National Library of Energy BETA

Sample records for aromatic hydrocarbons pahs

  1. Polycyclic Aromatic Hydrocarbons (PAHs), nitrated PAHs and oxygenated PAHs in ambient air of the

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1 Polycyclic Aromatic Hydrocarbons (PAHs), nitrated PAHs and oxygenated PAHs in ambient air + particle phases) of 16 polycyclic aromatic hydrocarbons (PAHs), 17 nitrated PAHs (NPAHs) and 9 oxygenated when (before or during the sampling) the OPAHs are formed. Keywords: Polycyclic aromatic hydrocarbons

  2. Distribution of polycyclic aromatic hydrocarbons (PAH's) in marsh sediments, Iraq

    SciTech Connect (OSTI)

    Al-Saad, H.T.; Al-Timari, A.A. (Univ. of Basrah (Iraq))

    1989-12-01

    Recently there has been a growing concern in the release of harmful organics into the environment. Carcinogenic polycyclic aromatic hydrocarbons (PAH's) are a class of compounds of interset due to their possible harmful effects to man as well as organisms. Anthropogenic PAH's may reach aquatic environment as a result of both industrial and domestic effluents, deposition of airborne particles, surface runoff and oil spillage. Having a relatively low water solubility and high affinity to sorb to the suspended particulate matter, most of the PAH's introduced to the aquatic environment tend to accumulate in bottom sediments. Sedimentary PAH's may thus provide a record of the input and history of these pollutants. Consequently, the distribution of PAH's in aquatic sediments have received considerable attention. The purpose of the present work was to establish the distribution of PAH's in the sediments of the marsh region located in southern Iraq.

  3. Interfacial effects in a two-phase partitioning bioreactor: degradation of polycyclic aromatic hydrocarbons (PAHs)

    E-Print Network [OSTI]

    Daugulis, Andrew J.

    hydrocarbons (PAHs) by a hydrophobic Mycobacterium Carolan T. MacLeod, Andrew J. Daugulis* Department 18 June 2004 Abstract The growth of Mycobacterium PYR-1 on polycyclic aromatic hydrocarbons (PAHs Bioreactor; Hydrophobicity 1. Introduction Polycyclic aromatic hydrocarbons (PAHs), many of which possess

  4. Polycylcic Aromatic Hydrocarbons (PAH's) in dense cloud chemistry

    E-Print Network [OSTI]

    Valentine Wakelam; Eric Herbst

    2008-02-26

    Virtually all detailed gas-phase models of the chemistry of dense interstellar clouds exclude polycyclic aromatic hydrocarbons (PAH's). This omission is unfortunate because from the few studies that have been done on the subject, it is known that the inclusion of PAH's can affect the gas-phase chemistry strongly. We have added PAH's to our network to determine the role they play in the chemistry of cold dense cores. In the models presented here, we include radiative attachment to form PAH-, mutual neutralization between PAH anions and small positively-charged ions, and photodetachment. We also test the sensitivity of our results to changes in the size and abundance of the PAH's. Our results confirm that the inclusion of PAH's changes many of the calculated abundances of smaller species considerably. In TMC-1, the general agreement with observations is significantly improved contrary to L134N. This may indicate a difference in PAH properties between the two regions. With the inclusion of PAH's in dense cloud chemistry, high-metal elemental abundances give a satisfactory agreement with observations. As a result, we do not need to decrease the observed elemental abundances of all metals and we do not need to vary the elemental C/O ratio in order to produce large abundances of carbon species in TMC-1 (CP).

  5. Polycyclic aromatic hydrocarbons (PAHs) are ubiquitous, recalcitrant, and potentially carcinogenic pollutants. Plants

    E-Print Network [OSTI]

    1461 Polycyclic aromatic hydrocarbons (PAHs) are ubiquitous, recalcitrant, and potentially microorganisms. Aged PAH-polluted soil with a total PAH level of 753 mg kg-1 soil dry weight was planted with 18. The size of soil microbial populations of PAH degraders was also monitored. Planting significantly enhanced

  6. Thermochemical Properties of Polycyclic Aromatic Hydrocarbons (PAH) from G3MP2B3 Calculations

    E-Print Network [OSTI]

    Pitsch, Heinz

    Thermochemical Properties of Polycyclic Aromatic Hydrocarbons (PAH) from G3MP2B3 Calculations-pVDZ). Enthalpies of formation are calculated using the mixed G3MP2//B3 method. Finally, a group correction

  7. Removal of polycyclic aromatic hydrocarbons (PAHs) from sewage sludge by anaerobic degradation

    E-Print Network [OSTI]

    to reduce volume, remove pathogens, and to gain energy. Anaerobic digestion is by far the most commonRemoval of polycyclic aromatic hydrocarbons (PAHs) from sewage sludge by anaerobic degradation N treatment in a wastewater treatment plant. They therefore proceed directly to the anaerobic post treatment

  8. Identification of Sediment Organic Carbon Location and Association with Polycyclic Aromatic Hydrocarbons (PAHs) in Contaminated Sediment

    E-Print Network [OSTI]

    Identification of Sediment Organic Carbon Location and Association with Polycyclic Aromatic Hydrocarbons (PAHs) in Contaminated Sediment Upal Ghosh1 , Richard G. Luthy1 , J. Seb Gillette2 , and Richard N long-term issue confronting sediment bioremediation is the lack of understanding of contaminant-sediment

  9. Stable carbon isotope ratio of polycyclic aromatic hydrocarbons (PAHs) in the environment: validation of isolation and stable carbon isotope analysis methods 

    E-Print Network [OSTI]

    Kim, Moon Koo

    2004-11-15

    Polycyclic aromatic hydrocarbons (PAHs) are ubiquitous, toxic contaminants that are released to the environment from various petrogenic and pyrogenic sources. In an effort to more clearly identify and trace sources of PAHs ...

