01-01

    Recent research and clinical data have begun to demonstrate the huge potential therapeutic importance of ligands that modulate the activity of the secretin-like, Class II, G protein-coupled receptors (GPCRs). Ligands that can modulate the activity of these Class II GPCRs may have important clinical roles in the treatment of a wide variety of conditions such as osteoporosis, diabetes, amyotrophic lateral sclerosis and autism spectrum disorders. While these receptors present important new therapeutic targets, the large glycoprotein nature of their cognate ligands poses many problems with respect to therapeutic peptidergic drug design. These native peptides often exhibit poor bioavailability, metabolic instability, poor receptor selectivity and resultant low potencies in vivo. Recently, increased attention has been paid to the structural modification of these peptides to enhance their therapeutic efficacy. Successful modification strategies have included d-amino acid substitutions, selective truncation, and fatty acid acylation of the peptide. Through these and other processes, these novel peptide ligand analogs can demonstrate enhanced receptor subtype selectivity, directed signal transduction pathway activation, resistance to proteolytic degradation, and improved systemic bioavailability. In the future, it is likely, through additional modification strategies such as addition of circulation-stabilizing transferrin moieties, that the therapeutic pharmacopeia of drugs targeted towards Class II secretin-like receptors may rival that of the Class I rhodopsin-like receptors that currently provide the majority of clinically used GPCR-based therapeutics. Currently, Class II-based drugs include synthesized analogs of vasoactive intestinal peptide for type 2 diabetes or parathyroid hormone for osteoporosis. PMID:19686775

  10. Proceedings of the ninth cellulose conference. II. Symposium on cellulose and wood as future chemical feedstocks and sources of energy, and general papers

    SciTech Connect

    Sarko, A.

    1983-01-01

    The second part of the conference dealt with the utilization of wood and cellulose. The productivity and resource conservation of forests, chemical composition of woods and spent liquors, the chemical reactions of cellulose to improve its utilization (e.g., acid hydrolysis, enyzmatic hydrolysis, saccharification, radiolysis, pyrolysis), a review of liquid ammonia-cellulose technology, wood delignification and combustion, sorptive and mechanical properties of cellulose fibers, microstructure and phase transformations of cellulose were discussed. All 38 papers have been abstracted separately. 824 references, 246 figures, 132 tables.

  11. Chemical analyses of soil samples collected from the vicinity of the thermal test complex at Sandia National Laboratories, New Mexico environs, 2006.

    SciTech Connect

    Miller, Mark Laverne; Nieto, Danielle M.

    2007-01-01

    In the summer of 2006, the Environmental Programs and Assurance Department of Sandia National Laboratories in Albuquerque, New Mexico (SNL/NM), collected surface soil samples at 37 locations within one mile of the vicinity of the newly constructed Thermal Test Complex (TTC) for the purpose of determining baseline conditions against which potential future impacts to the environs from operations at the facility could be assessed. These samples were submitted to an offsite analytical laboratory for metal-in-soil analyses. This work provided the SNL Environmental Programs and Assurance Department with a sound baseline data reference set against which to assess potential future operational impacts at the TTC. In addition, it demonstrates the commitment that the Laboratories have to go beyond mere compliance to achieve excellence in its operations. This data are presented in graphical format with narrative commentaries on particular items of interest.

  12. Analysis of chemical constituents and antinociceptive potential of essential oil of Teucrium Stocksianum bioss collected from the North West of Pakistan

    PubMed Central

    2012-01-01

    Background Medicinal plants are used for the treatment of different diseases in almost all cultures. Teucrium species grow wildly at different geographical locations around the world. Teucrium stocksianum is used in folk medicine for the treatment of diarrhea, cough, jaundice and abdominal pain. Scientific study on Teucrium stocksianum shows that it possesses anthelmintic, cytotoxic and antispasmodic activity. The aim of our present study is to identify the chemical composition and antinociceptive potential of the essential oil extracted from Teucrium stocksianum bioss. Method Essential oil (EO) from the aerial parts of Teucrium stocksianum were extracted by hydrodistillation process. The qualitative and quantitative composition of essential oil was determined with Gas chromatography/Mass spectrometer. Antinociceptive activity was determined by acetic acid induced writhing method. Percent inhibition of writhes of the test concentration was determined by comparing it with that of control. Tween-80 emulsion 2.5% (5 ml/kg b.w) was used as a control while Diclofenic sodium 50 mg/kg (b.w) was used as a standard drug. Results The chromatogram of the essential oil of Teucrium stocksianum shows differences both qualitatively and quantatively from essential oil composition reported in other countries. Hydrodistillation of Teucrium stocksianum yielded 0.4% (v/w), pale yellowish oil on dry basis. A total of 26 chemicals were identified by GC-MS accounting for 90.28% of the oil. The major components of essential oil were δ-cadinene (12.92%), α-pinene (10.3%), myrcene (8.64%), β-caryophyllene (8.23%), germacrene D (5.18%) and limonene (2.36%). Essential oil of Teucrium stocksianum has shown outstanding antinociceptive activity. It has been observed that increase in percent writhe inhibition (PWI) occurred from 20-80 mg/kg (b.w) and maximum writhe inhibition has been noted at a concentration of 80 mg/kg (b.w), but PWI decreased at 160 mg/kg, which may be due to some toxic effect of higher dose. ED50 value for Teucrium stocksianum was calculated as 31.5 ± 1.72415 mg/kg (b.w). Conclusion Our results indicate that there is a lot of variation in the composition of essential oil of Teucrium stocksianum boiss, which may be due to different climatic and experimental conditions. Secondly, the essential oil possesses strong antinociceptive activity and could be used in analgesic preparations especially for topical use. PMID:23217213

  13. A survey of EPA/OPP and open literature on selected pesticide chemicals. II. Mutagenicity and carcinogenicity of selected chloroacetanilides and related compounds.

    PubMed

    Dearfield, K L; McCarroll, N E; Protzel, A; Stack, H F; Jackson, M A; Waters, M D

    1999-07-15

    With this effort, we continue our examination of data on selected pesticide chemicals and their related analogues that have been presented to the U.S. Environmental Protection Agency's (USEPA's) Office of Pesticide Programs (OPP). This report focuses on a group of selected chloroacetanilides and a few related compounds. As part of the registration process for pesticidal chemicals, interested parties (registrants) must submit toxicity information to support the registration including both mutagenicity and carcinogenicity data. Although this information is available to the public via Freedom of Information (FOI) requests to the OPP, publication in the scientific literature allows greater dissemination and examination of the data. For this Special Issue, graphic profiles have been prepared of the mutagenicity and carcinogenicity data available in the submissions to OPP. Also, a discussion is presented about how toxicity data are used to help establish tolerances (limits of pesticide residues in foods). The mutagenicity results submitted by registrants are supplemented by data on these chemicals from the open literature to provide a full perspective of their genetic toxicology. The group of chloroacetanilides reviewed here display a consistent pattern of mutagenic activity, probably mediated via metabolites. This mutagenic activity is a mechanistically plausible factor in the development of tumors seen in experimental animals exposed to this class of chemicals. PMID:10415440

  14. Tiered High-Throughput Screening Approach to Identify Thyroperoxidase Inhibitors within the ToxCast Phase I and II Chemical Libraries

    EPA Science Inventory

    High-throughput screening (HTS) for potential thyroid–disrupting chemicals requires a system of assays to capture multiple molecular-initiating events (MIEs) that converge on perturbed thyroid hormone (TH) homeostasis. Screening for MIEs specific to TH-disrupting pathways is limi...

  15. Biogeochemical Cycles for Combining Chemical Knowledge and ESD Issues in Greek Secondary Schools Part II: Assessing the Impact of the Intervention

    ERIC Educational Resources Information Center

    Koutalidi, Sophia; Psallidas, Vassilis; Scoullos, Michael

    2016-01-01

    In searching for effective ways to combine science/chemical education with EE/ESD, new didactic materials were designed and produced focussing on biogeochemical cycles and their connection to sustainable development. The materials were experimentally applied in 16 Greek schools under the newly introduced compulsory "school project" which

  16. QSAR Classification of ToxCast and Tox21 Chemicals on the Basis of Estrogen Receptor Assays (FutureToxII)

    EPA Science Inventory

    The ToxCast and Tox21 programs have tested ~8,200 chemicals in a broad screening panel of in vitro high-throughput screening (HTS) assays for estrogen receptor (ER) agonist and antagonist activity. The present work uses this large in vitro data set to develop in silico QSAR model...

  17. Biogeochemical Cycles for Combining Chemical Knowledge and ESD Issues in Greek Secondary Schools Part II: Assessing the Impact of the Intervention

    ERIC Educational Resources Information Center

    Koutalidi, Sophia; Psallidas, Vassilis; Scoullos, Michael

    2016-01-01

    In searching for effective ways to combine science/chemical education with EE/ESD, new didactic materials were designed and produced focussing on biogeochemical cycles and their connection to sustainable development. The materials were experimentally applied in 16 Greek schools under the newly introduced compulsory "school project" which…

  18. A Collection of Chemical, Mineralogical, and Stable Isotopic Compositional Data for Green River Oil Shale from Depositional Center Cores in Colorado, Utah, and Wyoming

    USGS Publications Warehouse

    Tuttle, Michele L.W.

    2009-01-01

    For over half a century, the U.S. Geological Survey and collaborators have conducted stratigraphic and geochemical studies on the Eocene Green River Formation, which is known to contain large oil shale resources. Many of the studies were undertaken in the 1970s during the last oil shale boom. One such study analyzed the chemistry, mineralogy, and stable isotopy of the Green River Formation in the three major depositional basins: Piceance basin, Colo.; Uinta basin, Utah; and the Green River basin, Wyo. One depositional-center core from each basin was sampled and analyzed for major, minor, and trace chemistry; mineral composition and sulfide-mineral morphology; sulfur, nitrogen, and carbon forms; and stable isotopic composition (delta34S, delta15N, delta13C, and delta18O). Many of these data were published and used to support interpretative papers (see references herein). Some bulk-chemical and carbonate-isotopic data were never published and may be useful to studies that are currently exploring topics such as future oil shale development and the climate, geography, and weathering in the Eocene Epoch. These unpublished data, together with most of the U.S. Geological Survey data already published on these samples, are tabulated in this report.

  19. Trace metals in PM10 and PM 2.5 samples collected in a highly industrialized chemical/petrochemical area and its urbanized surroundings.

    PubMed

    dos Anjos Paulino, Silvia; Oliveira, Rafael Lopes; Loyola, Josiane; Minho, Alan Silva; Arbilla, Graciela; Quiterio, Simone Lorena; Escaleira, Viviane

    2014-05-01

    The aim of this study was to determine the potential impact of a highly industrialized area on its urbanized surroundings. The area studied is home to a refinery, a thermoelectric plant and several petrochemical facilities industries. The concentrations of twelve elements were determined in PM10 and PM2.5 samples collected along a busy highway and near the petrochemical complex. Significantly higher concentrations of Ca, Mg, Mn, Fe, Cu and Al were observed in the petrochemical zone, but principal component analysis revealed similar patterns for both the highway site and a site approximately 1.5 km from the petrochemical complex, suggesting that the main pollution source in the area is vehicular flux. Higher concentrations in the industrial area may be attributed to intense diesel-powered truck and bus traffic movement, mainly due to the transport of supplies, fuel and gas. The observed concentrations of the elements Cr, Co, Ni, Cd and Pb were always lower than the detection limits of the technique used. PMID:24509656

  20. Chemical composition, sources, and deposition fluxes of water-soluble inorganic ions obtained from precipitation chemistry measurements collected at an urban site in northwest China.

    PubMed

    Shen, Zhenxing; Zhang, Leiming; Cao, Junji; Tian, Jing; Liu, Li; Wang, Geihui; Zhao, Zhuzi; Wang, Xin; Zhang, Renjian; Liu, Suixin

    2012-11-01

    Precipitation samples were collected at an urban site in Xi'an, northwest China during March to November in 2009 and were then analyzed to determine the pH and concentrations of water-soluble inorganic ions (Na(+), NH(4)(+), K(+), Mg(2+), Ca(2+), SO(4)(2-), NO(3)(-), Cl(-), and F(-)) in precipitation. The pH of precipitation ranged from 4.1 to 7.6 for all of the samples with an annual volume-weighted mean of 6.4. While a large portion of the precipitation events were weakly acidic or alkaline, around 30% of the precipitation events in the autumn were strongly acidic. Precipitation events with air masses from the northeast and the southeast were weakly acidic while those with air masses from the northwest and the southwest were alkaline. SO(4)(2-), Ca(2+), NH(4)(+), and NO(3)(-) were dominant ions in the precipitation, accounting for 37%, 25%, 18%, and 9%, respectively, of the total analyzed ions. Ca(2+) and NH(4)(+) were found to be the major neutralizers of precipitation acidity; however, the contribution of Mg(2+), although much lower than those of Ca(2+) and NH(4)(+), was important, in many cases, in changing the precipitation from weakly acidic to weakly alkaline. Enrichment factor analysis confirmed that SO(4)(2-) and NO(3)(-) were produced from anthropogenic sources, Ca(2+), K(+), and 80% Mg(2+) were from crustal sources, and Na(+), Cl(-), and ∼20% of Mg(2+) were from marine sources. The annual wet depositions were estimated to be 3.5 t km(-2) per year for sulfur; 2.3 t km(-2) per year for nitrogen, of which 0.8 t km(-2) per year was oxidized nitrogen and 1.5 t km(-2) per year was reduced nitrogen; and 3.0 t km(-2) per year for Ca(2+). PMID:23023835

  1. Rapid, Non-Mechanical, Damage Free Figuring Of Optical Surfaces Using Plasma Assisted Chemical Etching (PACE): Part Ii Theory & Process Control

    NASA Astrophysics Data System (ADS)

    Zarowin, C. B.; Bollinger, L. D.

    1989-01-01

    We describe an application of Plasma Assisted Chemical Etching (PACE) to rapid and controllable figuring and smoothing of optical surfaces without mechanical contact. This removes the usual constraints on the design of optical elements imposed by mechanical pro-cesses, such as substrate deformation, edge distortion and subsurface damage or contamination. This process employs a process originally developed to pattern microelectronic circuits by ion enhanced chemical etching of a solid (Si02, Si, Al, Au, etc.) through a relatively nonerodeable photolithographically patterned mask1,-2. The PACE process shapes the optical surface by removing material in a small area under a confined reactive gas plasma (a "puck") moved over this surface. Rates of removal of such processes in microelectronic applications are as high as 10 pm per minute and are very accurately controllable and repeatable. The removal "footprint" of PACE may be varied during the process and it inherently smooths or polishes while exposing a virgin surface free of process generated contamination and subsurface damage. It can operate in two modes: (1) in "contact" with the plasma, where the chemical reaction is driven by the kinetic energy given up at the reacting surface by short lived species such as ions; and (2) downstream of the plasma, by the stored energy freed at the surface by longer lived species such as excited metastable neutrals. Since control of this process is so important to this application, we sketch the generic physics and chemi hi stry1,2 of the PACE figuring and smoothing process, identifying the quantitative relations between the plasma and chemical parameters that control it:rf power density reactive gas pressure reactive gas flow the reactor surface temperatures and the pertinent transport chemistry.

  2. Application of a high surface area solid-phase microextraction air sampling device: collection and analysis of chemical warfare agent surrogate and degradation compounds.