  10. Biomarkers of polycyclic aromatic hydrocarbon (PAH) exposure in northwest Gulf of Mexico marine fish and invertebrates: indicators of offshore petroleum contamination 

    E-Print Network [OSTI]

    Erickson, Cynthia Marie

    1994-01-01

    Higher molecular weight Polycyclic aromatic hydrocarbons (PAHS) associated with crude oil induce CYPIAI gene expression, and this response has been utilized as a biomarker of exposure to PAHs in aquatic and marine environments. Several benthic...

  11. Nitrated and oxygenated derivatives of polycyclic aromatic hydrocarbons in the ambient air of two

    E-Print Network [OSTI]

    Boyer, Edmond

    1 Nitrated and oxygenated derivatives of polycyclic aromatic hydrocarbons in the ambient air of two aromatic hydrocarbons, 17 nitrated PAHs (NPAHs) and 8 oxygenated PAHs (OPAHs) were carried out during hydrocarbons; Nitrated polycyclic aromatic hydrocarbons; Oxygenated polycyclic aromatic hydrocarbons

  12. Nitrated and oxygenated derivatives of polycyclic aromatic hydrocarbons in the ambient air of two

    E-Print Network [OSTI]

    Boyer, Edmond

    1 Nitrated and oxygenated derivatives of polycyclic aromatic hydrocarbons in the ambient air of two;2 Abstract The size distribution of polycyclic aromatic hydrocarbons (PAHs) and PAH derivatives of compounds. Keywords: Polycyclic aromatic hydrocarbons; Nitrated polycyclic aromatic hydrocarbons; Oxygenated

  13. Polycyclic Aromatic Hydrocarbon Biodegradation Rates: A

    E-Print Network [OSTI]

    Peters, Catherine A.

    Polycyclic Aromatic Hydrocarbon Biodegradation Rates: A Structure-Based Study K R I S T I N E H . W structure in determining the biodegradation rates of polycyclic aromatic hydrocarbons (PAHs). Laboratory. Introduction Polycyclic aromatic hydrocarbons (PAHs) are a class of organic pollutants that are commonly found

  14. Properties of polycyclic aromatic hydrocarbons in the northwest photon dominated region of NGC 7023. II. Traditional PAH analysis using k-means as a visualization tool

    SciTech Connect (OSTI)

    Boersma, C.; Bregman, J.; Allamandola, L. J.

    2014-11-10

    Polycyclic aromatic hydrocarbon (PAH) emission in the Spitzer-IRS spectral map of the northwest photon dominated region (PDR) in NGC 7023 is analyzed using the 'traditional' approach in which the PAH bands and plateaus between 5.2-19.5 ?m are isolated by subtracting the underlying continuum and removing H{sub 2} emission lines. The spectra are organized into seven spectroscopic bins by using k-means clustering. Each cluster corresponds to, and reveals, a morphological zone within NGC 7023. The zones self-organize parallel to the well-defined PDR front that coincides with an increase in intensity of the H{sub 2} emission lines. PAH band profiles and integrated strengths are measured, classified, and mapped. The morphological zones revealed by the k-means clustering provides deeper insight into the conditions that drive variations in band strength ratios and evolution of the PAH population that otherwise would be lost. For example, certain band-band relations are bifurcated, revealing two limiting cases; one associated with the PDR, the other with the diffuse medium. Traditionally, PAH band strength ratios are used to gain insight into the properties of the emitting PAH population, i.e., charge, size, structure, and composition. Insights inferred from this work are compared and contrasted to those from Boersma et al. (first paper in this series), where the PAH emission in NGC 7023 is decomposed exclusively using the PAH spectra and tools made available through the NASA Ames PAH IR Spectroscopic Database.

  15. Infrared Spectroscopy of Matrix-Isolated Polycyclic Aromatic Hydrocarbon Ions. 5. PAHs Incorporating a Cyclopentadienyl Ring

    E-Print Network [OSTI]

    Research Center, MS 245-6, Moffett Field, California 94035 J. C. Fetzer CheVron Research Company, Richmond) are the carriers of a very common family of interstellar infrared fluorescence bands. These emission features properties of PAHs under conditions relevant to the astrophysical problem. Of the experimental techniques

  16. Isomeric differentiation of polycyclic aromatic hydrocarbons using silver nitrate reactive desorption electrospray ionization

    E-Print Network [OSTI]

    Zare, Richard N.

    Isomeric differentiation of polycyclic aromatic hydrocarbons using silver nitrate reactive hydrocarbons (PAHs) are nonpolar and difficult to detect by desorption electrospray ionization. We present. Polycyclic aromatic hydrocarbons (PAHs) are one of the most prevalent forms of aquatic environmental

  17. Long-range transport of particulate polycyclic aromatic hydrocarbons at Cape Hedo remote island site in the East China Sea between 2005 and 2008

    E-Print Network [OSTI]

    2008-01-01

    of polycyclic aromatic hydrocarbons (PAHs) for 2004. Atmos.of polynuclear aromatic hydrocarbons in ambient air throughpolycyclic aromatic hydrocarbons in urban air of Hong Kong.

  18. Metabolism of mixtures of polycyclic aromatic hydrocarbons (PAHs) by Cunninghamella elegans 

    E-Print Network [OSTI]

    Olatubi, Oluwaseun Alfred

    2007-04-25

    of Phase I reactions or to the compound directly in certain cases. Enzymes of different phase II reactions include, glucronosyltransferases, sulfotransferases, methylation, N-acetyl transferases, but of more importance of the covalent bonds and to PAH... dehydrogenase in an oxidation reaction to give salicylate. This salicylate is then acted upon by salicylate-5-hydroxylase in an oxidation reaction to give gentisate, which finally goes into the intermediary metabolism. More commonly and of interest, salicylate...