    PubMed

    Stevens, Michael E; Tipple, Christopher A; Smith, Philip A; Cho, David S; Mustacich, Robert V; Eckenrode, Brian A

    2013-09-17

    This work examines a recently improved, dynamic air sampling technique, high surface area solid-phase microextraction (HSA-SPME), developed for time-critical, high-volume sampling and analysis scenarios. The previously reported HSA-SPME sampling device, which provides 10-fold greater surface area compared to commercially available SPME fibers, allowed for an increased analyte uptake per unit time relative to exhaustive sampling through a standard sorbent tube. This sampling device has been improved with the addition of a type-K thermocouple and a custom heater control circuit for direct heating, providing precise (relative standard deviation ∼1%) temperature control of the desorption process for trapped analytes. Power requirements for the HSA-SPME desorption process were 30-fold lower than those for conventional sorbent-bed-based desorption devices, an important quality for a device that could be used for field analysis. Comparisons of the HSA-SPME device when using fixed sampling times for the chemical warfare agent (CWA) surrogate compound, diisopropyl methylphosphonate (DIMP), demonstrated that the HSA-SPME device yielded a greater chromatographic response (up to 50%) relative to a sorbent-bed method. Another HSA-SPME air sampling approach, in which two devices are joined in tandem, was also evaluated for very rapid, low-level, and representative analysis when using discrete sampling times for the compounds of interest. The results indicated that subparts per billion by volume concentration levels of DIMP were detectable with short sampling times (∼15 s). Finally, the tandem HSA-SPME device was employed for the headspace sampling of a CWA degradation compound, 2-(diisopropylaminoethyl) ethyl sulfide, present on cloth material, which demonstrated the capability to detect trace amounts of a CWA degradation product that is estimated to be less volatile than sarin. The rapid and highly sensitive detection features of this device may be beneficial in decision making for law enforcement, military, and civilian emergency organizations and responders, providing critical information in a contaminated environment scenario when time is of the essence. PMID:23902152

  3. CHEMICAL ABUNDANCES OF THE MILKY WAY THICK DISK AND STELLAR HALO. II. SODIUM, IRON-PEAK, AND NEUTRON-CAPTURE ELEMENTS

    SciTech Connect

    Ishigaki, M. N.; Aoki, W.; Chiba, M. E-mail: aoki.wako@nao.ac.jp

    2013-07-01

    We present chemical abundance analyses of sodium, iron-peak, and neutron-capture elements for 97 kinematically selected thick disk, inner halo, and outer halo stars with metallicities -3.3 < [Fe/H] <-0.5. The main aim of this study is to examine chemical similarities and differences among metal-poor stars belonging to these old Galactic components as a clue to determine their early chemodynamical evolution. In our previous paper, we obtained abundances of {alpha} elements by performing a one-dimensional LTE abundance analysis based on the high-resolution (R {approx} 50, 000) spectra obtained with the Subaru/HDS. In this paper, a similar analysis is performed to determine abundances of an additional 17 elements. We show that, in metallicities below [Fe/H] {approx}-2, the abundance ratios of many elements in the thick disk, inner halo, and outer halo subsamples are largely similar. In contrast, in higher metallicities ([Fe/H] {approx}> -1.5), differences in some of the abundance ratios among the three subsamples are identified. Specifically, the [Na/Fe], [Ni/Fe], [Cu/Fe], and [Zn/Fe] ratios in the inner and outer halo subsamples are found to be lower than those in the thick disk subsample. A modest abundance difference between the two halo subsamples in this metallicity range is also seen for the [Na/Fe] and [Zn/Fe] ratios. In contrast to that observed for [Mg/Fe] in our previous paper, [Eu/Fe] ratios are more enhanced in the two halo subsamples rather than in the thick disk subsample. The observed distinct chemical abundances of some elements between the thick disk and inner/outer halo subsamples with [Fe/H] >-1.5 support the hypothesis that these components formed through different mechanisms. In particular, our results favor the scenario that the inner and outer halo components formed through an assembly of multiple progenitor systems that experienced various degrees of chemical enrichments, while the thick disk formed through rapid star formation with an efficient mixing of chemical elements. The lower [Na/Fe] and [Zn/Fe] observed in stars with the outer halo kinematics may further suggest that progenitors with longer star formation timescales contributed to the buildup of the relatively metal-rich part of stellar halos.

  4. The chemical biology of Cu(II) complexes with imidazole or thiazole containing ligands: Synthesis, crystal structures and comparative biological activity.

    PubMed

    Lewis, Adam; McDonald, Molly; Scharbach, Stephanie; Hamaway, Stefan; Plooster, Melissa; Peters, Kyle; Fox, Kristin M; Cassimeris, Lynne; Tanski, Joseph M; Tyler, Laurie A

    2016-04-01

    The synthesis and characterization of two copper(II) complexes containing 2-(2-pyridyl)benzimidazole (PyBIm) are reported with the biological activity of these two complexes and a third Cu(II) complex containing 2-(2-pyridyl)benzothiazole (PyBTh). Complex 1, [Cu(PyBIm)(NO3)(H2O)](NO3), is a four coordinate, distorted square planar species with one ligand (N,N), nitrate and water bound to Cu(II). The [Cu(PyBIm)3](BF4)2 complex (2) has distorted octahedral geometry with a 3:1 Py(BIm) ligand to metal ratio. The distorted trigonal bi-pyramidal geometry of compound 3, [Cu(PyBTh)2(H2O)](BF4)2, is comprised of two PyBTh ligands and one water. Biological activity of 1-3 has been assessed by analyzing DNA interaction, nuclease ability, cytotoxic activity and antibacterial properties. Complex 3 exhibits potent concentration dependent SC-DNA cleavage forming single- and double-nicked DNA in contrast to the weak activity of complexes 1 and 2. Mechanistic studies indicate that all complexes utilize an oxidative mechanism however 1 and 2 employ O2(-) as the principal reactive oxygen species while the highly active 3 utilizes (1)O2. The interaction between 1-3 and DNA was investigated using fluorescence emission spectroscopy and revealed all complexes strongly intercalate DNA with Kapp values of 2.65×10(6), 1.85×10(6) and 2.72×10(6)M(-1), respectively. Cytotoxic effects of 1-3 were examined using HeLa and K562 cells and show cell death in the micromolar range with the activity of 1≈2 and were slightly higher than 3. Similar reactivity was observed in the antibacterial studies with E. coli and S. aureus. A detailed comparative analysis of the three complexes is presented. PMID:26828284

  5. Possible Bose-condensate behavior in a quantum phase originating in a collective excitation in the chemically and optically doped Mott-Hubbard system UO2+x

    NASA Astrophysics Data System (ADS)

    Conradson, Steven D.; Durakiewicz, Tomasz; Espinosa-Faller, Francisco J.; An, Yong Q.; Andersson, David A.; Bishop, Alan R.; Boland, Kevin S.; Bradley, Joseph A.; Byler, Darrin D.; Clark, David L.; Conradson, Dylan R.; Conradson, Leilani L.; Costello, Alison L.; Hess, Nancy J.; Lander, Gerard H.; Llobet, Anna; Martucci, Mary B.; Mustre de Leon, Jose; Nordlund, Dennis; Lezama-Pacheco, Juan S.; Proffen, Thomas E.; Rodriguez, George; Schwarz, Daniel E.; Seidler, Gerald T.; Taylor, Antoinette J.; Trugman, Stuart A.; Tyson, Trevor A.; Valdez, James A.

    2013-09-01

    X-ray pair distribution function (pdf) and U L3 extended x-ray absorption fine structure (EXAFS) and neutron pdf measurements that give identical results for UO2 show U(VI)-oxo moieties with x rays for mixed valence U4O9 and U3O7, in contrast to the neutron data that indicate only U(V) sites with no short U-O bonds as well as other differences. In addition, although the EXAFS spectra of UO2 are essentially identical at 30, 100, and 200 K, those of the UO2+x compounds exhibit different nearest-neighbor U-O distributions at each temperature. Further tunneling polaron-type behavior is found in the broadening of the features of the O K-edge x-ray absorption spectra (XAS) of the UO2+x compounds. Raman spectra of powders also show a large increase in scattering cross section with increasing O content that would originate in a change in the electronic structure that increases the overall polarizability. The XAS and Raman also show that U4O9 does not behave as a linear combination of the UO2 and U3O7 fluorite endpoints. The properties induced by mobile rather than static charged quasiparticles were explored by optical pumping of the metal-to-metal charge-transfer transition. The temperature dependence of 4.71 eV pump-1.57 eV probe reflectivity on UO2 that initially populates the U 6d-dominated portion of the upper Hubbard band (UHB) shows a sharp 28-μsec lifetime peak at 25 K that may be associated with the fluctuations of its antiferromagnetic transition. Pumping at 3.14 eV into the 5f-dominated portion of the UHB shows an analogous 2.8-μsec peak but also a plateau bracketing this peak that ends in a cusp at 50-60 K and an abrupt change in the hardening rate of a novel 12-15 GHz phonon that is the signature for the quasiparticle quantum phase. The different results for the different excitation channels indicate a highly specific nonthermal relaxation mechanism. These results constitute the first observation of a distinct phase of photoinduced quasiparticles that is sufficiently coupled to the lattice to undergo a gap-opening transition. When the intragap state is probed with a terahertz time domain spectroscopy (TTDS) measurement 33 psec after a 3.14 excitation pulse, it shows increased absorption in the 0.5-1.1 THz range with a decrease in temperature from ˜30 to 10 K instead of the expected decrease, a result consistent with the presence of a condensate. These results are too extreme to originate in the dynamical, nonadiabatic, coupled charge-transfer-phonon/tunneling polaron scenario previously used for doped Mott-Hubbard insulators with intermediate electron-phonon coupling and therefore indicate novel physics. One possibility that could cause all of these behaviors is that a collective, dynamical, charge transfer-coupled Peierls distortion involving the 2 U(V) ↔ U(IV)+U(VI)-oxo excitation occurs coherently over an entire domain to cause the atoms in this domain to condense into a system with Bose-Einstein or Bose-Einstein-Hubbard properties.

  6. Collection Development.

    ERIC Educational Resources Information Center

    School Libraries in Canada, 2002

    2002-01-01

    Includes 21 articles that discuss collection development in Canadian school libraries. Topics include digital collections in school library media centers; print and electronic library resources; library collections; collaborative projects; print-disabled students; informing administrators of the importance of collection development; censorship;…

  7. Assessment of CREAMS (Chemicals, Runoff, and Erosion from Agricultural Management Systems) and ERHYM-II (Ekalaka Rangeland Hydrology and Yield Model) computer models for simulating soil water movement on the Idaho National Engineering Laboratory

    SciTech Connect

    Laundre, J.W. . Dept. of Biological Sciences)

    1990-05-01

    The major goal of radioactive waste management is long-term containment of radioactive waste. Long-term containment is dependent on understanding water movement on, into, and through trench caps. Several computer simulation models are available for predicting water movement. Of the several computer models available, CREAMS (Chemicals, Runoff, and Erosion from Agricultural Management Systems) and ERHYM-II (Ekalaka Rangeland Hydrology and Yield Model) were tested for use on the Idaho National Engineering Laboratory (INEL). The models were calibrated, tested for sensitivity, and used to evaluate some basic trench cap designs. Each model was used to postdict soil moisture, evapotranspiration, and runoff of two watersheds for which such data were already available. Sensitivity of the models was tested by adjusting various input parameters from high to low values and then comparing model outputs to those generated from average values. Ten input parameters of the CREAMS model were tested for sensitivity. 17 refs., 23 figs., 20 tabs.

  8. Common effect of chemical and external pressures on the magnetic properties of R CoPO (R =La ,Pr ,Nd ,Sm ). II.

    NASA Astrophysics Data System (ADS)

    Prando, G.; Profeta, G.; Continenza, A.; Khasanov, R.; Pal, A.; Awana, V. P. S.; Büchner, B.; Sanna, S.

    2015-10-01

    We investigate the direct correspondence between Co band ferromagnetism and structural parameters in the pnictide oxides R CoPO for different rare-earth ions (R =La ,Pr ,Nd ,Sm ) by means of muon-spin spectroscopy and ab initio calculations, complementing our results published previously [G. Prando et al., Common effect of chemical and external pressures on the magnetic properties of R CoPO (R =La ,Pr ), Phys. Rev. B 87, 064401 (2013), 10.1103/PhysRevB.87.064401]. We find that both the transition temperature to the ferromagnetic phase TC and the volume of the crystallographic unit cell V are conveniently tuned by the R ionic radius and/or external pressure. We report a linear correlation between TC and V and our ab initio calculations unambiguously demonstrate a full equivalence of chemical and external pressures. As such, we show that R ions influence the ferromagnetic phase only via the induced structural shrinkage without involving any active role from the electronic f degrees of freedom, which are only giving a sizable magnetic contribution at much lower temperatures.

  9. Theoretical study of fabrication of line-and-space patterns with 7 nm quarter-pitch using electron beam lithography with chemically amplified resist processes: II. Stochastic effects

    NASA Astrophysics Data System (ADS)

    Kozawa, Takahiro

    2015-09-01

    Electron beam (EB) lithography is a core technology for nanofabrication. Owing to the increasing demand for high-resolution semiconductor lithography, the requirements for the resist processes of EB lithography for the photomasks used in ArF immersion and extreme ultraviolet lithographies and the mold fabrication of nanoimprints have also become stricter. In this study, the feasibility of single nano patterning by EB lithography with a chemically amplified resist process was investigated from the viewpoint of stochastic effects. The latent images of line-and-space patterns with a 7 nm quarter-pitch (7 nm space width and 21 nm line width) were calculated using a Monte Carlo method on the basis of the sensitization and reaction mechanisms of chemically amplified EB resists. Compared with the line-and-space pattern with a 7 nm half-pitch, line edge roughness (LER) and the stochastic pinching generation are considered to be significantly improved by increasing the pitch. It was found that the suppression of the stochastic generation of bridges is the critical issue in 7 nm quarter-pitch fabrication.

  10. Oxygen Consumption by Red Wines. Part II: Differential Effects on Color and Chemical Composition Caused by Oxygen Taken in Different Sulfur Dioxide-Related Oxidation Contexts.

    PubMed

    Carrascon, Vanesa; Fernandez-Zurbano, Purificación; Bueno, Mónica; Ferreira, Vicente

    2015-12-30

    Chemical changes caused by oxidation of red wines during 5 consecutive air-saturation cycles have been assessed. In order to investigate the existing relationship between the effects caused by O2 and the levels and consumption rates of wine SO2, the total oxygen consumed by the wines (16-25 mg/L) was subdivided into different nonmutually exclusive categories. The ones found most influential on chemical changes were the O2 consumed in the first saturation without equivalent SO2 consumption (O2preSO2) and the O2 consumed when levels of free SO2 were below 5 mg/L (radical forming O2). Chromatic changes were strongly related to both O2 categories, even though anthocyanidin degradation was not related to any O2 category. Radical forming O2 prevented both formation of red pigments and reduction of epigallocatechin and other proanthocyanidins, induced accumulation of phenolic acids, and caused losses of β-damascenone and whiskylactone without evidence of acetaldehyde formation. O2preSO2 seemed to play a key role in the formation of blue pigments and in the decrease of Folin index and of many important aroma compounds. PMID:26646423

  11. Computer Program for Calculation of Complex Chemical Equilibrium Compositions and Applications II. Users Manual and Program Description. 2; Users Manual and Program Description

    NASA Technical Reports Server (NTRS)

    McBride, Bonnie J.; Gordon, Sanford

    1996-01-01

    This users manual is the second part of a two-part report describing the NASA Lewis CEA (Chemical Equilibrium with Applications) program. The program obtains chemical equilibrium compositions of complex mixtures with applications to several types of problems. The topics presented in this manual are: (1) details for preparing input data sets; (2) a description of output tables for various types of problems; (3) the overall modular organization of the program with information on how to make modifications; (4) a description of the function of each subroutine; (5) error messages and their significance; and (6) a number of examples that illustrate various types of problems handled by CEA and that cover many of the options available in both input and output. Seven appendixes give information on the thermodynamic and thermal transport data used in CEA; some information on common variables used in or generated by the equilibrium module; and output tables for 14 example problems. The CEA program was written in ANSI standard FORTRAN 77. CEA should work on any system with sufficient storage. There are about 6300 lines in the source code, which uses about 225 kilobytes of memory. The compiled program takes about 975 kilobytes.