  19. UV Irradiation of Polycyclic Aromatic Hydrocarbons in Ices

    E-Print Network [OSTI]

    UV Irradiation of Polycyclic Aromatic Hydrocarbons in Ices: Production of Alcohols, Quinones. Clemett,3 Richard N. Zare3 Polycyclic aromatic hydrocarbons (PAHs) in water ice were exposed to ultra, and ethers, and reduced, producing partially hydrogenated aromatic hydrocarbons, molecules that account

  20. THE ROLE OF POLYCYCLIC AROMATIC HYDROCARBONS IN ULTRAVIOLET EXTINCTION. I. PROBING SMALL MOLECULAR POLYCYCLIC AROMATIC HYDROCARBONS1

    E-Print Network [OSTI]

    THE ROLE OF POLYCYCLIC AROMATIC HYDROCARBONS IN ULTRAVIOLET EXTINCTION. I. PROBING SMALL MOLECULAR POLYCYCLIC AROMATIC HYDROCARBONS1 Geoffrey C. Clayton,2 Karl D. Gordon,3 F. Salama,4 L. J. Allamandola,4, with particular emphasis on a search for absorp- tion features produced by polycyclic aromatic hydrocarbons (PAHs

  1. Modeling personal particle-bound polycyclic aromatic hydrocarbon (pb-pah) exposure in human subjects in Southern California

    E-Print Network [OSTI]

    Wu, Jun; Tjoa, Thomas; Li, Lianfa; Jaimes, Guillermo; Delfino, Ralph J

    2012-01-01

    PAH exposures of each subject across all the samplingroot of average PAH exposures of each subject across all thesampling sessions (six subjects with only one-day of

  2. Author's personal copy The sedimentary fluxes of polycyclic aromatic hydrocarbons in the

    E-Print Network [OSTI]

    Zheng, Mei

    Author's personal copy The sedimentary fluxes of polycyclic aromatic hydrocarbons in the Yangtze aromatic hydrocarbons (PAHs) in two 210 Pb dated sediment cores from the coastal East China Sea, strongly flux; Source; Yangtze River Estuary coastal sea 1. Introduction Polycyclic aromatic hydrocarbons (PAHs

  3. DEUTERATED INTERSTELLAR POLYCYCLIC AROMATIC HYDROCARBONS1 E. Peeters,2,3

    E-Print Network [OSTI]

    DEUTERATED INTERSTELLAR POLYCYCLIC AROMATIC HYDROCARBONS1 E. Peeters,2,3 L. J. Allamandola,3 C. W aromatic hydrocarbons (PAHs). Two bands are detected in the infrared emission from the ionization bar fluorescence from UV-pumped, large polycyclic aromatic hydrocarbon molecules (PAHs; Allamandola, Tielens

  4. Toxicity cutoff of aromatic hydrocarbons for luminescence inhibition of Vibrio fischeri

    E-Print Network [OSTI]

    McFall-Ngai, Margaret

    Toxicity cutoff of aromatic hydrocarbons for luminescence inhibition of Vibrio fischeri So Polycyclic aromatic hydrocarbons a b s t r a c t Effects of individual petroleum hydrocarbons hydrocarbons, including benzene and its derivatives and polycyclic aromatic hydrocarbons (PAHs), were chosen

  5. Mass Transfer of Polynuclear Aromatic Hydrocarbons from

    E-Print Network [OSTI]

    Peters, Catherine A.

    ). Many PAHs are only sparingly soluble, and large volumes of water can therefore be contaminated by smallMass Transfer of Polynuclear Aromatic Hydrocarbons from Complex DNAPL Mixtures S U P A R N A M U K . * , Environmental and Water Resources Engineering, Department of Civil and Environmental Engineering, The University

  6. An investigation of the thermal degradation mechanisms of a waste tire through chemical analysis including hydrocarbons, benzene derivatives, and Polycyclic

    E-Print Network [OSTI]

    including hydrocarbons, benzene derivatives, and Polycyclic Aromatic Hydrocarbons (PAHs) at high temperature-to-Energy, Volatile Organic Carbons (VOCs), Polycyclic Aromatic Hydrocarbons (PAHs), Hetero-N containing PAH

  7. Low temperature formation of naphthalene and its role in the synthesis of PAHs (Polycyclic Aromatic

    E-Print Network [OSTI]

    Kaiser, Ralf I.

    Hydrocarbons) in the interstellar medium Dorian S. N. Parkera , Fangtong Zhanga , Y. Seol Kima , Ralf I, and approved October 26, 2011 (received for review August 24, 2011) Polycyclic aromatic hydrocarbons (PAHs finding challenges conventional wisdom that PAH-formation only occurs at high temperatures

  8. Secondary Organic Aerosol Formation From Aromatic Hydrocarbon

    E-Print Network [OSTI]

    Tang, Ping

    2013-01-01

    Jimenez, J.L. , 2005. Hydrocarbon- like and oxygenatedoxidation of aromatic hydrocarbons in the presence of drySummary of aromatic hydrocarbon photooxidation experiments

  9. Ambient aromatic hydrocarbon measurements at Welgegund, South Africa

    E-Print Network [OSTI]

    2014-01-01

    Ambient aromatic hydrocarbon measurements at Welgegund,Ambient aromatic hydrocarbon measurements at Welgegund,Ambient aromatic hydrocarbon measurements at Welgegund,

  10. Black carbon in marine sediments : quantification and implications for the sorption of polycyclic aromatic hydrocarbons

    E-Print Network [OSTI]

    Accardi-Dey, AmyMarie, 1976-

    2003-01-01

    Sorption is a key factor in determining the fate of polycyclic aromatic hydrocarbons (PAHs) in the environment. Here, PAH sorption is proposed as the sum of two mechanisms: absorption into a biogenic, organic carbon (OC) ...