  12. Interactions of Zn(II) Ions with Humic Acids Isolated from Various Type of Soils. Effect of pH, Zn Concentrations and Humic Acids Chemical Properties

    PubMed Central

    Boguta, Patrycja; Sokołowska, Zofia

    2016-01-01

    The main aim of this study was the analysis of the interaction between humic acids (HAs) from different soils and Zn(II) ions at wide concentration ranges and at two different pHs, 5 and 7, by using fluorescence and FTIR spectroscopy, as well as potentiometric measurements. The presence of a few areas of HAs structures responsible for Zn(II) complexing was revealed. Complexation at α-sites (low humified structures of low-molecular weight and aromatic polycondensation) and β-sites (weakly humified structures) was stronger at pH 7 than 5. This trend was not observed for γ-sites (structures with linearly-condensed aromatic rings, unsaturated bonds and large molecular weight). The amount of metal complexed at pH5 and 7 by α and γ-structures increased with a decrease in humification and aromaticity of HAs, contrary to β-areas where complexation increased with increasing content of carboxylic groups. The stability of complexes was higher at pH 7 and was the highest for γ-structures. At pH 5, stability decreased with C/N increase for α-areas and -COOH content increase for β-sites; stability increased with humification decrease for γ-structures. The stability of complexes at α and β-areas at pH 7 decreased with a drop in HAs humification. FTIR spectra at pH 5 revealed that the most-humified HAs tended to cause bidentate bridging coordination, while in the case of the least-humified HAs, Zn caused bidentate bridging coordination at low Zn additions and bidentate chelation at the highest Zn concentrations. Low Zn doses at pH 7 caused formation of unidentate complexes while higher Zn doses caused bidentate bridging. Such processes were noticed for HAs characterized by high oxidation degree and high oxygen functional group content; where these were low, HAs displayed bidentate bridging or even bidentate chelation. To summarize, the above studies have showed significant impact of Zn concentration, pH and some properties of HAs on complexation reactions of humic acids with zinc. PMID:27077915

  13. Parallel processing of chemical information in a local area network--II. A parallel cross-validation procedure for artificial neural networks.

    PubMed

    Derks, E P; Beckers, M L; Melssen, W J; Buydens, L M

    1996-08-01

    This paper describes a parallel cross-validation (PCV) procedure, for testing the predictive ability of multi-layer feed-forward (MLF) neural networks models, trained by the generalized delta learning rule. The PCV program has been parallelized to operate in a local area computer network. Development and execution of the parallel application was aided by the HYDRA programming environment, which is extensively described in Part I of this paper. A brief theoretical introduction on MLF networks is given and the problems, associated with the validation of predictive abilities, will be discussed. Furthermore, this paper comprises a general outline of the PCV program. Finally, the parallel PCV application is used to validate the predictive ability of an MLF network modeling a chemical non-linear function approximation problem which is described extensively in the literature. PMID:8799999

  14. Herschel Observations of Extraordinary Sources: Analysi sof the HIFI 1.2 THz Wide Spectral Survey toward Orion KL II. Chemical Implications

    NASA Astrophysics Data System (ADS)

    Crockett, N. R.; Bergin, E. A.; Neill, J. L.; Favre, C.; Blake, G. A.; Herbst, E.; Anderson, D. E.; Hassel, G. E.

    2015-06-01

    We present chemical implications arising from spectral models fit to the Herschel/HIFI spectral survey toward the Orion Kleinmann-Low nebula (Orion KL). We focus our discussion on the eight complex organics detected within the HIFI survey utilizing a novel technique to identify those molecules emitting in the hottest gas. In particular, we find the complex nitrogen bearing species CH3CN, C2H3CN, C2H5CN, and NH2CHO systematically trace hotter gas than the oxygen bearing organics CH3OH, C2H5OH, CH3OCH3, and CH3OCHO, which do not contain nitrogen. If these complex species form predominantly on grain surfaces, this may indicate N-bearing organics are more difficult to remove from grain surfaces than O-bearing species. Another possibility is that hot (Tkin ∼ 300 K) gas phase chemistry naturally produces higher complex cyanide abundances while suppressing the formation of O-bearing complex organics. We compare our derived rotation temperatures and molecular abundances to chemical models, which include gas-phase and grain surface pathways. Abundances for a majority of the detected complex organics can be reproduced over timescales ≳105 years, with several species being underpredicted by less than 3σ. Derived rotation temperatures for most organics, furthermore, agree reasonably well with the predicted temperatures at peak abundance. We also find that sulfur bearing molecules that also contain oxygen (i.e., SO, SO2, and OCS) tend to probe the hottest gas toward Orion KL, indicating the formation pathways for these species are most efficient at high temperatures. Herschel is an ESA space observatory with science instruments provided by European-led Principal Investigator consortia and with important participation from NASA.

  15. Collecting apparatus

    DOEpatents

    Duncan, Charles P.

    1983-01-01

    An improved collecting apparatus for small aquatic or airborne organisms such as plankton, larval fish, insects, etc. The improvement constitutes an apertured removal container within which is retained a collecting bag, and which is secured at the apex of a conical collecting net. Such collectors are towed behind a vessel or vehicle with the open end of the conical net facing forward for trapping the aquatic or airborne organisms within the collecting bag, while allowing the water or air to pass through the apertures in the container. The container is readily removable from the collecting net whereby the collecting bag can be quickly removed and replaced for further sample collection. The collecting bag is provided with means for preventing the bag from being pulled into the container by the water or air flowing therethrough.

  16. Chemical evolution of the Galactic bulge as traced by microlensed dwarf and subgiant stars. II. Ages, metallicities, detailed elemental abundances, and connections to the Galactic thick disc

    NASA Astrophysics Data System (ADS)

    Bensby, T.; Feltzing, S.; Johnson, J. A.; Gould, A.; Adn, D.; Asplund, M.; Melndez, J.; Gal-Yam, A.; Lucatello, S.; Sana, H.; Sumi, T.; Miyake, N.; Suzuki, D.; Han, C.; Bond, I.; Udalski, A.

    2010-03-01

    Context. The Bulge is the least understood major stellar population of the Milky Way. Most of what we know about the formation and evolution of the Bulge comes from bright giant stars. The underlying assumption that giants represent all the stars, and accurately trace the chemical evolution of a stellar population, is under debate. In particular, recent observations of a few microlensed dwarf stars give a very different picture of the evolution of the Bulge from that given by the giant stars. Aims: We aim to resolve the apparent discrepancy between Bulge metallicity distributions derived from microlensed dwarf stars and giant stars. Additionally, we aim to put observational constraints on the elemental abundance trends and chemical evolution of the Bulge. Methods: We perform a detailed elemental abundance analysis of dwarf stars in the Galactic bulge, based on high-resolution spectra that were obtained while the stars were optically magnified during gravitational microlensing events. The analysis method is the same as for a large sample of F and G dwarf stars in the Solar neighbourhood, enabling a fully differential comparison between the Bulge and the local stellar populations in the Galactic disc. Results: We present detailed elemental abundances and stellar ages for six new dwarf stars in the Galactic bulge. Combining these with previous events, here re-analysed with the same methods, we study a homogeneous sample of 15 stars, which constitute the largest sample to date of microlensed dwarf stars in the Galactic bulge. We find that the stars span the full range of metallicities from [Fe/H] = -0.72 to +0.54, and an average metallicity of < [Fe/H]> = -0.08 0.47, close to the average metallicity based on giant stars in the Bulge. Furthermore, the stars follow well-defined abundance trends, that for [Fe/H]<0 are very similar to those of the local Galactic thick disc. This suggests that the Bulge and the thick disc have had, at least partially, comparable chemical histories. At sub-solar metallicities we find the Bulge dwarf stars to have consistently old ages, while at super-solar metallicities we find a wide range of ages. Using the new age and abundance results from the microlensed dwarf stars we investigate possible formation scenarios for the Bulge. Based on observations made with the European Southern Observatory telescopes, Program IDs 082.B-0453 and 083.B-0265.Table 5 is also available in electronic form at the CDS and full Table 4 is only available in electronic form at the CDS via anonymous ftp to cdsarc.u-strasbg.fr (130.79.128.5) or via http://cdsweb.u-strasbg.fr/cgi-bin/qcat?J/A+A/512/A41

  17. Collections Conservation.

    ERIC Educational Resources Information Center

    DeCandido, Robert

    Collections conservation is an approach to the preservation treatment of books and book-like materials that is conceptualized and organized in terms of large groups of materials. This guide is intended to enable a library to evaluate its current collections conservation activities. The introduction describes collections conservation and gives…

  18. FR-IR spectroscopic studies of polyurethanes—Part II. Ab initio quantum chemical studies of the relative strengths of ``carbonyl'' and ``ether'' hydrogen-bonds in polyurethanes

    NASA Astrophysics Data System (ADS)

    Bandekar, Jagdeesh; Klima, Suzanne

    1992-10-01

    Ab initio quantum chemical computations were carried out on (a) dimethyl ether, (b) N-methyl formamide, (c) dimethyl ether- N-methyl formamide complex, and (d) N-methyl formamide dimer to compute the strengths of hydrogen bonds (H-bonds) between the NH groups and CO and ether COC groups. The basis set used was the 3-21G set of the GAUSSIAN 80 program obtained from QCPE, Bloomington, IN. Variations in the strengths of these two H-bonds with the N . . O distance (where O is either carbonyl or ether group oxygen) were studied and found to be similar in behavior. The strength of the "ether" hydrogen bond is computed to be 10.32 kcal mol -1, which is quite significant compared to the value of 10.11 kcal mol -1 for the more accepted "carbonyl" hydrogen bond. The "ether" hydrogen bond is found to be directional, specific and non-negligible. Work with two more basis sets has indicated that the results so obtained are not dependent on their choice. Possible importance of such a hydrogen bond in polyurethanes, inhalation anesthetics, and depsi-peptides is indicated.

  19. Self assembling monolayers of dialkynyl bridged Pd(II) thiols obtained by thermally induced multilayer desorption: Thermal and chemical stability investigated by SR-XPS

    NASA Astrophysics Data System (ADS)

    Battocchio, C.; Fratoddi, I.; Bondino, F.; Malvestuto, M.; Russo, M. V.; Polzonetti, G.

    2012-02-01

    Self assembling monolayers (SAMs) of organometallic thiols trans-[HS-Pd(PBu3)2-SH], trans-[HS-Pd(PBu3)2(-Ctbnd C-C6H5)] and trans,trans-[HS-Pd(PBu3)2(-Ctbnd C-C6H4-C6H4-Ctbnd C-Pd(PBu3)2-SH] on gold were obtained from the corresponding multilayers through thermally induced desorption. Temperature-dependent synchrotron radiation-induced X-ray photoelectron spectroscopy (SR-XPS) measurements were carried out on the heated multilayers during the annealing process, in order to investigate the thermal and chemical stability of the systems. SAMs of the same organometallic thiols were also obtained by rinsing the thick films with appropriate solvents. SR-XPS was used to ascertain that the molecular and electronic structure of the two series of SAMs are not influenced by the rinsing or thermal desorption process, i.e. both strategies allow for obtaining well ordered monolayers of organometallic thiols.

  20. Multielement chemical and statistical analyses from a uranium hydrogeochemical and stream-sediment survey in and near the Elkhorn Mountains, Jefferson County, Montana; Part II, Stream sediments

    USGS Publications Warehouse

    Suits, V.J.; Wenrich, K.J.

    1982-01-01

    Fifty-two stream-sediment samples, collected from an area south of Helena, Jefferson County, Montana, were sieved into two size fractions (50 ppm for the fine fraction) were encountered in samples from the Warm Springs Creek drainage area, along Prickly Pear Creek near Welmer and Golconda Creeks and along Muskrat Creek. All groups showed a significant correlation at the 99 percent confidence level (r between 0.73 and 0.77) between U and Th. Uranium was found to correlate significantly only with Th (as mentioned above) and with -Ni in the fine fraction of the volcanics group. U correlates significantly with -Al2O3, Ba, organic C, -K2O, -Sr and Y in both size fractions for the Boulder batholith. Correlations between U and each of several elements differ for the fine and coarse fractions of the Boulder batholith group, suggesting that the U distribution in these stream sediments is in large part controlled by grain size. Correlations were found between U and CaO, Cr, Fe203, -Na2O, Sc, -SiO2, TiO2, Yb and Zr in the coarse fraction but not in the fine fraction. U correlates weakly (to the 90% confidence level, crc<.37) with -Co and -Cu in the fine but not the coarse fraction. These results are compared to a previous study in the northern Absaroka mountains. Correlation coefficients between all other elements determined from these samples are also shown in Tables 12 to 15.

  1. Chemical Principles Exemplified

    ERIC Educational Resources Information Center

    Plumb, Robert C.

    1972-01-01

    Collection of two short descriptions of chemical principles seen in life situations: the autocatalytic reaction seen in the bombardier beetle, and molecular potential energy used for quick roasting of beef. Brief reference is also made to methanol lighters. (PS)

  2. [Relation between the chemical structure of substances and their antimicrobial action against atypical strains. II. 6-acycloamido-2-alkylthiobenzothiazoles, quantitative relation to their effectiveness spectrum].

    PubMed

    Machácek, M; Kunes, J; Sidóová, E; Odlerová, Z; Waisser, K

    1989-02-01

    Forty-six 6-acylamido-2-alkylthiobenzothiazoles were tested in vitro for antimicrobial activity towards Mycobacterium avium. The values of logarithms of the minimal inhibitory concentrations (log MIC) are shown in Table 1. The relationships between chemical structure and the activity under study were studied by the Free-Wilson method. The results, contributions of the substituents in positions 2 and 6 and the contribution of the common benzothiazole part (marked C) to the activity (delta log MIC) are shown in Table 2. Regression equation correlating the contributions and fragmental hydrophobic constants (f) belonging to the unbranched alkyl groups bound to the sulphur atom in position 2 (see Table 2) are not statistically significant (equation 8). The initial data for a complex analysis of the structure--antimycobacterial activity relationships with regard to the equipotency of the activity towards the species mentioned below form the values of log MIC and the derived values delta log MIC towards Mycobacterium tuberculosis, M. kansasii (see ref.9) and M. avium (see above). According to it, to each drug, each molecular fragment, the vector of activities A is attributed (equation 1), or the vector of contributions a (equation 7). Complex analysis is based on the idea of comparison (similarity) of the drug under study with an "ideal" drug, which possesses the required profile of activities. The vector uk corresponding to it is given for the above-considered case (of wide spectrum) by relation 5, for the case of selectivity with regard to the 1st activity by relation 4. The fundamental concepts of vector algebra, particularly the scalar product of vectors (A, uk) (relation 3) are used as the criteria of decision.(ABSTRACT TRUNCATED AT 250 WORDS) PMID:2743430

  3. Measurements of atmospheric parameters during Indian Space Research Organization Geosphere Biosphere Program Land Campaign II at a typical location in the Ganga Basin: 2. Chemical properties

    NASA Astrophysics Data System (ADS)

    Tare, Vinod; Tripathi, S. N.; Chinnam, N.; Srivastava, A. K.; Dey, Sagnik; Manar, M.; Kanawade, Vijay P.; Agarwal, A.; Kishore, S.; Lal, R. B.; Sharma, M.

    2006-12-01

    This paper attempts to analyze the chemical compositions of the near surface aerosols at a typical location in the Ganga basin with an emphasis on delineating the source of aerosols in foggy/hazy conditions. Collocated measurements of a number of atmospheric and aerosol parameters along with simultaneous sampling of near surface aerosols of size less than 10 μm (PM10) were made as part of an intense field campaign launched under the Indian Space Research Organization Geosphere Biosphere Program (ISRO-GBP) in December 2004. PM10 and black carbon (BC) mass concentration was found to be significantly higher during the foggy/hazy period. Much of the PM10 mass (˜81%) was due to fine/accumulation mode particles (0.1-0.95 μm). Significant proportions of water soluble ions such as NH4+, K+, Na+, Cl-, NO3- and SO42- were present in the fine mode particles while considerable amounts of Ca2+ and Mg2+ along with NH4+, K+, Na+, Cl-, NO3- and SO42- were found in the coarse mode particles. Also, water soluble ions NH4+ and NO3- were significantly higher; however, Na+, K+, SO42- and Cl- did not show significant difference between foggy/hazy and clear days. In contrast, Ca2+, Mg2+ and acid soluble metals were significantly lower during foggy/hazy days as compared to the clear days. Presence of higher amounts of NH4+, K+, NO3- and SO42- associated with very low values (<5 ppmv) of SO2 despite considerable plausible emissions due to fossil fuel and biomass burning in the region suggests that loading of fine mode aerosols in the region could have been enhanced through reactions of gaseous pollutants on the solid surfaces. These results along with the findings presented in the companion paper indicate that prolonged foggy/hazy conditions in the region may be due to the increased anthropogenic emissions.

  4. Physical and chemical properties of the regional mixed layer of Mexico's Megapolis – Part II: Evaluation of measured and modeled trace gases and particle size distributions

    SciTech Connect

    Ochoa, Carlos; Baumgardner, Darrel; Grutter, M.; Allan, James D.; Fast, Jerome D.; Rappengluck, B.