  11. Bacterial mutagenicity of polycyclic aromatic hydrocarbons in reconstituted mixtures and crude coal tar extracts and fractions 

    E-Print Network [OSTI]

    Onufrock, Amy Mildred

    1994-01-01

    Although polycyclic aromatic hydrocarbons (PAHS) are one of the most ubiquitous carcinogens in the environment, little is known regarding their potential mutagenic interactions. Risk assessment of complex PAH mixtures ...

  12. THE MID-INFRARED ABSORPTION SPECTRA OF NEUTRAL POLYCYCLIC AROMATIC HYDROCARBONS IN CONDITIONS RELEVANT TO DENSE INTERSTELLAR CLOUDS

    E-Print Network [OSTI]

    THE MID-INFRARED ABSORPTION SPECTRA OF NEUTRAL POLYCYCLIC AROMATIC HYDROCARBONS IN CONDITIONS; accepted 2005 June 17 ABSTRACT Polycyclic aromatic hydrocarbons (PAHs) are common throughout the universe. INTRODUCTION Polycyclic aromatic hydrocarbons (PAHs) and related aro- matic materials are thought to be present

  13. Biodegradation of Bicyclic and Polycyclic Aromatic Hydrocarbons in

    E-Print Network [OSTI]

    Rockne, Karl J.

    Biodegradation of Bicyclic and Polycyclic Aromatic Hydrocarbons in Anaerobic Enrichments K A R L J contaminated sediments are anaerobic. With recent results demonstrating that some bicyclics and PAHs can for aerobic cultures. These results show that bicyclics and PAHs can be biodegraded under nitrate- and sulfate

  14. First detection of an ultraviolet transition in an ionized polycyclic aromatic hydrocarbon

    E-Print Network [OSTI]

    ; accepted 3 May 1999 We report the first measurement of a polycyclic aromatic hydrocarbon cation electronicFirst detection of an ultraviolet transition in an ionized polycyclic aromatic hydrocarbon Xavier D of Physics. S0021-9606 99 02226-6 I. INTRODUCTION Polycyclic aromatic hydrocarbon PAH ions are prom- ising

  15. THE INFRARED SPECTROSCOPY OF NEUTRAL POLYCYCLIC AROMATIC HYDROCARBON CLUSTERS

    SciTech Connect (OSTI)

    Ricca, Alessandra; Bauschlicher, Charles W. Jr.; Allamandola, Louis J. E-mail: Charles.W.Bauschlicher@nasa.gov

    2013-10-10

    The mid-infrared spectra of neutral homogeneous polycyclic aromatic hydrocarbon (PAH) clusters have been computed using density functional theory including an empirical correction for dispersion. The C-H out-of-plane bending modes are redshifted for all the clusters considered in this work. The magnitude of the redshift and the peak broadening are dependent on PAH size, shape, and on the PAH arrangement in the cluster.

  16. Sampling precautions for the measurement of nitrated polycyclic aromatic hydrocarbons in ambient air

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1 Sampling precautions for the measurement of nitrated polycyclic aromatic hydrocarbons in ambient of polycyclic aromatic hydrocarbons (PAHs) and of their oxidation products, such as nitrated and oxygenated PAHs samplers (cascade impactor and conventional high volume sampler) installed in parallel during several field

  17. Molecular catalytic hydrogenation of aromatic hydrocarbons and...

    Office of Scientific and Technical Information (OSTI)

    hydrogenation of aromatic hydrocarbons and hydrotreating of coal liquids. Citation Details In-Document Search Title: Molecular catalytic hydrogenation of aromatic hydrocarbons and...

  18. THE UNUSUAL HYDROCARBON EMISSION FROM THE EARLY CARBON STAR HD 100764: THE CONNECTION BETWEEN AROMATICS AND ALIPHATICS

    E-Print Network [OSTI]

    Sloan, Gregory C.

    THE UNUSUAL HYDROCARBON EMISSION FROM THE EARLY CARBON STAR HD 100764: THE CONNECTION BETWEEN disk. The spectrum shows emission features from polycyclic aro- matic hydrocarbons (PAHs shifts are consistent with hydrocarbon mixtures containing both aromatic and aliphatic bonds. We propose

  19. Long-Range Atmospheric Transport of Polycyclic Aromatic Hydrocarbons: A Global 3-D Model Analysis Including Evaluation of Arctic Sources

    E-Print Network [OSTI]

    Friedman, Carey

    We use the global 3-D chemical transport model GEOS-Chem to simulate long-range atmospheric transport of polycyclic aromatic hydrocarbons (PAHs). To evaluate the model’s ability to simulate PAHs with different volatilities, ...

  20. POLYCYCLIC AROMATIC HYDROCARBONS AS A TRACER OF STAR FORMATION? NASA Ames Research Center, Mail Stop 245-6, Moffett Field, CA 94035; epeeters@mail.arc.nasa.gov

    E-Print Network [OSTI]

    Spoon, Henrik

    POLYCYCLIC AROMATIC HYDROCARBONS AS A TRACER OF STAR FORMATION? E. Peeters NASA Ames Research) pumped large polycyclic aromatic hydrocarbon (PAH) molecules. As such, these features trace the FUV of polycyclic aromatic hydrocarbons (PAHs) containing '50 carbon atoms (Le´ger & Puget 1984; Allamandola et al

  1. Aromatic and polycyclic aromatic hydrocarbon formation in a laminar premixed n-butane flame

    SciTech Connect (OSTI)

    Marinov, N.M.; Pitz, W.J.; Westbrook, C.K.; Vincitore, A.M.; Castaldi, M.J.; Senkan, S.M.; Melius, C.F.