    2012-10-31

    This study extends the work of Baumgardner et al. (2009) in which measurements of trace gases and particles at a remote, high-altitude mountain site 60 km from Mexico City were analyzed with respect to the origin of air masses. In the current evaluation, the temperature, water vapor, ozone (O3), carbon monoxide (CO), acyl peroxy nitrate (APN) and particle size distributions (PSDs) of the mass concentrations of sulfate, nitrate, ammonium and organic mass (OM) were simulated with the WRF-Chem chemical transport model and compared with the measurements at the mountain site. The model prediction of the diurnal trends of the gases were well correlated with the measurements before the regional boundary layer reached the measurement site but underestimated the concentrations after that time. The differences are caused by an overly rapid growth of the boundary layer by the model with too much dilution. There also appears to be more O3 produced by photochemical production, downwind of the emission sources, than predicted by the model. The measured and modeled PSDs compare very well with respect to their general shape and diameter of the peak concentrations. The spectra are log normally distributed with most of the mass in the accumulation mode and the geometric diameter centered at 200 ±20 nm, with little observed or predicted change with respect to the origin of the air mass or the time when the RBL is above the Altzomoni research. Only the total mass changed with time and air mass origin. The invariability of the average diameter of the accumulation mode suggests that there is very little growth of the particles by condensation or coagulation after six hours of aging downwind of the major sources of anthropogenic emissions in Mexico’s Megapolis.

  5. Collection Mapping and Collection Development.

    ERIC Educational Resources Information Center

    Murray, William; And Others

    1985-01-01

    Describes the use of collection mapping to assess media collections of Aurora, Colorado, Public Schools. Case studies of elementary, middle, and high school media centers describe materials selection and weeding and identify philosophies that library collections should support school curriculum, and teacher-library media specialist cooperation in…

  6. An overview of Southeast Florida Outfall Experiment II

    SciTech Connect

    Fergen, R.E.; Bloetscher, F.

    1999-07-01

    The Southeast Florida Ocean Outfall Experiment II (SEFLOE II, 1991--1994) project is the result of a cooperative effort of several government agencies and the Hazen and Sawyer, P.C. The project was designed to satisfy biomonitoring concerns and provide site specific information to allow the USEPA Regional Administrator to evaluate if four open ocean outfalls located off the Southeast Florida coast were contributing to unreasonable degradation of the local marine environment. During the field studies of the project, tremendous efforts were made to collect physical, chemical, and biological data. These data were analyzed to characterize outfall plumes and associated environmental conditions. This overview provides a summary to the SEFLOE II project.

  7. Study of Chemical Surface Structure of Natural Sorbents Used for Removing of Pb2+ Ions from Model Aqueous Solutions (part Ii)

    NASA Astrophysics Data System (ADS)

    Bożęcka, Agnieszka; Bożęcki, Piotr; Sanak-Rydlewska, Stanisława

    2014-03-01

    This article presents the results of the chemical structure research of organic sorbent surface such as walnut shells, plums stones and sunflower hulls with using such methods as infrared spectrometry (FTIR) and elemental analysis. Based on the IR spectra identification of functional groups present on the surface of studied materials has been done as well as determination of their effect on the sorption mechanism of Pb2+ ions from aqueous model solutions W artykule przedstawiono wyniki badań chemicznej struktury powierzchni sorbentów organicznych takich jak: łupiny orzecha włoskiego, pestki śliwek oraz łuski słonecznika z wykorzystaniem metody spektrometrii w podczerwieni (FTIR) oraz analizy elementarnej. W oparciu o uzyskane widma IR dokonano identyfikacji grup funkcyjnych obecnych na powierzchni tych materiałów i określono ich wpływ na mechanizm sorpcji jonów Pb2+ z modelowych roztworów wodnych. Analiza elementarna wykazała, że spośród badanych sorbentów, największą zawartość węgla (49,91%) i wodoru (5,93%) mają pestki śliwek. Najwięcej azotu (1,59%) zawierają łuszczyny słonecznika (tabela 1). Zawartość siarki we wszystkich badanych materiałach jest znikoma, dlatego nie udało się jej oznaczyć tą metodą. Obecność pozostałych pierwiastków może świadczyć o istnieniu zarówno alifatycznych jak i aromatycznych połączeń organicznych. Potwierdzeniem tego są również zarejestrowane widma IR (rysunki 1-3). W oparciu o uzyskane wyniki można przypuszczać także, iż udział procesu wymiany jonowej w sorpcji ołowiu z roztworów wodnych jest znaczący. Świadczą o tym m.in. intensywności pasm na widmach IR dla próbek badanych materiałów po ich kontakcie z roztworami jonów Pb2+ (rysunki 4-6).

  8. A study of new optical materials. I. Crystal-chemical development of new optical frequency converters. II. New hosts for Cr[sup 3+] luminescence and lasing

    SciTech Connect

    Schaffers, K.I.

    1992-01-01

    The emphasis of this work has been on the crystal-chemical development of new optical frequency converters and the synthesis and study of the new hosts for Cr[sup 3+] luminescence and lasing. A simple method has been developed to identify promising frequency-doubling materials containing triangular oxoanions by estimation of nonlinear susceptibilities. Implementation of this method and its results have generated predictive capabilities in determining the relationships among crystal structure, nonlinear properties, and threshold powers. The new noncentrosymmetric borate SrLiB[sub 9]O[sub 15] is discussed. A prescription for new pyroborate frequency converters has been developed. The material CdCl[sub 2]C[sub 3]H[sub 7]NO[sub 2] has been synthesized and structurally characterized. Three new alkaline-earth beryllium borates have been identified. Several materials with potential as hosts for Cr[sup 3+] lasing have been analyzed. The structural study of the laser host LiSrAlF[sub 6] revealed the distortions at the Al site that contribute to the unique optical properties of the Cr[sup 3+]-doped crystals. The family of solid state oxide A[sub 6]MM[prime](BO[sub 3])[sub 6] is one of the largest families of oxide reported to date. Metal site preferences, disorder, solid solubility, and the interrelationship between this structure and the layered structure type of Ba[sub 3]Sc(BO[sub 3])[sub 3] are detailed. An optimal synthetic procedure has been developed for these materials to provide pure, highly crystalline phases. The structural and optical features of (Cr[sup 3+]:) Sr[sub 3]In(BO[sub 3])[sub 3] with A = Sr and M = M[prime] = In have been studied. The material Sr[sub 2]LiInB[sub 4]O[sub 10], was discovered while searching for a suitable lithium borate flux for crystal growth of the compound Sr[sub 3]In(BO[sub 3])[sub 3].

  9. Physical and chemical properties of the regional mixed layer of Mexico's Megapolis Part II: evaluation of measured and modeled trace gases and particle size distributions

    NASA Astrophysics Data System (ADS)

    Ochoa, C.; Baumgardner, D.; Grutter, M.; Allan, J.; Fast, J.; Rappenglueck, B.

    2012-11-01

    This study extends the work of Baumgardner et al. (2009) in which measurements of trace gases and particles, at a remote, high altitude mountain site, 60 km from Mexico City were analyzed with respect to the origin of the air masses. In the current evaluation, the temperature, water vapor mixing ratio (WMR), ozone (O3), carbon monoxide (CO), sulfur dioxide (SO2) and acyl peroxy nitrate (APN) are simulated with the WRF-Chem chemical transport model and compared with the measurements at the mountain site. Comparisons between the model and measurements are also evaluated for particle size distributions (PSDs) of the mass concentrations of sulfate, nitrate, ammonium and organic mass (OM). The model predictions of the diurnal trends in temperature, WMR and trace gases were generally well correlated; 13 of the 18 correlations were significant at a confidence level of <0.01. Less satisfactory were the average hourly differences between model and measurements that showed predicted values within expected, natural variation for only 10 of the 18 comparisons. The model performed best when comparing with the measurements during periods when the air originated from the east. In that case all six of the parameters being compared had average differences between the model and measurements less than the expected standard deviation. For the cases when the air masses are from the southwest or west northwest, only two of the comparisons from each case showed differences less than the expected standard deviation. The differences appear to be a result of an overly rapid growth of the boundary layer predicted by the model and too much dilution. There also is more O3 being produced, most likely by photochemical production, downwind of the emission sources than is predicted by the model. The measured and modeled PSD compare very well with respect to their general shape and the diameter of the peak concentrations. The spectra are log normally distributed with most of the mass in the accumulation mode centered at 200 ± 20 nm and little observed or predicted changes with respect to the time when the RML is above the Altzomoni research station. Only the total mass changes with time and air mass origin. The invariability of average diameter of the accumulation mode suggests that there is very little growth of the particles by condensation or coagulation after six hours of aging downwind of the major sources of anthropogenic emissions in Mexico's Megapolis. This could greatly simplify parameterization in climate models although it is not known at this time if this invariance can be extended to other megacity regions.

  10. Capacitive chemical sensor

    DOEpatents

    Manginell, Ronald P; Moorman, Matthew W; Wheeler, David R

    2014-05-27

    A microfabricated capacitive chemical sensor can be used as an autonomous chemical sensor or as an analyte-sensitive chemical preconcentrator in a larger microanalytical system. The capacitive chemical sensor detects changes in sensing film dielectric properties, such as the dielectric constant, conductivity, or dimensionality. These changes result from the interaction of a target analyte with the sensing film. This capability provides a low-power, self-heating chemical sensor suitable for remote and unattended sensing applications. The capacitive chemical sensor also enables a smart, analyte-sensitive chemical preconcentrator. After sorption of the sample by the sensing film, the film can be rapidly heated to release the sample for further analysis. Therefore, the capacitive chemical sensor can optimize the sample collection time prior to release to enable the rapid and accurate analysis of analytes by a microanalytical system.

  11. Evaluation of the National School Lunch Program Application/Verification Pilot Projects: Volume II: Data Collection, Study Methods and Supplementary Tables on Certification Impacts. Nutrition Assistance Program Report Series. Report No. CN-04-AV2

    ERIC Educational Resources Information Center

    Burghardt, John; Gleason, Philip; Sinclair, Michael; Cohen, Rhoda; Hulsey, Lara; Milliner-Waddell, Julita

    2004-01-01

    This is Volume II of the report on the evaluation of the NSLP Application Verification Pilot Projects. It supplements Volume I, which presents the evaluation findings. Volume II has two objectives: (1) to provide a detailed description of the methods used to conduct the study; and (2) to present tabulations that supplement and extend the analyses…

  12. Ancient graphite in the Eoarchean quartz-pyroxene rocks from Akilia in southern West Greenland II: Isotopic and chemical compositions and comparison with Paleoproterozoic banded iron formations

    NASA Astrophysics Data System (ADS)

    Papineau, Dominic; De Gregorio, Bradley T.; Stroud, Rhonda M.; Steele, Andrew; Pecoits, Ernesto; Konhauser, Kurt; Wang, Jianhua; Fogel, Marilyn L.

    2010-10-01

    We present detailed petrographic surveys of apatite grains in association with carbonaceous material (CM) in two banded iron formations (BIFs) from the Paleoproterozoic of Uruguay and Michigan for comparison with similar mineral associations in the highly debated Akilia Quartz-pyroxene (Qp) rock. Petrographic and Raman spectroscopic surveys of these Paleoproterozoic BIFs show that apatite grains typically occur in bands parallel to bedding and are more often associated with CM when concentrations of organic matter are high. Carbonaceous material in the Vichadero BIF from Uruguay is generally well-crystallized graphite and occurs in concentrations around 0.01 wt% with an average δ 13C gra value of -28.6 ± 4.4‰ (1 σ). In this BIF, only about 5% of apatite grains are associated with graphite. In comparison, CM in the Bijiki BIF from Michigan is also graphitic, but occurs in concentrations around 2.4 wt% with δ 13C gra values around -24.0 ± 0.3‰ (1 σ). In the Bijiki BIF, more than 78% of apatite grains are associated with CM. Given the geologic context and high levels of CM in the Bijiki BIF, the significantly higher proportion of apatite grains associated with CM in this rock is interpreted to represent diagenetically altered biomass and shows that such diagenetic mineral associations can survive metamorphism up to the amphibolite facies. Isotope compositions of CM in muffled acidified whole-rock powders from the Akilia Qp rock have average δ 13C gra values of -17.5 ± 2.5‰ (1 σ), while δ 13C carb values in whole-rock powders average -4.0 ± 1.0‰ (1 σ). Carbon isotope compositions of graphite associated with apatite and other minerals in the Akilia Qp rock were also measured with the NanoSIMS to have similar ranges of δ 13C gra values averaging -13.8 ± 5.6‰ (1 σ). The NanoSIMS was also used to semi-quantitatively map the distributions of H, N, O, P, and S in graphite from the Akilia Qp rock, and relative abundances were found to be similar for graphite associated with apatite or with hornblende, calcite, and sulfides. These analyses revealed generally lower abundances of trace elements in the Akilia graphite compared to graphite associated with apatite from Paleoproterozoic BIFs. Graphite associated with hornblende, calcite, and sulfides in the Akilia Qp rock was fluid-deposited at high-temperature from carbon-bearing fluids, and since this graphite has similar ranges of δ 13C gra values and of trace elements compared to graphite associated with apatite, we conclude that the Akilia graphite in different mineral associations formed from the same source(s) of CM. Collectively our results do not exclude a biogenic origin of the carbon in the Akilia graphite, but because some observations can not exclude graphitization of abiogenic carbon from CO 2- and CH 4-bearing mantle fluids, there remain ambiguities with respect to the exact origin of carbon in this ancient metasedimentary rock. Accordingly, there may have been several generations of graphite formation along with possibly varying mixtures of CO 2- and CH 4-bearing fluids that may have resulted in large ranges of δ 13C gra values. The possibility of fluid-deposited graphite associated with apatite should be a focus of future investigations as this may prove to be an alternative pathway of graphitization from phosphate-bearing fluids. Correlated micro-analytical approaches tested on terrestrial rocks in this work provide insights into the origin of carbon in ancient graphite and will pave the way for the search for life on other ancient planetary surfaces.

  13. A systematic study of the interactions between chemical partners (metal, ligands, counterions, and support) involved in the design of Al2O3-supported nickel catalysts from diamine-Ni(II) chelates.

    PubMed

    Négrier, Fabien; Marceau, Eric; Che, Michel; Giraudon, Jean-Marc; Gengembre, Léon; Löfberg, Axel

    2005-02-24

    1.5 Ni wt %/Al2O3 catalysts have been prepared by incipient wetness impregnation using [Ni(diamine)x(H2O)(6-2x)]Y2 precursors (diamine = 1,2-ethanediamine (en) and trans-1,2-cyclohexanediamine (tc); x = 0, 1, and 2; Y = NO3- and Cl-), to avoid the formation, during calcination, of difficult-to-reduce nickel aluminate. N2 was chosen for thermal treatment to help reveal and take advantage of the reactions occurring between Ni2+, ligands, counterions, and support. In the case of [Ni(en)2(H2O)2]Y2 salts used as precursors, in situ UV-vis and DRIFT spectroscopies show that after treatment at 230 degrees C Ni(II) ions are grafted to alumina via two OAl bonds and that the diamine ligands still remain coordinated to grafted nickel ions but in a monodentate way, bridging the cation with the alumina surface. With Y = Cl-, the chloride counterions desorb as hydrogen chloride, and hydrogen released upon decomposition of the en ligands is able to reduce a fraction of nickel ions into metal as evidenced by XPS. In contrast, with Y = NO3-, compounds such as CO or NO are formed during thermal treatment, indicating that nitrate ions burn the en ligands. After thermal treatment at 500 degrees C, a surface phase containing Ni(II) ions forms, characterized by XPS and UV-vis spectroscopy. Temperature-programmed reduction shows that these ions can be quantitatively reduced to the metallic state at 500 degrees C, in contrast with the aluminate obtained when the preparation is carried out from [Ni(H2O)6]2+, which is reduced only partly at 950 degrees C. On the other hand, a total self-reduction of nickel complexes leading to 2-5-nm metal particles is obtained upon thermal treatment via the hydrogen released by a hydrogen-rich ligand such as tc, whatever the Y counterion. An appropriate choice of the ligand and the counterion allows then to obtain selectively Ni(II) ions or a dispersed reduced nickel phase after treatment in N2, as a result of the reactions occurring between the chemical partners present on alumina. PMID:16851295

  14. Collective Enumeration

    ERIC Educational Resources Information Center

    Bahrami, Bahador; Didino, Daniele; Frith, Chris; Butterworth, Brian; Rees, Geraint

    2013-01-01

    Many joint decisions in everyday life (e.g., Which bar is less crowded?) depend on approximate enumeration, but very little is known about the psychological characteristics of counting together. Here we systematically investigated collective approximate enumeration. Pairs of participants made individual and collective enumeration judgments in a…

  15. Collecting Rocks.

    ERIC Educational Resources Information Center

    Barker, Rachel M.

    One of a series of general interest publications on science topics, the booklet provides those interested in rock collecting with a nontechnical introduction to the subject. Following a section examining the nature and formation of igneous, sedimentary, and metamorphic rocks, the booklet gives suggestions for starting a rock collection and using…

  16. Data Collection

    A view of the various systems that are used for navigation, logging, and data collection during the trip. The USGS returned from a seafloor data mapping mission offshore of the Delmarva Peninsula (Ocean City, MD) on July 25th, 2014. The data collected is foundational to our continued understanding ...

  17. Jay's Collectibles

    ERIC Educational Resources Information Center

    Cappel, James J.; Gillman, Jason R., Jr.

    2011-01-01

    There is growing interest in collectibles of many types, as indicated by the popularity of television programs such as the History Channel's "Pawn Stars" and "American Pickers" and the Public Broadcasting Service's "Antiques Road Show." The availability of online auction sites such as eBay has enabled many people to collect items of interest as a…

  18. OXALATE MASS BALANCE DURING CHEMICAL CLEANING IN TANK 6F

    SciTech Connect

    Poirier, M.; Fink, S.

    2011-07-22

    The Savannah River Remediation (SRR) is preparing Tank 6F for closure. The first step in preparing the tank for closure is mechanical sludge removal. Following mechanical sludge removal, SRS performed chemical cleaning with oxalic acid to remove the sludge heel. Personnel are currently assessing the effectiveness of the chemical cleaning to determine whether the tank is ready for closure. SRR personnel collected liquid samples during chemical cleaning and submitted them to Savannah River National Laboratory (SRNL) for analysis. Following chemical cleaning, they collected a solid sample (also known as 'process sample') and submitted it to SRNL for analysis. The authors analyzed these samples to assess the effectiveness of the chemical cleaning process. Analysis of the anions showed the measured oxalate removed from Tank 6F to be approximately 50% of the amount added in the oxalic acid. To close the oxalate mass balance, the author collected solid samples, leached them with nitric acid, and measured the concentration of cations and anions in the leachate. Some conclusions from this work are: (1) Approximately 65% of the oxalate added as oxalic acid was removed with the decanted liquid. (2) Approximately 1% of the oxalate (added to the tank as oxalic acid) formed precipitates with compounds such as nickel, manganese, sodium, and iron (II), and was dissolved with nitric acid. (3) As much as 30% of the oxalate may have decomposed forming carbon dioxide. The balance does not fully account for all the oxalate added. The offset represents the combined uncertainty in the analyses and sampling.

  19. Collective Enumeration

    PubMed Central

    Bahrami, Bahador; Didino, Daniele; Frith, Chris; Butterworth, Brian; Rees, Geraint

    2012-01-01

    Many joint decisions in everyday life (e.g., Which bar is less crowded?) depend on approximate enumeration, but very little is known about the psychological characteristics of counting together. Here we systematically investigated collective approximate enumeration. Pairs of participants made individual and collective enumeration judgments in a 2-alternative forced-choice task and when in disagreement, they negotiated joint decisions via verbal communication and received feedback about accuracy at the end of each trial. The results showed that two people could collectively count better than either one alone, but not as well as expected by previous models of collective sensory decision making in more basic perceptual domains (e.g., luminance contrast). Moreover, such collective enumeration benefited from prior, noninteractive practice showing that social learning of how to combine shared information about enumeration required substantial individual experience. Finally, the collective context had a positive but transient impact on an individual's enumeration sensitivity. This transient social influence may be explained as a motivational factor arising from the fact that members of a collective must take responsibility for their individual decisions and face the consequences of their judgments. PMID:22889187

  20. Micrometeorite Collecting

    ERIC Educational Resources Information Center

    Toubes, Joe; Hoff, Darrel

    1974-01-01

    Describes how to collect micrometeorites and suggests a number of related activities such as determining the number of meteors entering the atmosphere and determining the composition of the micrometeorites. (BR)

  1. Blood Collection

    NASA Technical Reports Server (NTRS)

    1999-01-01

    The method that is used for the collection, storage and real-time analysis of blood and other bodily fluids has been licensed to DBCD, Inc. by NASA. The result of this patent licensing agreement has been the development of a commercial product that can provide serum or plasma from whole blood volumes of 20 microliters to 4 milliliters. The device has a fibrous filter with a pore size of less than about 3 microns, and is coated with a mixture of mannitol and plasma fraction protein. The coating causes the cellular fraction to be trapped by the small pores, leaving the cellular fraction intact on the fibrous filter while the acellular fraction passes through the filter for collection in unaltered form from the serum sample collection chamber. The method used by this product is useful to NASA for blood analysis on manned space missions.

  2. Synthesis and spectroscopic and structural studies of a new cadmium(II)-citrate aqueous complex. Potential relevance to cadmium(II)-citrate speciation and links to cadmium toxicity.

    PubMed

    Dakanali, M; Kefalas, E T; Raptopoulou, C P; Terzis, A; Mavromoustakos, T; Salifoglou, A

    2003-04-21

    The presence of cadmium in the environment undoubtedly contributes to an increased risk of exposure and ultimate toxic influence on humans. In an effort to comprehend the chemical and biological interactions of Cd(II) with physiological ligands, like citric acid, we explored the requisite aqueous chemistry, which afforded the first aqueous Cd(II)-citrate complex [Cd(C(6)H(6)O(7))(H(2)O)](n)() (1). Compound 1 was characterized by elemental analysis, and spectroscopically by FT-IR and (113)Cd MAS NMR. Compound 1 crystallizes in the orthorhombic space group P2(1)2(1)2(1), with a = 6.166(2) A, b = 10.508(3) A, c = 13.599(5) A, V = 881.2(5) A(3), and Z = 4. The X-ray structure of 1 reveals the presence of octahedral Cd(II) ions bound to citrate ligands in a molecular crystal lattice. Citrate acts as a tridentate binder promoting coordination to one Cd(II) through the central alcoholic moiety, one terminal carboxylate group, and the central carboxylate group. In addition, the central carboxylate binds to three Cd(II) ions. Specifically, one of the oxygens of the central carboxylate serves as a bridge to two neighboring Cd(II) ions, while the other oxygen binds to a third Cd(II). A bound water molecule completes the coordination requirements of Cd(II). (113)Cd MAS NMR studies project the spectroscopic signature of the nature of the coordination environment around Cd(II) in 1, thus corroborating the X-ray findings. Collectively, the data at hand are in line with past solution studies. The latter predict that other similar low molecular mass Cd(II)-citrate complexes may exist in the acidic pH region, thus influencing the uptake of cadmium by living (micro)organisms, their ability to metabolize organic substrates, and possibly Cd(II) toxicity. PMID:12691558

  3. Chemical Emergencies

    MedlinePlus

    Chemical Emergencies Under certain conditions, chemicals which are normally safe can be poisonous or harmful to your health. A major chemical emergency is an accident that releases a hazardous amount ...

  4. Collecting Samples

    Collecting Samples at Embden 3. Embden 3 is a 60-degree V trapezoidal flume in a bured concreate culvert located on the other side of the north-south road east of the large data shelter. The flow is measured and sampled from the V flume underground and periodic QW grab samples are taken form the blu...

  5. Collectible Aesthetics.

    ERIC Educational Resources Information Center

    Burton, David

    1989-01-01

    Shows how the advertisement copy for "collectible art" can be used to develop a definition of art. Suggests that middle and high school students should look at the criteria for art offered in the advertisements. Recommends they analyze the terminology used to convince the lay person that the object is "genuine" art. (LS)

  6. Wastewater Collection.

    ERIC Educational Resources Information Center

    Chatterjee, Samar; And Others

    1978-01-01

    Presents a literature review of wastewater collection systems and components. This review covers: (1) planning, (2) construction; (3) sewer system evaluation; (4) maintenance; (5) rehabilitation; (6) overview prevention; and (7) wastewater pumping. A list of 111 references is also presented. (HM)

  7. Collecting Artifacts

    ERIC Educational Resources Information Center

    Coffey, Natalie

    2004-01-01

    Fresh out of college, the author had only a handful of items worthy of displaying, which included some fossils she had collected in her paleontology class. She had binders filled with great science information, but kids want to see "real" science, not paper science. Then it came to her: she could fill the shelves with science artifacts with the…

  8. The Tox21 robotic platform for assessment of environmental chemicals - from vision to reality

    PubMed Central

    Attene-Ramos, Matias S.; Miller, Nicole; Huang, Ruili; Michael, Sam; Itkin, Misha; Kavlock, Robert J.; Austin, Christopher P.; Shinn, Paul; Simeonov, Anton; Tice, Raymond R.; Xia, Menghang

    2013-01-01

    Since its establishment in 2008, the US Tox21 inter-agency collaboration has made great progress in developing and evaluating cellular models for the evaluation of environmental chemicals as a proof of principle. Currently, the program has entered its production phase (Tox21 Phase II) focusing initially on the areas of modulation of nuclear receptors and stress response pathways. During Tox21 Phase II, the set of chemicals to be tested has been expanded to nearly 10,000 (10K) compounds and a fully automated screening platform has been implemented. The Tox21 robotic system combined with informatics efforts is capable of screening and profiling the collection of 10K environmental chemicals in triplicate in a week. In this article, we describe the Tox21 screening process, compound library preparation, data processing, and robotic system validation. PMID:23732176

  9. The Tox21 robotic platform for the assessment of environmental chemicals--from vision to reality.

    PubMed

    Attene-Ramos, Matias S; Miller, Nicole; Huang, Ruili; Michael, Sam; Itkin, Misha; Kavlock, Robert J; Austin, Christopher P; Shinn, Paul; Simeonov, Anton; Tice, Raymond R; Xia, Menghang

    2013-08-01

    Since its establishment in 2008, the US Tox21 inter-agency collaboration has made great progress in developing and evaluating cellular models for the evaluation of environmental chemicals as a proof of principle. Currently, the program has entered its production phase (Tox21 Phase II) focusing initially on the areas of modulation of nuclear receptors and stress response pathways. During Tox21 Phase II, the set of chemicals to be tested has been expanded to nearly 10,000 (10K) compounds and a fully automated screening platform has been implemented. The Tox21 robotic system combined with informatics efforts is capable of screening and profiling the collection of 10K environmental chemicals in triplicate in a week. In this article, we describe the Tox21 screening process, compound library preparation, data processing, and robotic system validation. PMID:23732176

  10. Physical and chemical characteristics including total and geochemical forms of phosphorus in sediment from the top 30 centimeters of cores collected in October 2006 at 26 sites in Upper Klamath Lake, Oregon

    USGS Publications Warehouse

    Simon, Nancy S.; Ingle, Sarah N.

    2011-01-01

    μThis study of phosphorus (P) cycling in eutrophic Upper Klamath Lake (UKL), Oregon, was conducted by the U.S. Geological Survey in cooperation with the U.S. Bureau of Reclamation. Lakebed sediments from the upper 30 centimeters (cm) of cores collected from 26 sites were characterized. Cores were sampled at 0.5, 1.5, 2.5, 3.5, 4.5, 10, 15, 20, 25, and 30 cm. Prior to freezing, water content and sediment pH were determined. After being freeze-dried, all samples were separated into greater than 63-micron (μm) particle-size (coarse) and less than 63-μm particle-size (fine) fractions. In the surface samples (0.5 to 4.5 cm below the sediment water interface), approximately three-fourths of the particles were larger than 63-μm. The ratios of the coarse particle-size fraction (>63 μm) and the fine particle-size fraction (<63 μm) were approximately equal in samples at depths greater than 10 cm below the sediment water interface. Chemical analyses included both size fractions of freeze-dried samples. Chemical analyses included determination of total concentrations of aluminum (Al), calcium (Ca), carbon (C), iron (Fe), poorly crystalline Fe, nitrogen (N), P, and titanium (Ti). Total Fe concentrations were the largest in sediment from the northern portion of UKL, Howard Bay, and the southern portion of the lake. Concentrations of total Al, Ca, and Ti were largest in sediment from the northern, central, and southernmost portions of the lake and in sediment from Howard Bay. Concentrations of total C and N were largest in sediment from the embayments and in sediment from the northern arm and southern portion of the lake in the general region of Buck Island. Concentrations of total C were larger in the greater than 63-μm particle-size fraction than in the less than 63-μm particle-size fraction. Sediments were sequentially extracted to determine concentrations of inorganic forms of P, including loosely sorbed P, P associated with poorly crystalline Fe oxides, and P associated with mineral phases. The difference between the concentration of total P and sum of the concentrations of inorganic forms of P is referred to as residual P. Residual P was the largest fraction of P in all of the sediment samples. In UKL, the correlation between concentrations of total P and total Fe in sediment is poor (R2<0.1). The correlation between the concentrations of total P and P associated with poorly crystalline Fe oxides is good (R2=0.43) in surface sediment (0.5-4.5 cm below the sediment water interface) but poor (R2<0.1) in sediments at depths between 10 cm and 30 cm. Phosphorus associated with poorly crystalline Fe oxides is considered bioavailable because it is released when sediment conditions change from oxidizing to reducing, which causes dissolution of Fe oxides.

  11. Collective instabilities

    SciTech Connect

    K.Y. Ng

    2003-08-25

    The lecture covers mainly Sections 2.VIII and 3.VII of the book ''Accelerator Physics'' by S.Y. Lee, plus mode-coupling instabilities and chromaticity-driven head-tail instability. Besides giving more detailed derivation of many equations, simple interpretations of many collective instabilities are included with the intention that the phenomena can be understood more easily without going into too much mathematics. The notations of Lee's book as well as the e{sup jwt} convention are followed.

  12. 77 FR 37078 - Proposed Collection; Comment Request

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-06-20

    ... things: (i) Each transaction effected under the rule is reported on Form N-SAR; (ii) the fund's directors... transaction reports on Form N-SAR, which is encompassed in the information collection burden estimate for...

  13. 75 FR 34487 - Notice of Information Collection

    Federal Register 2010, 2011, 2012, 2013, 2014

    2010-06-17

    ... general themes on areas to focus on in order to enhance creativity and innovation at the Center. II. Method of Collection Electronic. III. Data Title: The KEYS Creativity and Innovation Survey. OMB...

  14. Shuttle II

    NASA Technical Reports Server (NTRS)

    Talay, T. A.

    1987-01-01

    This paper presents a status report on the study of a next-generation manned launch system, called Shuttle II, being conducted at the NASA Langley Research Center. Underlying reasons for considering such a system include the need for low-cost, safe, and reliable manned access to space. System and operational characteristics for a Shuttle II vehicle are presented. The need for fully reusable launch systems with radically simpler ground and flight operations is stated to be critical in reducing launch costs. Advancing technologies have a major impact on the choice of vehicle concepts. For a near-term level of technology, a two-stage vertical-takeoff rocket vehicle has been selected for further in-depth Shuttle II studies. The role of the Shuttle II vehicle in a proposed space transportation system, which includes heavy lift and Space Shuttle complementary manned systems, is discussed.

  15. Photosystem II

    ScienceCinema

    James Barber

    2010-09-01

    James Barber, Ernst Chain Professor of Biochemistry at Imperial College, London, gives a BSA Distinguished Lecture titled, "The Structure and Function of Photosystem II: The Water-Splitting Enzyme of Photosynthesis."

  16. Delta II

    NASA Technical Reports Server (NTRS)

    1990-01-01

    The Delta II expendable launch vehicle with the ROSAT (Roentgen Satellite), cooperative space X-ray astronomy mission between NASA, Germany and United Kingdom, was launched from the Cape Canaveral Air Force Station on June 1, 1990.

  17. Stereodynamics of sterically crowded metal-phosphine complexes: trans-[(t-Bu){sub 2}P(l-Pr)]{sub 2}MCl{sub 2} [M = Pt(II) and Pd(II)]. One-dimensional dynamic and two-dimensional chemical exchange NMR studies, X-ray crystallographic studies, molecular conformation trapping, and molecular mechanics calculations

    SciTech Connect

    DiMeglio, C.M.; Ahmed, K.J.; Luck, L.A.; Weltin, E.E.