    1998-07-01

    Experimental and detailed chemical kinetic modeling work has been performed to investigate aromatic and polycyclic aromatic hydrocarbon (PAH) formation pathways in a premixed, rich, sooting, n-butane-oxygen-argon burner stabilized flame. An atmospheric pressure, laminar flat flame operated at an equivalence ratio of 2.6 was used to acquire experimental data for model validation. Gas composition analysis was conducted by an on-line gas chromatograph/mass spectrometer technique. Measurements were made in the main reaction and post-reaction zones for a number of low molecular weight species, aliphatics, aromatics, and polycyclic aromatic hydrocarbons (PAHs) ranging from two to five-fused aromatic rings. Reaction flux and sensitivity analysis were used to help identify the important reaction sequences leading to aromatic and PAH growth and destruction in the n-butane flame. Reaction flux analysis showed the propargyl recombination reaction was the dominant pathway to benzene formation. The consumption of propargyl by H atoms was shown to limit propargyl, benzene, and naphthalene formation in flames as exhibited by the large negative sensitivity coefficients. Naphthalene and phenanthrene production was shown to be plausibly formed through reactions involving resonantly stabilized cyclopentadienyl and indenyl radicals. Many of the low molecular weight aliphatics, combustion by-products, aromatics, branched aromatics, and PAHs were fairly well simulated by the model. Additional work is required to understand the formation mechanisms of phenyl acetylene, pyrene, and fluoranthene in the n-butane flame. 73 refs.

  2. Emission of polycyclic aromatic hydrocarbons in China

    SciTech Connect (OSTI)

    Shanshan Xu; Wenxin Liu; Shu Tao [Peking University, Beijing (China). Laboratory for Earth Surface Processes, College of Environmental Sciences

    2006-02-01

    Emission of 16 polycyclic aromatic hydrocarbons (PAHs) listed as U.S. Environmental Protection Agency (U.S. EPA) priority pollutants from major sources in China were compiled. Geographical distribution and temporal change of the PAH emission, as well as emission profiles, are discussed. It was estimated that the total PAH emission in China was 25,300 tons in 2003. The emission profile featured a relatively higher portion of high molecular weight (HMW) species with carcinogenic potential due to large contributions of domestic coal and coking industry. Among various sources, biomass burning, domestic coal combustion, and the coking industry contributed 60%, 20%, and 16% of the total emission, respectively. Total emission, emission density, emission intensity, and emission per capita showed geographical variations. In general, the southeastern provinces were characterized by higher emission density, while those in western and northern China featured higher emission intensity and population-normalized emission. Although energy consumption in China went up continuously during the past two decades, annual emission of PAHs fluctuated depending on the amount of domestic coal consumption, coke production, and the efficiency of energy utilization. 47 refs., 6 figs.

  3. QSAR model of the phototoxicity of polycyclic aromatic hydrocarbons Fabiana Alves de Lima Ribeiro, Marcia Miguel Castro Ferreira*

    E-Print Network [OSTI]

    Ferreira, Márcia M. C.

    QSAR model of the phototoxicity of polycyclic aromatic hydrocarbons Fabiana Alves de Lima Ribeiro of 67 polycyclic aromatic hydrocarbons (PAHs) is performed and a prediction rule for the phototoxicity be produced from saturated hydrocarbons under oxygen-deficient conditions. Hydrocarbons with very low

  4. Polycyclic Aromatic Hydrocarbons and n-alkanes in sediments of the Upper Scheldt River Basin: contamination levels and source apportionment

    E-Print Network [OSTI]

    Boyer, Edmond

    Polycyclic Aromatic Hydrocarbons and n-alkanes in sediments of the Upper Scheldt River Basin hydrocarbons (PAHs). Total n-alkane and PAH concentrations in all the sampled cores ranged from 2.8 to 29 mg kg European Research Program for trace metals in river sediments 6,7 , but data on hydrocarbon contamination

  5. Reduction of Aromatic Hydrocarbons by Zero-Valent Iron and Palladium Catalyst

    SciTech Connect (OSTI)

    Kim, Young-Hun; Shin, Won Sik; Ko, Seok-Oh; Kim, Myung-Chul

    2004-03-31

    Permeable reactive barrier (PRB) is an alternative technology for soil and groundwater remediation. Zero valent iron, which is the most popular PRB material, is only applicable to halogenated aliphatic organics and some heavy metals. The objective of this study was to investigate reductive dechlorination of halogenated compounds and reduction of non-halogenated aromatic hydrocarbons using zero valent metals (ZVMs) and catalysts as reactive materials for PRBs. A group of small aromatic hydrocarbons such as monochlorophenols, phenol and benzene were readily reduced with palladium catalyst and zero valent iron. Poly-aromatic hydrocarbons (PAHs) were also tested with the catalysts and zero valent metal combinations. The aromatic rings were reduced and partly reduced PAHs were found as the daughter compounds. The current study demonstrates reduction of aromatic compounds by ZVMs and modified catalysts and implicates that PRB is applicable not only for halogenated organic compounds but nonhalogenated aromatic compounds such as PAHs.