    1992-10-29

    By using complementary techniques including dynamic NMR (DNMR) spectroscopy, X-ray crystallography, molecular conformation trapping and molecular mechanics calculations, incisive pictures of the stereodynamics of two sterically crowded Pd(II) and Pt(II) complexes have been elucidated. X-ray crystallography shows that the molecular geometry in the only crystalline modification (P2{sub 1}/a space group) of trans-[(t-Bu){sub 2}P(i-Pr)]{sub 2}PdCl{sub 2} (1) has C{sub i} symmetry. The isopropyl groups are mutually anti; the dihedral angle between the two P-CH bonds is 180{degrees}. For the isopropyl group on each phosphine ligand, one methyl group is anti and the other gauche ot the palladium atom. There are significant torsions about Pd-P,P-(i-Pr) and P-(t-Bu) bonds including a dihedral angle between proximate P-CH and Pd-Cl bonds of 21.6{degrees}. On the basis of the hypotheses that (a) when placed in solution, the conformation of each phosphine ligand of 1 will adopt an essentially exclusive preference for that in the crystal and (b) the two phosphines act essentially independently of each other, four stable diastereomeric equilibrium conformations are predicted. In two diastereomeric conformations, the isopropyl groups are mutually syn with dihedral angles between the P-CH bonds of 44{degrees} (C{sub 2} symmetry) and 0{degrees} (C{sub s} symmetry). In the other two diastereomeric forms, the isopropyl groups are mutually anti with dihedral angles between the P-CH bonds of 136{degrees} (C{sub 2} symmetry) and 180{degrees} (C{sub i} symmetry). Two-dimensional {sup 31}P({sup 1}H) NMR chemical exchange spectroscopy in conjunction with theoretical simulations of the one-dimensional {sup 31}P({sup 1}H) and {sup 13}C({sup 1}H)DNMR spectra do reveal the presence of four diastereomeric equilibrium conformations and allow elucidation of the preferred conformational interconversion pathways. 32 refs., 8 figs., 1 tab.

  18. Tortuous path chemical preconcentrator

    DOEpatents

    Manginell, Ronald P.; Lewis, Patrick R.; Adkins, Douglas R.; Wheeler, David R.; Simonson, Robert J.

    2010-09-21

    A non-planar, tortuous path chemical preconcentrator has a high internal surface area having a heatable sorptive coating that can be used to selectively collect and concentrate one or more chemical species of interest from a fluid stream that can be rapidly released as a concentrated plug into an analytical or microanalytical chain for separation and detection. The non-planar chemical preconcentrator comprises a sorptive support structure having a tortuous flow path. The tortuosity provides repeated twists, turns, and bends to the flow, thereby increasing the interfacial contact between sample fluid stream and the sorptive material. The tortuous path also provides more opportunities for desorption and readsorption of volatile species. Further, the thermal efficiency of the tortuous path chemical preconcentrator is comparable or superior to the prior non-planar chemical preconcentrator. Finally, the tortuosity can be varied in different directions to optimize flow rates during the adsorption and desorption phases of operation of the preconcentrator.

  19. Diet History Questionnaire II & Canadian Diet History Questionnaire II: Web-based DHQ

    Cancer.gov

    The Web-based versions of DHQ II and C-DHQ II are identical in content to the paper forms. By automating the DHQ II and providing versions on the Web for public use, researchers have another tool to collect and analyze food frequency questionnaire data.

  20. 78 FR 9429 - Agency Information Collection Activities; Proposed Collection; Comments Requested: Application...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-02-08

    ...: Application for Procurement Quota for Controlled Substances and Ephedrine, Pseudoephedrine, and... Quota for Controlled Substances and Ephedrine, Pseudoephedrine, and Phenylpropanolamine (DEA Form 250... II or the List I chemicals ephedrine, pseudoephedrine, and phenylpropanolamine for purposes...

  1. Chemical Engineering in Education and Industry.

    ERIC Educational Resources Information Center

    Wei, James

    1986-01-01

    Provides an historical overview of the origins, developments, and contributions of chemical engineering. Reviews the roles of the university and industry in the education of chemical engineers. Includes a listing of the major advances of chemical engineering since World War II. (ML)

  2. 22 CFR 226.73 - Collection of amounts due.

    Code of Federal Regulations, 2012 CFR

    2012-04-01

    .... NON-GOVERNMENTAL ORGANIZATIONS After-the-Award Requirements § 226.73 Collection of amounts due. (a... overdue debt in accordance with 4 CFR Chapter II, “Federal Claims Collection Standards.”...

  3. 22 CFR 226.73 - Collection of amounts due.

    Code of Federal Regulations, 2010 CFR

    2010-04-01

    .... NON-GOVERNMENTAL ORGANIZATIONS After-the-Award Requirements § 226.73 Collection of amounts due. (a... overdue debt in accordance with 4 CFR Chapter II, “Federal Claims Collection Standards.”...

  4. 22 CFR 226.73 - Collection of amounts due.

    Code of Federal Regulations, 2014 CFR

    2014-04-01

    .... NON-GOVERNMENTAL ORGANIZATIONS After-the-Award Requirements § 226.73 Collection of amounts due. (a... overdue debt in accordance with 4 CFR Chapter II, “Federal Claims Collection Standards.”...

  5. 22 CFR 226.73 - Collection of amounts due.

    Code of Federal Regulations, 2011 CFR

    2011-04-01

    .... NON-GOVERNMENTAL ORGANIZATIONS After-the-Award Requirements § 226.73 Collection of amounts due. (a... overdue debt in accordance with 4 CFR Chapter II, “Federal Claims Collection Standards.”...

  6. 22 CFR 226.73 - Collection of amounts due.

    Code of Federal Regulations, 2013 CFR

    2013-04-01

    .... NON-GOVERNMENTAL ORGANIZATIONS After-the-Award Requirements § 226.73 Collection of amounts due. (a... overdue debt in accordance with 4 CFR Chapter II, “Federal Claims Collection Standards.”...

  7. Amazonian functional diversity from forest canopy chemical assembly.

    PubMed

    Asner, Gregory P; Martin, Roberta E; Tupayachi, Raul; Anderson, Christopher B; Sinca, Felipe; Carranza-Jiménez, Loreli; Martinez, Paola

    2014-04-15

    Patterns of tropical forest functional diversity express processes of ecological assembly at multiple geographic scales and aid in predicting ecological responses to environmental change. Tree canopy chemistry underpins forest functional diversity, but the interactive role of phylogeny and environment in determining the chemical traits of tropical trees is poorly known. Collecting and analyzing foliage in 2,420 canopy tree species across 19 forests in the western Amazon, we discovered (i) systematic, community-scale shifts in average canopy chemical traits along gradients of elevation and soil fertility; (ii) strong phylogenetic partitioning of structural and defense chemicals within communities independent of variation in environmental conditions; and (iii) strong environmental control on foliar phosphorus and calcium, the two rock-derived elements limiting CO2 uptake in tropical forests. These findings indicate that the chemical diversity of western Amazonian forests occurs in a regionally nested mosaic driven by long-term chemical trait adjustment of communities to large-scale environmental filters, particularly soils and climate, and is supported by phylogenetic divergence of traits essential to foliar survival under varying environmental conditions. Geographically nested patterns of forest canopy chemical traits will play a role in determining the response and functional rearrangement of western Amazonian ecosystems to changing land use and climate. PMID:24591585

  8. Amazonian functional diversity from forest canopy chemical assembly

    PubMed Central

    Asner, Gregory P.; Martin, Roberta E.; Tupayachi, Raul; Anderson, Christopher B.; Sinca, Felipe; Carranza-Jimnez, Loreli; Martinez, Paola

    2014-01-01

    Patterns of tropical forest functional diversity express processes of ecological assembly at multiple geographic scales and aid in predicting ecological responses to environmental change. Tree canopy chemistry underpins forest functional diversity, but the interactive role of phylogeny and environment in determining the chemical traits of tropical trees is poorly known. Collecting and analyzing foliage in 2,420 canopy tree species across 19 forests in the western Amazon, we discovered (i) systematic, community-scale shifts in average canopy chemical traits along gradients of elevation and soil fertility; (ii) strong phylogenetic partitioning of structural and defense chemicals within communities independent of variation in environmental conditions; and (iii) strong environmental control on foliar phosphorus and calcium, the two rock-derived elements limiting CO2 uptake in tropical forests. These findings indicate that the chemical diversity of western Amazonian forests occurs in a regionally nested mosaic driven by long-term chemical trait adjustment of communities to large-scale environmental filters, particularly soils and climate, and is supported by phylogenetic divergence of traits essential to foliar survival under varying environmental conditions. Geographically nested patterns of forest canopy chemical traits will play a role in determining the response and functional rearrangement of western Amazonian ecosystems to changing land use and climate. PMID:24591585

  9. Chemical genomics in yeast

    PubMed Central

    Brenner, Charles

    2004-01-01

    Many drugs have unknown, controversial or multiple mechanisms of action. Four recent 'chemical genomic' studies, using genome-scale collections of yeast gene deletions that were either arrayed or barcoded, have presented complementary approaches to identifying gene-drug and pathway-drug interactions. PMID:15345040

  10. Mostly Plants. Individualized Biology Activities on: I. Investigating Bread Mold; II. Transpiration; III. Botany Project; IV. Collecting/Preserving/Identifying Leaves; [and] V. Student Science Laboratory Write-Ups.

    ERIC Educational Resources Information Center

    Gibson, Paul R.

    Individualized biology activities for secondary students are presented in this teaching guide. The guide is divided into five sections: (1) investigating bread mold; (2) investigating transpiration; (3) completing a botany project; (4) collecting, preserving, and identifying leaves; and (5) writing up science laboratory investigations. The…

  11. Subject and Citation Indexing. Part I: The Clustering Structure of Composite Representations in the Cystic Fibrosis Document Collection. Part II: The Optimal, Cluster-Based Retrieval Performance of Composite Representations.

    ERIC Educational Resources Information Center

    Shaw, W. M., Jr.

    1991-01-01

    Two articles discuss the clustering of composite representations in the Cystic Fibrosis Document Collection from the National Library of Medicine's MEDLINE file. Clustering is evaluated as a function of the exhaustivity of composite representations based on Medical Subject Headings (MeSH) and citation indexes, and evaluation of retrieval

  12. Subject and Citation Indexing. Part I: The Clustering Structure of Composite Representations in the Cystic Fibrosis Document Collection. Part II: The Optimal, Cluster-Based Retrieval Performance of Composite Representations.

    ERIC Educational Resources Information Center

    Shaw, W. M., Jr.

    1991-01-01

    Two articles discuss the clustering of composite representations in the Cystic Fibrosis Document Collection from the National Library of Medicine's MEDLINE file. Clustering is evaluated as a function of the exhaustivity of composite representations based on Medical Subject Headings (MeSH) and citation indexes, and evaluation of retrieval…

  13. Mostly Plants. Individualized Biology Activities on: I. Investigating Bread Mold; II. Transpiration; III. Botany Project; IV. Collecting/Preserving/Identifying Leaves; [and] V. Student Science Laboratory Write-Ups.

    ERIC Educational Resources Information Center

    Gibson, Paul R.

    Individualized biology activities for secondary students are presented in this teaching guide. The guide is divided into five sections: (1) investigating bread mold; (2) investigating transpiration; (3) completing a botany project; (4) collecting, preserving, and identifying leaves; and (5) writing up science laboratory investigations. The

  14. Chemical sensor

    NASA Technical Reports Server (NTRS)

    Rauh, R. David (Inventor)

    1990-01-01

    A sensor for detecting a chemical substance includes an insertion element having a structure which enables insertion of the chemical substance with a resulting change in the bulk electrical characteristics of the insertion element under conditions sufficient to permit effective insertion; the change in the bulk electrical characteristics of the insertion element is detected as an indication of the presence of the chemical substance.

  15. 77 FR 70188 - Manufacturer of Controlled Substances; Notice of Registration; Boehringer Ingelheim Chemicals, Inc.

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-11-23

    ... Chemicals, Inc. By Notice dated July 17, 2012, and published in the Federal Register on July 26, 2012, 77 FR... Lisdexamfetamine (1205) II Methylphenidate (1724) II Methadone (9250) II Methadone Intermediate (9254)...

  16. Chemical emergency preparedness program: chemical profiles. Interim guidance

    SciTech Connect

    Not Available

    1985-12-01

    The document, developed by the U.S. Environmental Protection Agency (USEPA) is part of the USEPA National Air Toxics Strategy. The document is provided in support of EPA Chemical Emergency Preparedness Program (CEPP) which deals with accidental release of acutely toxic chemicals. For each acutely toxic chemical listed in the CEPP guidance document (report number PB86-155256), a chemical profile is available. A chemical profile is a collection of information on the chemical identity hazardous identity, physical/chemical characteristics, fire and explosive hazard, reactivity, health hazard, use, and precautions for handling and use of the chemical. The information is presented in the format that conforms as closely as possible to the Occupational Safety and Health Administration (OSHA) recommended format for a Material Safety Data Sheet (MSDS).

  17. 7 CFR 633.14 - Debt collection.

    Code of Federal Regulations, 2010 CFR

    2010-01-01

    ....C. 3701) and the regulations found in 4 CFR chapter II. ... 7 Agriculture 6 2010-01-01 2010-01-01 false Debt collection. 633.14 Section 633.14 Agriculture... AGRICULTURE LONG TERM CONTRACTING WATER BANK PROGRAM § 633.14 Debt collection. Any debts arising under...

  18. 76 FR 14994 - Agency Information Collection Activities: Proposed Collection; Comments Requested: Reports of...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-03-18

    ...: Reports of Suspicious Orders or Theft/Loss of Listed Chemicals/Machines ACTION: 60-Day Notice of... Form/Collection: Reports of Suspicious Orders or Theft/Loss of Listed Chemicals/Machines. (3) Agency... collection: Form Number: Notification of suspicious orders and thefts is provided in writing on an as...

  19. 78 FR 76656 - Agency Information Collection Activities: Proposed Collection; Comments Requested: Reports of...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2013-12-18

    ...: Reports of Suspicious Orders or Theft/Loss of Listed Chemicals/Machines ACTION: 60-Day notice. The... Form/Collection: Reports of Suspicious Orders or Theft/Loss of Listed Chemicals/Machines. (3) Agency... collection: Form Number: Notification of suspicious orders and thefts is provided in writing on an as...

  20. Welding II.

    ERIC Educational Resources Information Center

    Allegheny County Community Coll., Pittsburgh, PA.

    Instructional objectives and performance requirements are outlined in this course guide for Welding II, a performance-based course offered at the Community College of Allegheny County to introduce students to out-of-position shielded arc welding with emphasis on proper heats, electrode selection, and alternating/direct currents. After introductory…

  1. FAQs II

    ERIC Educational Resources Information Center

    Kezar, Adrianna; Frank, Vikki; Lester, Jaime; Yang, Hannah

    2008-01-01

    In their paper entitled "Why should postsecondary institutions consider partnering to offer (Individual Development Accounts (IDAs)?" the authors reviewed frequently asked questions they encountered from higher education professionals about IDAs, but as their research continued so did the questions. FAQ II has more in-depth questions and answers…

  2. Welding II.

    ERIC Educational Resources Information Center

    Allegheny County Community Coll., Pittsburgh, PA.

    Instructional objectives and performance requirements are outlined in this course guide for Welding II, a performance-based course offered at the Community College of Allegheny County to introduce students to out-of-position shielded arc welding with emphasis on proper heats, electrode selection, and alternating/direct currents. After introductory

  3. Gas phase chemical detection with an integrated chemical analysis system

    SciTech Connect

    CASALNUOVO,STEPHEN A.; FRYE-MASON,GREGORY CHARLES; KOTTENSTETTE,RICHARD; HELLER,EDWIN J.; MATZKE,CAROLYN M.; LEWIS,PATRICK R.; MANGINELL,RONALD P.; BACA,ALBERT G.; HIETALA,VINCENT M.

    2000-04-12

    Microfabrication technology has been applied to the development of a miniature, multi-channel gas phase chemical laboratory that provides fast response, small size, and enhanced versatility and chemical discrimination. Each analysis channel includes a sample preconcentrator followed by a gas chromatographic separator and a chemically selective surface acoustic wave detector array to achieve high sensitivity and selectivity. The performance of the components, individually and collectively, is described.

  4. Anniston Community Health Survey: Follow-Up and Dioxin Analyses (ACHS-II) - Methods

    PubMed Central

    Birnbaum, L.S.; Dutton, N.D.; Cusack, C.; Mennemeyer, S.T.; Pavuk, M.

    2015-01-01

    High serum concentrations of polychlorinated biphenyls (PCBs) have been reported previously among residents of Anniston, Alabama, where a PCB production facility was located in the past. As the second of two cross-sectional studies of these Anniston residents, the Anniston Community Health Survey: Follow-Up and Dioxin Analyses (ACHS-II) will yield repeated measurements to be used to evaluate changes over time in ortho-PCB concentrations and selected health indicators in study participants. Dioxins, non-ortho PCBs, other chemicals, heavy metals, and a variety of additional clinical tests not previously measured in the original ACHS cohort will be examined in ACHS-II. The follow-up study also incorporates a questionnaire with extended sections on diet and occupational history for a more comprehensive assessment of possible exposure sources. Data collection for ACHS-II from 359 eligible participants took place in 2014, seven to nine years after ACHS. PMID:25982988

  5. I. Cognitive and instructional factors relating to students' development of personal models of chemical systems in the general chemistry laboratory II. Solvation in supercritical carbon dioxide/ethanol mixtures studied by molecular dynamics simulation

    NASA Astrophysics Data System (ADS)

    Anthony, Seth

    Part I. Students' participation in inquiry-based chemistry laboratory curricula, and, in particular, engagement with key thinking processes in conjunction with these experiences, is linked with success at the difficult task of "transfer"---applying their knowledge in new contexts to solve unfamiliar types of problems. We investigate factors related to classroom experiences, student metacognition, and instructor feedback that may affect students' engagement in key aspects of the Model-Observe-Reflect-Explain (MORE) laboratory curriculum - production of written molecular-level models of chemical systems, describing changes to those models, and supporting those changes with reference to experimental evidence---and related behaviors. Participation in introductory activities that emphasize reviewing and critiquing of sample models and peers' models are associated with improvement in several of these key aspects. When students' self-assessments of the quality of aspects of their models are solicited, students are generally overconfident in the quality of their models, but these self-ratings are also sensitive to the strictness of grades assigned by their instructor. Furthermore, students who produce higher-quality models are also more accurate in their self-assessments, suggesting the importance of self-evaluation as part of the model-writing process. While the written feedback delivered by instructors did not have significant impacts on student model quality or self-assessments, students' resubmissions of models were significantly improved when students received "reflective" feedback prompting them to self-evaluate the quality of their models. Analysis of several case studies indicates that the content and extent of molecular-level ideas expressed in students' models are linked with the depth of discussion and content of discussion that occurred during the laboratory period, with ideas developed or personally committed to by students during the laboratory period being likely to appear in students' post-laboratory refined models. These discussions during the laboratory period are primarily prompted by factors external to the students or their laboratory groups such as questions posed by the instructor or laboratory materials. Part II. Solvation of polar molecules within non-polar supercritical carbon dioxide is often facilitated by the introduction of polar cosolvents as entrainers, which are believed to preferentially surround solute molecules. Molecular dynamics simulations of supercritical carbon dioxide/ethanol mixtures reveal that ethanol molecules form hydrogen-bonded aggregates of varying sizes and structures, with cyclic tetramers and pentamers being unusually prevalent. The dynamics of ethanol molecules within these mixtures at a range of thermodynamic conditions can largely be explained by differences in size and structure in these aggregates. Simulations that include solute molecules reveal enhancement of the polar cosolvent around hydrogen-bonding sites on the solute molecules, corroborating and helping to explain previously reported experimental trends in solute mobility.

  6. Cu(II) and Zn(II) ions alter the dynamics and distribution of Mn(II) in cultured chick glial cells

    SciTech Connect

    Wedler, F.C.; Ley, B.W. )

    1990-12-01

    Previous studies revealed that Mn(II) is accumulated in cultured glial cells to concentrations far above those present in whole brain or in culture medium. The data indicated that Mn(II) moves across the plasma membrane into the cytoplasm by facilitated diffusion or counter-ion transport with Ca(II), then into mitochondria by active transport. The fact that 1-10 microM Mn(II) ions activate brain glutamine synthetase makes important the regulation of Mn(II) transport in the CNS. Since Cu(II) and Zn(II) caused significant changes in the accumulation of Mn(II) by glia, the mechanisms by which these ions alter the uptake and efflux of Mn(II) ions has been investigated systematically under chemically defined conditions. The kinetics of (54MN)-Mn(II) uptake and efflux were determined and compared under four different sets of conditions: no adducts, Cu(II) or Zn(II) added externally, and with cells preloaded with Cu(II) or Zn(II) in the presence and absence of external added metal ions. Zn(II) ions inhibit the initial velocity of Mn(II) uptake, increase total Mn(II) accumulated, but do not alter the rate or extent Mn(II) efflux. Cu(II) ions increase both the initial velocity and the net Mn(II) accumulated by glia, with little effect on rate or extent of Mn(II) efflux. These results predict that increases in Cu(II) or Zn(II) levels may also increase the steady-state levels of Mn(II) in the cytoplasmic fraction of glial cells, which may in turn alter the activity of Mn(II)-sensitive enzymes in this cell compartment.

  7. [Chemical weapons and chemical terrorism].

    PubMed

    Nakamura, Katsumi

    2005-10-01

    Chemical Weapons are kind of Weapons of Mass Destruction (WMD). They were used large quantities in WWI. Historically, large quantities usage like WWI was not recorded, but small usage has appeared now and then. Chemical weapons are so called "Nuclear weapon for poor countrys" because it's very easy to produce/possession being possible. They are categorized (1) Nerve Agents, (2) Blister Agents, (3) Cyanide (blood) Agents, (4) Pulmonary Agents, (5) Incapacitating Agents (6) Tear Agents from the viewpoint of human body interaction. In 1997 the Chemical Weapons Convention has taken effect. It prohibits chemical weapons development/production, and Organization for the Prohibition of Chemical Weapons (OPCW) verification regime contributes to the chemical weapons disposal. But possibility of possession/use of weapons of mass destruction by terrorist group represented in one by Matsumoto and Tokyo Subway Sarin Attack, So new chemical terrorism countermeasures are necessary. PMID:16296384

  8. Chemical Composition

    NASA Astrophysics Data System (ADS)

    May, Willie; Cavanagh, Richard; Turk, Gregory; Winchester, Michael; Travis, John; Smith, Melody; Derose, Paul; Choquette, Steven; Kramer, Gary; Sieber, John; Greenberg, Robert; Lindstrom, Richard; Lamaze, George; Zeisler, Rolf; Schantz, Michele; Sander, Lane; Phinney, Karen; Welch, Michael; Vetter, Thomas; Pratt, Kenneth; Scott, John; Small, John; Wight, Scott; Stranick, Stephan

    Measurements of the chemical compositions of materials and the levels of certain substances in them are vital when assessing and improving public health, safety and the environment, are necessary to ensure trade equity, and are required when monitoring and improving industrial products and services. Chemical measurements play a crucial role in most areas of the economy, including healthcare, food and nutrition, agriculture, environmental technologies, chemicals and materials, instrumentation, electronics, forensics, energy, and transportation.

  9. Chemical microsensors

    DOEpatents

    Li, DeQuan; Swanson, Basil I.

    1995-01-01

    An article of manufacture is provided including a substrate having an oxide surface layer and a selective thin film of a cyclodextrin derivative chemically bound upon said substrate, said film is adapted for the inclusion of a selected organic compound therewith. Such an article can be either a chemical sensor capable of detecting a resultant mass change from inclusion of the selected organic compound or a chemical separator capable of reversibly selectively separating a selected organic compound.

  10. PORT II

    NASA Technical Reports Server (NTRS)

    Muniz, Beau

    2009-01-01

    One unique project that the Prototype lab worked on was PORT I (Post-landing Orion Recovery Test). PORT is designed to test and develop the system and components needed to recover the Orion capsule once it splashes down in the ocean. PORT II is designated as a follow up to PORT I that will utilize a mock up pressure vessel that is spatially compar able to the final Orion capsule.

  11. BORE II

    Energy Science and Technology Software Center (ESTSC)

    2015-08-01

    Bore II, co-developed by Berkeley Lab researchers Frank Hale, Chin-Fu Tsang, and Christine Doughty, provides vital information for solving water quality and supply problems and for improving remediation of contaminated sites. Termed "hydrophysical logging," this technology is based on the concept of measuring repeated depth profiles of fluid electric conductivity in a borehole that is pumping. As fluid enters the wellbore, its distinct electric conductivity causes peaks in the conductivity log that grow and migratemore » upward with time. Analysis of the evolution of the peaks enables characterization of groundwater flow distribution more quickly, more cost effectively, and with higher resolution than ever before. Combining the unique interpretation software Bore II with advanced downhole instrumentation (the hydrophysical logging tool), the method quantifies inflow and outflow locations, their associated flow rates, and the basic water quality parameters of the associated formation waters (e.g., pH, oxidation-reduction potential, temperature). In addition, when applied in conjunction with downhole fluid sampling, Bore II makes possible a complete assessment of contaminant concentration within groundwater.« less

  12. BORE II

    SciTech Connect

    2015-08-01

    Bore II, co-developed by Berkeley Lab researchers Frank Hale, Chin-Fu Tsang, and Christine Doughty, provides vital information for solving water quality and supply problems and for improving remediation of contaminated sites. Termed "hydrophysical logging," this technology is based on the concept of measuring repeated depth profiles of fluid electric conductivity in a borehole that is pumping. As fluid enters the wellbore, its distinct electric conductivity causes peaks in the conductivity log that grow and migrate upward with time. Analysis of the evolution of the peaks enables characterization of groundwater flow distribution more quickly, more cost effectively, and with higher resolution than ever before. Combining the unique interpretation software Bore II with advanced downhole instrumentation (the hydrophysical logging tool), the method quantifies inflow and outflow locations, their associated flow rates, and the basic water quality parameters of the associated formation waters (e.g., pH, oxidation-reduction potential, temperature). In addition, when applied in conjunction with downhole fluid sampling, Bore II makes possible a complete assessment of contaminant concentration within groundwater.

  13. Dust as interstellar catalyst. I. Quantifying the chemical desorption process

    NASA Astrophysics Data System (ADS)

    Minissale, M.; Dulieu, F.; Cazaux, S.; Hocuk, S.

    2016-01-01

    Context. The presence of dust in the interstellar medium has profound consequences on the chemical composition of regions where stars are forming. Recent observations show that many species formed onto dust are populating the gas phase, especially in cold environments where UV- and cosmic-ray-induced photons do not account for such processes. Aims: The aim of this paper is to understand and quantify the process that releases solid species into the gas phase, the so-called chemical desorption process, so that an explicit formula can be derived that can be included in astrochemical models. Methods: We present a collection of experimental results of more than ten reactive systems. For each reaction, different substrates such as oxidized graphite and compact amorphous water ice were used. We derived a formula for reproducing the efficiencies of the chemical desorption process that considers the equipartition of the energy of newly formed products, followed by classical bounce on the surface. In part II of this study we extend these results to astrophysical conditions. Results: The equipartition of energy correctly describes the chemical desorption process on bare surfaces. On icy surfaces, the chemical desorption process is much less efficient, and a better description of the interaction with the surface is still needed. Conclusions: We show that the mechanism that directly transforms solid species into gas phase species is efficient for many reactions.

  14. Non-planar chemical preconcentrator

    DOEpatents

    Manginell, Ronald P.; Adkins, Douglas R.; Sokolowski, Sara S.; Lewis, Patrick R.

    2006-10-10

    A non-planar chemical preconcentrator comprises a high-surface area, low mass, three-dimensional, flow-through sorption support structure that can be coated or packed with a sorptive material. The sorptive material can collect and concentrate a chemical analyte from a fluid stream and rapidly release it as a very narrow temporal plug for improved separations in a microanalytical system. The non-planar chemical preconcentrator retains most of the thermal and fabrication benefits of a planar preconcentrator, but has improved ruggedness and uptake, while reducing sorptive coating concerns and extending the range of collectible analytes.

  15. Children Teaching Children II. [CD-ROM].

    ERIC Educational Resources Information Center

    California State Dept. of Education, Sacramento. Office of School Improvement.

    Children Teaching Children (CTC): Collection II is a CD-ROM created at 6 elementary schools in the West Contra Costa Unified School District (California) as part of the Coaching Odyssey for school improvement. CTC II, published by the California Department of Education, is an effective early literacy intervention that integrates the development of…

  16. Chemical tracking at the Rocky Flats Plant

    SciTech Connect

    Costain, D.B.

    1994-04-01

    EG&G Rocky Flats, Inc., has developed a chemical tracking system to support compliance with the Emergency Planning and community Right-to-Know Act (EPCRA) at the Rocky Flats Plant. This system, referred to as the EPCRA Chemical Control system (ECCS), uses bar code technology to uniquely identify and track the receipt, distribution, and use of chemicals. Chemical inventories are conducted using hand-held electronic scanners to update a site wide chemical database on a VAX 6000 computer. Information from the ECCS supports preparation of the EPCRA Tier II and Form R reports on chemical storage and use.

  17. Collection, Isolation and Culture of Marine Algae.

    ERIC Educational Resources Information Center

    James, Daniel E.

    1984-01-01

    Methods of collecting, isolating, and culturing microscopic and macroscopic marine algae are described. Three different culture media list of chemicals needed and procedures for preparing Erdschreiber's and Provasoli's E. S. media. (BC)

  18. Electronic and chemical state of aluminum from the single- (K) and double-electron excitation (KLII&III, KLI) x-ray absorption near-edge spectra of α-alumina, sodium aluminate, aqueous Al³⁺•(H₂O)₆, and aqueous Al(OH)₄⁻

    SciTech Connect

    Fulton, John L.; Govind, Niranjan; Huthwelker, Thomas; Bylaska, Eric J.; Vjunov, Aleksei; Pin, Sonia; Smurthwaite, Tricia D.

    2015-07-02

    We probe, at high energy resolution, the double electron excitation (KLII&II) x-ray absorption region that lies approximately 115 eV above the main Al K-edge (1566 eV) of α-alumina and sodium aluminate. The two solid standards, α-alumina (octahedral) and sodium aluminate (tetrahedral) are compared to aqueous species that have the same Al coordination symmetries, Al³⁺•6H₂O (octahedral) and Al(OH)₄⁻ (tetrahedral). For the octahedral species, the edge height of the KLII&III-edge is approximately 10% of the main K-edge however the edge height is much weaker (3% of K-edge height) for Al species with tetrahedral symmetry. For the α-alumina and aqueous Al³⁺•6H₂O the KLII&III spectra contain white line features and extended absorption fine structure (EXAFS) that mimics the K-edge spectra. The KLII&III-edge feature interferes with an important region of the extended-XAFS region of the spectra for the K-edge of the crystalline and aqueous standards. The K-edge spectra and K-edge positions are predicted using time-dependent density functional theory (TDDFT). The TDDFT calculations for the K-edge XANES spectra reproduce the observed transitions in the experimental spectra of the four Al species. The KLII&III and KLI onsets and their corresponding chemical shifts for the four standards are estimated using the delta self-consistent field (ΔSCF) method. Research by JLF, NG, EJB, AV, TDS was supported by U.S. Department of Energy’s (DOE), Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences. NG thanks Amity Andersen for help with the α-Al₂O₃ and tetrahedral sodium aluminate (NaAlO₂) clusters. All the calculations were performed using the Molecular Science Computing Capability at EMSL, a national scientific user facility sponsored by the U.S. Department of Energy’s Office of Biological and Environmental Research and located at Pacific Northwest National Laboratory (PNNL). PNNL is a multi-program national laboratory operated for DOE by Battelle under Contract # AC05-76RL01830.

  19. 76 FR 29792 - Agency Information Collection Activities: Proposed Collection; Comments Requested: Reports of...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-05-23

    ... information collection was previously published in the Federal Register at 76 FR 14994, March 18, 2011...: Reports of Suspicious Orders or Theft/Loss of Listed Chemicals/Machines ACTION: 30-Day notice of... currently approved collection. (2) Title of the Form/Collection: Reports of Suspicious Orders or...