  6. Cardiac toxicity of 5-ring polycyclic aromatic hydrocarbons is differentially dependent on the aryl hydrocarbon receptor 2 isoform during zebrafish development

    E-Print Network [OSTI]

    Cardiac toxicity of 5-ring polycyclic aromatic hydrocarbons is differentially dependent on the aryl hydrocarbon receptor 2 isoform during zebrafish development John P. Incardona , Tiffany L. Linbo, Nathaniel L aromatic hydrocarbons (PAHs), commonly occur as com- plex mixtures in the environment. Recent studies using

  7. Experimental and modeling investigation of aromatic and polycyclic aromatic hydrocarbon formation in a premixed ethylene flame

    SciTech Connect (OSTI)

    Castaldi, M.J.; Marinov, N.M.; Melius, C.F.

    1996-02-01

    Experimental and detailed chemical kinetic modeling has been performed to investigate aromatic and polyaromatic hydrocarbon formation pathways in a rich, sooting, ethylene-oxygen-argon premixed flame. An atmospheric pressure, laminar flat flame operated at an equivalence ratio of 2.5 was used to acquire experimental data for model validation. Gas composition analysis was conducted by an on-line gas chromatograph/mass spectrometer (GC/MS) technique. Measurements were made in the flame and post-flame zone for a number of low molecular weight species, aliphatics, aromatics and polycyclic aromatic hydrocarbons (PAHs) ranging from two to five-aromatic fused rings. The modeling results show the key reaction sequences leading to aromatic and polycyclic aromatic hydrocarbon growth involve the combination of resonantly stabilized radicals. In particular, propargyl and 1-methylallenyl combination reactions lead to benzene and methyl substituted benzene formation, while polycyclic aromatics are formed from cyclopentadienyl radicals and fused rings that have a shared C{sub 5} side structure. Naphthalene production through the reaction step of cyclopentadienyl self-combination and phenanthrene formation from indenyl and cyclopentadienyl combination were shown to be important in the flame modeling study. The removal of phenyl by O{sub 2} leading to cyclopentadienyl formation is expected to play a pivotal role in the PAH or soot precursor growth process under fuel-rich oxidation conditions.

  8. doi:10.1016/j.gca.2004.09.009 Alkylation of polycyclic aromatic hydrocarbons in carbonaceous chondrites

    E-Print Network [OSTI]

    Zare, Richard N.

    doi:10.1016/j.gca.2004.09.009 Alkylation of polycyclic aromatic hydrocarbons in carbonaceous hydrocarbons (PAHs) in the free organic material of 20 carbonaceous chondrites. These meteorites represent, is in a solvent-extractable form containing aromatic and aliphatic hydrocarbons, amino acids, and other compounds

  9. Molecular catalytic hydrogenation of aromatic hydrocarbons and

    Office of Scientific and Technical Information (OSTI)

    catalytic hydrogenation of aromatic hydrocarbons and hydrotreating of coal liquids. Yang, Shiyong; Stock, L.M. 01 COAL, LIGNITE, AND PEAT; 40 CHEMISTRY; COAL LIQUIDS;...

  10. Advances in PAHs/nitro-PAHs fractioning Aurea Andrade-Eiroa,* Valerie Leroy and Philippe Dagaut

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    hydrocarbons (nitro-PAHs) and polycyclic aromatic hydrocarbons (PAHs). Unlike what usually occurs under polarizability. 1. Introduction The detection and characterization of polycyclic aromatic hydrocarbons (PAHs and nitro-PAHs is not possible by using the conventional methods aforementioned. Moreover, all

  11. LARGE ABUNDANCES OF POLYCYCLIC AROMATIC HYDROCARBONS IN TITAN'S UPPER ATMOSPHERE

    SciTech Connect (OSTI)

    Lopez-Puertas, M.; Funke, B.; Garcia-Comas, M.; Dinelli, B. M.; Adriani, A.; D'Aversa, E.; Moriconi, M. L.; Boersma, C.; Allamandola, L. J.

    2013-06-20

    In this paper, we analyze the strong unidentified emission near 3.28 {mu}m in Titan's upper daytime atmosphere recently discovered by Dinelli et al. We have studied it by using the NASA Ames PAH IR Spectroscopic Database. The polycyclic aromatic hydrocarbons (PAHs), after absorbing UV solar radiation, are able to emit strongly near 3.3 {mu}m. By using current models for the redistribution of the absorbed UV energy, we have explained the observed spectral feature and have derived the vertical distribution of PAH abundances in Titan's upper atmosphere. PAHs have been found to be present in large concentrations, about (2-3) Multiplication-Sign 10{sup 4} particles cm{sup -3}. The identified PAHs have 9-96 carbons, with a concentration-weighted average of 34 carbons. The mean mass is {approx}430 u; the mean area is about 0.53 nm{sup 2}; they are formed by 10-11 rings on average, and about one-third of them contain nitrogen atoms. Recently, benzene together with light aromatic species as well as small concentrations of heavy positive and negative ions have been detected in Titan's upper atmosphere. We suggest that the large concentrations of PAHs found here are the neutral counterpart of those positive and negative ions, which hence supports the theory that the origin of Titan main haze layer is located in the upper atmosphere.

  12. MNRAS 448, 168187 (2015) doi:10.1093/mnras/stu2715 The relationship between polycyclic aromatic hydrocarbon emission and

    E-Print Network [OSTI]

    Baes, Maarten

    2015-01-01

    hydrocarbon emission and far-infrared dust emission from NGC 2403 and M83 A. G. Jones,1 between polycyclic aromatic hydrocarbon (PAH) emission at 8 µm and far-infrared emission from hot dust with the stellar surface brightness as measured at 3.6 µm. This implies that the PAHs in NGC 2403 are intermixed

  13. Tenax as sorption sink for in vitro bioaccessibility measurement of polycyclic aromatic hydrocarbons in soils

    E-Print Network [OSTI]

    Ma, Lena

    hydrocarbons in soils Chao Li a , XinÀYi Cui a, * , YingÀYing Fan a , Ying Teng b , ZhongÀRen Nan c , Lena Q and maintain the desorption gradient between soil and GI solution. Polycyclic aromatic hydrocarbons (PAHs) were

  14. Effectiveness of in site biodegradation for the remediation of polycyclic aromatic hydrocarbons at a contaminated oil refinery, Port Arthur, Texas 

    E-Print Network [OSTI]

    Moffit, Alfred Edward

    2000-01-01

    The effectiveness of bioremediation for the removal of polycyclic aromatic hydrocarbons (PAHs) from sediments contaminated with highly weathered petroleum was evaluated at a contaminated oil refinery. The sediments were chronically contaminated...

  15. Assessing the Influence of Secondary Organic versus Primary Carbonaceous Aerosols on Long-Range Atmospheric Polycyclic Aromatic Hydrocarbon Transport

    E-Print Network [OSTI]

    Pierce, J. R.

    We use the chemical transport model GEOS-Chem to evaluate the hypothesis that atmospheric polycyclic aromatic hydrocarbons (PAHs) are trapped in secondary organic aerosol (SOA) as it forms. We test the ability of three ...

  16. Aromaticity of Polycyclic Conjugated Hydrocarbons Milan Randic*

    E-Print Network [OSTI]

    Ferreira, Márcia M. C.

    Aromaticity of Polycyclic Conjugated Hydrocarbons Milan Randic´* National Institute of Chemistry Chemistry 3462 G. Clar 6n Rule versus Hu¨ckel 4n + 2 Rule 3464 H. Hydrocarbons versus Heteroatomic Systems Ordering 3476 VI. On Enumeration of Benzenoid Hydrocarbons 3477 VII. Kekule´ Valence Structures Count 3479

  17. Polynuclear aromatic hydrocarbons for fullerene synthesis in flames

    DOE Patents [OSTI]

    Alford, J. Michael; Diener, Michael D.

    2006-12-19

    This invention provides improved methods for combustion synthesis of carbon nanomaterials, including fullerenes, employing multiple-ring aromatic hydrocarbon fuels selected for high carbon conversion to extractable fullerenes. The multiple-ring aromatic hydrocarbon fuels include those that contain polynuclear aromatic hydrocarbons. More specifically, multiple-ring aromatic hydrocarbon fuels contain a substantial amount of indene, methylnapthalenes or mixtures thereof. Coal tar and petroleum distillate fractions provide low cost hydrocarbon fuels containing polynuclear aromatic hydrocarbons, including without limitation, indene, methylnapthalenes or mixtures thereof.

  18. Effects of episodic disturbances on microbial degradation of polycyclic aromatic hydrocarbons (PAHs) in coastal sediments. Final report, 1 July 1993-31 December 1996

    SciTech Connect (OSTI)

    Taylor, G.; Brownawell, B.; Lopez, G.; LeBlanc, L.; Gulnick, J.

    1996-12-31

    To examine the effect of disturbance on bacterial PAH transformation in sediments, C14 labeled sediment was resuspended into an oxic overlying water column in a flowthrough microcosm system (I-SORES) at resuspension frequencies of 8-12, 4, 1, 0.25 and 0 1/d. Rates of mineralization of C14 naphthalene, phenanthrene and benzo(a)pyrene, modeled as first order processes, were found to increase, along with cumulative mineralization as a function of resuspension frequency. Flux of dissolved compound from the bed was also found to increase with increasing resuspension for all compounds. For the most quiescent treatments (0 and 0.25 1/d ), multi-order kinetics suggested acclimation of bacterial populations. First order rate constants normalized to the fraction of bioavailable solute in pore waters were within an order of magnitude for all three compounds which span three orders of magnitude in hydrophobicity, suggesting that bioavailability is an important control on mineralization. Similarities in the rate and extent of mineralization between naphthalene and phenanthrene was explained by a greater resistance to desorption for naphthalene relative to phenanthrene. Model predictions of phenanthrene mineralization rates, based upon the degree of oxygenation in the different treatments, bracketed measured rates, demonstrating oxygen`s control over mineralization.

  19. Design and Applications of Anti Albumin-Adduct Antibodies to Assess Human Exposure to Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Chung, Ming Kei

    2013-01-01

    measurement  of  polycyclic  aromatic  hydrocarbon-­?before  measurement  of  hydrocarbon-­?HSA  adducts   with  measurement  of  polycyclic  aromatic  hydrocarbon-­?

  20. Simultaneous analysis of oxygenated and nitrated polycylic aromatic hydrocarbons on standard reference material 1649a (urban dust) and

    E-Print Network [OSTI]

    Boyer, Edmond

    1 Simultaneous analysis of oxygenated and nitrated polycylic aromatic hydrocarbons on standard nitrated polycylic aromatic hydrocarbons (NPAHs) and 9 oxygenated polycylic aromatic hydrocarbons (OPAHs aromatic hydrocarbons; Nitrated polycyclic aromatic hydrocarbons; Oxygenated polycyclic aromatic

  1. An investigation of the thermal degradation mechanisms of a waste tire through chemical analysis including hydrocarbons, benzene derivatives, and Polycyclic

    E-Print Network [OSTI]

    Columbia University

    including hydrocarbons, benzene derivatives, and Polycyclic Aromatic Hydrocarbons (PAHs) at high temperature a GC/MS. Significant Volatile Organic Carbons (VOCs) including benzene derivatives, PAHs, and Hetero

  2. A study on the coagulation of polycyclic aromatic hydrocarbon clusters to determine their collision efficiency

    SciTech Connect (OSTI)

    Raj, Abhijeet; Sander, Markus; Janardhanan, Vinod; Kraft, Markus [Department of Chemical Engineering and Biotechnology, University of Cambridge, New Museums Site, Pembroke Street, Cambridge CB2 3RA (United Kingdom)