  20. Chemical and ancillary data associated with bed sediment, young of year Bluefish (Pomatomus saltatrix) tissue, and mussel (Mytilus edulis and Geukensia demissa) tissue collected after Hurricane Sandy in bays and estuaries of New Jersey and New York, 2013–14

    USGS Publications Warehouse

    Smalling, Kelly L.; Deshpande, Ashok D.; Blazer, Vicki; Galbraith, Heather S.; Dockum, Bruce W.; Romanok, Kristin M.; Colella, Kaitlyn; Deetz, Anna C.; Fisher, Irene J.; Imbrigiotta, Thomas E.; Sharack, Beth; Summer, Lisa; Timmons, DeMond; Trainor, John J.; Wieczorek, Daniel; Samson, Jennifer; Reilly, Timothy J.; Focazio, Michael J.

    2015-01-01

    Twenty three PCB congeners, 9 PBDE congeners, and 20 OCPs were detected in composite mussel samples collected throughout the study area. The co-eluting PCB congeners 153 and 132, PBDE 47, 99, and 100, and p,p’-DDE were detected in samples from each site. The highest median concentrations of PCBs and PBDEs were present in mussels from Raritan Bay, N.Y., whereas the highest median concentrations of OCPs were present in mussels from Fire Island Inlet, N.Y., and Shark River, N.J. Mytilus edulis (blue mussels) and Geukensia demissa (ribbed mussels) were thin-sectioned and aged. The blue mussels collected ranged in age from 4 to 13 years, and the ribbed mussels ranged in age from 3 to 12 years.

  1. Chemical sensors

    DOEpatents

    Lowell, Jr., James R.; Edlund, David J.; Friesen, Dwayne T.; Rayfield, George W.

    1991-01-01

    Sensors responsive to small changes in the concentration of chemical species are disclosed, comprising (a) a mechanochemically responsive polymeric film capable of expansion or contraction in response to a change in its chemical environment, operatively coupled to (b) a transducer capable of directly converting said expansion or contraction to a measurable electrical response.

  2. Chemical preconcentrator

    DOEpatents

    Manginell, Ronald P.; Frye-Mason, Gregory C.

    2001-01-01

    A chemical preconcentrator is disclosed with applications to chemical sensing and analysis. The preconcentrator can be formed by depositing a resistive heating element (e.g. platinum) over a membrane (e.g. silicon nitride) suspended above a substrate. A coating of a sorptive material (e.g. a microporous hydrophobic sol-gel coating or a polymer coating) is formed on the suspended membrane proximate to the heating element to selective sorb one or more chemical species of interest over a time period, thereby concentrating the chemical species in the sorptive material. Upon heating the sorptive material with the resistive heating element, the sorbed chemical species are released for detection and analysis in a relatively high concentration and over a relatively short time period. The sorptive material can be made to selectively sorb particular chemical species of interest while not substantially sorbing other chemical species not of interest. The present invention has applications for use in forming high-sensitivity, rapid-response miniaturized chemical analysis systems (e.g. a "chem lab on a chip").

  3. Chemical sensors

    DOEpatents

    Lowell, J.R. Jr.; Edlund, D.J.; Friesen, D.T.; Rayfield, G.W.

    1991-07-02

    Sensors responsive to small changes in the concentration of chemical species are disclosed. The sensors comprise a mechanochemically responsive polymeric film capable of expansion or contraction in response to a change in its chemical environment. They are operatively coupled to a transducer capable of directly converting the expansion or contraction to a measurable electrical response. 9 figures.

  4. Hydrothermal synthesis, structural and physico-chemical characterizations of two Nasicon phosphates: M{sub 0.50}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (M = Mn, Co)

    SciTech Connect

    Essehli, Rachid; Bali, Brahim El; Benmokhtar, S.; Fejfarova, Karla; Dusek, Michal

    2009-07-01

    The family of titanium Nasicon-phosphates of generic formula M{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} has been revisited using hydrothermal techniques. Two phases have been synthesized: Mn{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (MnTiP) and Co{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} (CoTiP). Single crystal diffraction studies show that they exhibit two different structural types. Mn{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} phosphate crystallizes in the R-3 space group, with the cell parameters a = 8.51300(10) A and c = 21.0083(3) A (V = 1318.52(3) A{sup 3} and Z = 6). The Co{sub 0.5}{sup II}Ti{sub 2}(PO{sub 4}){sub 3} phosphate crystallizes in the R-3c space group, with a = 8.4608(9) A and c = 21.174(2) A (V = 1312.7(2) A{sup 3} and Z = 6). These two compounds are clearly related to the parent Nasicon-type rhombohedral structure, which can be described using [Ti{sub 2}(PO{sub 4}){sub 3}] framework composed of two [TiO{sub 6}] octahedral interlinked via three [PO{sub 4}] tetrahedra. {sup 31}P magic-angle spinning nuclear magnetic resonance (MAS-NMR) data are presented as supporting data. Curie-Weiss-type behavior is observed in the magnetic susceptibility. The phases are also characterized by IR spectroscopy and UV-visible.

  5. Gas Phase Chemical Detection with an Integrated Chemical Analysis System

    SciTech Connect

    Baca, Albert G.; Casalnuovo, Stephen A.; Frye-Mason, Gregory C.; Heller, Edwin J.; Hietala, Susan L.; Hietala, Vincent M.; Kottenstette, Richard J.; Lewis, Patrick R.; Manginell, Ronald P.; Matzke, Carloyn M.; Reno, John L.; Sasaki, Darryl Y.; Schubert, W. Kent

    1999-07-08

    Microfabrication technology has been applied to the development of a miniature, multi-channel gas phase chemical laboratory that provides fast response, small size, and enhanced versatility and chemical discrimination. Each analysis channel includes a sample concentrator followed by a gas chromatographic separator and a chemically selective surface acoustic wave detector array to achieve high sensitivity and selectivity. The performance of the components, individually and collectively, is described. The design and performance of novel micromachined acoustic wave devices, with the potential for improved chemical sensitivity, are also described.

  6. Workforce Competitiveness Collection. "LINCS" Resource Collection News

    ERIC Educational Resources Information Center

    Literacy Information and Communication System, 2011

    2011-01-01

    This edition of "'LINCS' Resource Collection News" features the Workforce Competitiveness Collection, covering the topics of workforce education, English language acquisition, and technology. Each month Collections News features one of the three "LINCS" (Literacy Information and Communication System) Resource Collections--Basic Skills, Program…

  7. Program Management Collection. "LINCS" Resource Collection News

    ERIC Educational Resources Information Center

    Literacy Information and Communication System, 2011

    2011-01-01

    This edition of "'LINCS' Resource Collection News" features the Program Management Collection, which covers the topics of Assessment, Learning Disabilities, and Program Improvement. Each month Collections News features one of the three "LINCS" (Literacy Information and Communication System) Resource Collections--Basic Skills, Program Management,…

  8. 40 CFR 761.253 - Chemical analysis.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... 40 Protection of Environment 32 2013-07-01 2013-07-01 false Chemical analysis. 761.253 Section 761... Sample Sites, Collecting Surface Samples, and Analyzing Standard PCB Wipe Samples § 761.253 Chemical analysis. (a) Extract PCBs from the standard wipe sample collection medium and clean-up the extracted...

  9. 40 CFR 761.253 - Chemical analysis.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... 40 Protection of Environment 32 2012-07-01 2012-07-01 false Chemical analysis. 761.253 Section 761... Sample Sites, Collecting Surface Samples, and Analyzing Standard PCB Wipe Samples § 761.253 Chemical analysis. (a) Extract PCBs from the standard wipe sample collection medium and clean-up the extracted...

  10. 40 CFR 761.253 - Chemical analysis.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... 40 Protection of Environment 31 2014-07-01 2014-07-01 false Chemical analysis. 761.253 Section 761... Sample Sites, Collecting Surface Samples, and Analyzing Standard PCB Wipe Samples § 761.253 Chemical analysis. (a) Extract PCBs from the standard wipe sample collection medium and clean-up the extracted...

  11. 76 FR 35913 - Agency Information Collection Activities: Proposed Collection; Comments Requested: U.S. Official...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-06-20

    ... Form Requisition; DEA Form 222, 222a, Controlled Substances Order System ACTION: 30-Day notice of... currently approved collection. (2) Title of the Form/Collection: U.S. Official Order Forms for Schedule I and II Controlled Substances (Accountable Forms); Order Form Requisition. (3) Agency form number,...

  12. Unnecessary Chemicals

    ERIC Educational Resources Information Center

    Johnson, Anita

    1978-01-01

    Discusses the health hazards resulting from chemical additions of many common products such as cough syrups, food dyes, and cosmetics. Steps being taken to protect consumers from these health hazards are included. (MDR)

  13. Chemical pneumonitis

    MedlinePlus

    ... fertilizer dust Noxious fumes from pesticides Smoke (from house fires and wildfires) Chronic chemical pneumonitis can occur after only low levels of exposure to the irritant over a long time. This causes inflammation and may lead to ...

  14. Chemical Emergencies

    MedlinePlus

    ... be unintentional, as in the case of an industrial accident. They could also be planned, as in ... and VX. Many hazardous chemicals are used in industry - for example, chlorine, ammonia, and benzene. Some can ...

  15. Chemical Peels

    MedlinePlus

    ... under the eyes and around the mouth). Freckles. Melasma. Rough-feeling skin. Sun-damage skin. Insurance coverage: Chemical peels are considered a cosmetic treatment. Insurance does not cover the cost of cosmetic ...

  16. Chemical sensors

    DOEpatents

    Lowell, Jr., James R.; Edlund, David J.; Friesen, Dwayne T.; Rayfield, George W.

    1992-01-01

    Sensors responsive to small changes in the concentration of chemical species are disclosed, comprising a mechanicochemically responsive polymeric film capable of expansion or contraction in response to a change in its chemical environment, either operatively coupled to a transducer capable of directly converting the expansion or contraction to a measurable electrical or optical response, or adhered to a second inert polymeric strip, or doped with a conductive material.

  17. Chemical sensors

    DOEpatents

    Lowell, J.R. Jr.; Edlund, D.J.; Friesen, D.T.; Rayfield, G.W.

    1992-06-09

    Sensors responsive to small changes in the concentration of chemical species are disclosed, comprising a mechanicochemically responsive polymeric film capable of expansion or contraction in response to a change in its chemical environment, either operatively coupled to a transducer capable of directly converting the expansion or contraction to a measurable electrical or optical response, or adhered to a second inert polymeric strip, or doped with a conductive material. 12 figs.

  18. Atomic Structure and Valence: Level II, Unit 10, Lesson 1; Chemical Bonding: Lesson 2; The Table of Elements: Lesson 3; Electrolysis: Lesson 4. Advanced General Education Program. A High School Self-Study Program.

    ERIC Educational Resources Information Center

    Manpower Administration (DOL), Washington, DC. Job Corps.

    This self-study program for high-school level contains lessons on: Atomic Structure and Valence, Chemical Bonding, The Table of Elements, and Electrolysis. Each of the lessons concludes with a Mastery Test to be completed by the student. (DB)

  19. Chemical composition of PM10 and PM2.5 collected at ground level and 100 meters during a strong winter-time pollution episode in Xi'an, China.

    PubMed

    Shen, Zhenxing; Cao, Junji; Liu, Suixin; Zhu, Chongshu; Wang, Xin; Zhang, Ting; Xu, Hongmei; Hu, Tafeng

    2011-11-01

    An intensive sampling of aerosol particles from ground level and 100 m was conducted during a strong pollution episode during the winter in Xi'an, China. Concentrations of water-soluble inorganic ions, carbonaceous compounds, and trace elements were determined to compare the composition of particulate matter (PM) at the two heights. PM mass concentrations were high at both stations: PM10 (PM with aerodynamic diameter < or =10 microm) exceeded the China National Air Quality Standard Class II value on three occasions, and PM2.5 (PM with aerodynamic diameter < or =2.5 microm) exceeded the daily U.S. National Ambient Air Quality Standard more than 10 times. The PM10 organic carbon (OC) and elemental carbon (EC) were slightly lower at the ground than at 100 m, both in terms of concentration and percentage of total mass, but OC and EC in PM2.5 exhibited the opposite pattern. Major ionic species, such as sulfate and nitrate, showed vertical variations similar to the carbonaceous aerosols. High sulfate concentrations indicated that coal combustion dominated the PM mass both at the ground and 100 m. Correlations between K+ and OC and EC at 100 m imply a strong influence from suburban biomass burning, whereas coal combustion and motor vehicle exhaust had a greater influence on the ground PM. Stable atmospheric conditions apparently led to the accumulation of PM, especially at 100 m, and these conditions contributed to the similarities in PM at the two elevations. Low coefficient of divergence (CD) values reflect the similarities in the composition of the aerosol between sites, but higher CDs for fine particles compared with coarse ones were consistent with the differences in emission sources between the ground and 100 m. PMID:22168098

  20. Surface catalysis of uranium(VI) reduction by iron(II)

    NASA Astrophysics Data System (ADS)

    Liger, Emmanuelle; Charlet, Laurent; Van Cappellen, Philippe

    1999-10-01

    Colloidal hematite (α-Fe2O3) is used as model solid to investigate the kinetic effect of specific adsorption interactions on the chemical reduction of uranyl (UVIO22+) by ferrous iron. Acid-base titrations and Fe(II) and uranyl adsorption experiments are performed on hematite suspensions, under O2- and CO2-free conditions. The results are explained in terms of a constant capacitance surface complexation model of the hematite-aqueous solution interface. Two distinct Fe(II) surface complexes are required to reproduce the data: (≡FeIIIOFeII)+ (or ≡FeIIIOFeII(OH2)n+) and ≡FeIIIOFeIIOH0 (or ≡FeIIIOFeII(OH2)n-1OH0). The latter complex represents a significant fraction of total adsorbed Fe(II) at pH > 6.5. Uranyl binding to the hematite particles is characterized by a sharp adsorption edge between pH 4 and pH 5.5. Because of the absence of competing aqueous carbonate complexes, uranyl remains completely adsorbed at pH > 7. A single mononuclear surface complex accounts for the adsorption of uranyl over the entire range of experimental conditions. Although thermodynamically feasible, no reaction between uranyl and Fe(II) is observed in homogeneous solution at pH 7.5, for periods of up to three days. In hematite suspensions, however, surface-bound uranyl reacts on a time scale of hours. Based on Fourier Transformed Infrared spectra, chemical reduction of U(VI) is inferred to be the mechanism responsible for the disappearance of uranyl. The kinetics of uranyl reduction are quantified by measuring the decrease with time of the concentration of U(VI) extractable from the hematite particles by NaHCO3. In the presence of excess Fe(II), the initial rate of U(VI) reduction exhibits a first-order dependence on the concentration of adsorbed uranyl. The pseudo-first-order rate constant varies with pH (range, 6-7.5) and the total (dissolved + adsorbed) concentration of Fe(II) (range, 2-160 μM). When analyzing the rate data in terms of the calculated surface speciation, the variability of the rate constant can be accounted for entirely by changes in the concentration of the Fe(II) monohydroxo surface complex ≡FeIIIOFeIIOH0. Therefore, the following rate law is derived for the hematite-catalyzed reduction of uranyl by Fe(II), {d[U(VI)]}/{dt}=-k[≡FeIIIOFeIIOH0][U(VI)]ads where the bimolecular rate constant k has a value of 399 ± 25 M-1 min-1 at 25°C. The hydroxo surface complex is the rate-controlling reductant species, because it provides the most favorable coordination environment in which electrons are removed from Fe(II). Natural particulate matter collected in the hypolimnion of a seasonally stratified lake also causes the rapid reduction of uranyl by Fe(II). Ferrihydrite, identified in the particulate matter by X-ray diffraction, is one possible mineral phase accelerating the reaction between U(VI) and Fe(II). At near-neutral pH and total Fe(II) levels less than 1 mM, the pseudo-first-order rate constants of chemical U(VI) reduction, measured in the presence of the hematite and lake particles, are of the same order of magnitude as the highest corresponding rate coefficients for enzymatic U(VI) reduction in bacterial cultures. Hence, based on the results of this study, surface-catalyzed U(VI) reduction by Fe(II) is expected to be a major pathway of uranium immobilization in a wide range of redox-stratified environments.