    2010-03-15

    This paper presents a theoretical study on the physical interaction between polycyclic aromatic hydrocarbons (PAHs) and their clusters of different sizes in laminar premixed flames. Two models are employed for this study: a detailed PAH growth model, referred to as the kinetic Monte Carlo - aromatic site (KMC-ARS) model [Raj et al., Combust. Flame 156 (2009) 896-913]; and a multivariate PAH population balance model, referred to as the PAH - primary particle (PAH-PP) model. Both the models are solved by kinetic Monte Carlo methods. PAH mass spectra are generated using the PAH-PP model, and compared to the experimentally observed spectra for a laminar premixed ethylene flame. The position of the maxima of PAH dimers in the spectra and their concentrations are found to depend strongly on the collision efficiency of PAH coagulation. The variation in the collision efficiency with various flame and PAH parameters is studied to determine the factors on which it may depend. A correlation for the collision efficiency is proposed by comparing the computed and the observed spectra for an ethylene flame. With this correlation, a good agreement between the computed and the observed spectra for a number of laminar premixed ethylene flames is found. (author)

  3. Isomer discrimination of polycyclic aromatic hydrocarbons in the Murchison meteorite by resonant ionization

    E-Print Network [OSTI]

    de Vries, Mattanjah S.

    Isomer discrimination of polycyclic aromatic hydrocarbons in the Murchison meteorite by resonant;Abstract We have used two-color resonant two-photon ionization (2C-R2PI) mass spectrometry to discriminate demonstrated isomer discrimination of PAHs by chemical ionization mass spectrometry with carbon dioxide

  4. 1 Solvent-Extractable Polycyclic Aromatic Hydrocarbons in Biochar: 2 Influence of Pyrolysis Temperature and Feedstock

    E-Print Network [OSTI]

    1 Solvent-Extractable Polycyclic Aromatic Hydrocarbons in Biochar: 2 Influence of Pyrolysis, it is not known how variations in pyrolysis temperature and feedstock type 13 affect concentration and composition to pyrolytic products. Further research 25 is needed to characterize the PAH evolution in modern pyrolysis

  5. Threshold Energies for Single Carbon Knockout from Polycyclic Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Stockett, M H; Chen, T; de Ruette, N; Giacomozzi, L; Wolf, M; Schmidt, H T; Zettergren, H; Cederquist, H

    2015-01-01

    We have measured absolute cross sections for ultrafast (fs) single-carbon knockout from Polycyclic Aromatic Hydrocarbon (PAH) cations as functions of He-PAH center-of-mass collision energy in the range 10-200 eV. Classical Molecular Dynamics (MD) simulations cover this range and extend up to 10$^5$ eV. The shapes of the knockout cross sections are well described by a simple analytical expression yielding experimental and MD threshold energies of $E_{th}^{Exp}=32.5\\pm 0.4$ eV and $E_{th}^{MD}=41.0\\pm 0.3$ eV, respectively. These are the first measurements of knockout threshold energies for molecules isolated \\emph{in vacuo}. We further deduce semi-empirical (SE) and MD displacement energies --- \\emph{i.e.} the energy transfers to the PAH molecules at the threshold energies for knockout --- of $T_{disp}^{SE}=23.3\\pm 0.3$ eV and $T_{disp}^{MD}=27.0\\pm 0.3$ eV. The semi-empirical results compare favorably with measured displacement energies for graphene $T_{disp}=23.6$ eV [Meyer \\emph{et al.} Phys. Rev Lett. \\tex...

  6. Monitoring of vapor phase polycyclic aromatic hydrocarbons

    DOE Patents [OSTI]

    Vo-Dinh, Tuan; Hajaligol, Mohammad R.

    2004-06-01

    An apparatus for monitoring vapor phase polycyclic aromatic hydrocarbons in a high-temperature environment has an excitation source producing electromagnetic radiation, an optical path having an optical probe optically communicating the electromagnetic radiation received at a proximal end to a distal end, a spectrometer or polychromator, a detector, and a positioner coupled to the first optical path. The positioner can slidably move the distal end of the optical probe to maintain the distal end position with respect to an area of a material undergoing combustion. The emitted wavelength can be directed to a detector in a single optical probe 180.degree. backscattered configuration, in a dual optical probe 180.degree. backscattered configuration or in a dual optical probe 90.degree. side scattered configuration. The apparatus can be used to monitor an emitted wavelength of energy from a polycyclic aromatic hydrocarbon as it fluoresces in a high temperature environment.

  7. Polycyclic Aromatic Hydrocarbons in Indoor Air and Environmental Tobacco Smoke Measured with a New Integrated Organic Vapor-Particle Sampler

    E-Print Network [OSTI]

    Gundel, L.A.; Daisey, J.M.; Mahanama, K.R.R.; Lee, C.C.; Stevens, R.K.

    1993-01-01

    of polycyclic aromatic hydrocarbons in environmental tobaccoof polycyclic aromatic hydrocarbons. Indoor Air 1991;1:497-NK. Polycyclic aromatic hydrocarbons and their derivatives

  8. Real-time characterization of particle-bound polycyclic aromatic hydrocarbons in ambient aerosols and from motor-vehicle exhaust

    E-Print Network [OSTI]

    Polidori, A.; Hu, S.; Biswas, S.; Delfino, R. J; Sioutas, C.

    2008-01-01

    of polycyclic aromatic hydrocarbons in coupled out- door/polycyclic aromatic hydrocarbon concentration in combustionbound polycyclic aromatic hydrocarbons K. A. , Morris, J. ,

  9. Critically Evaluated Thermochemical Properties of Polycyclic Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Chickos, James S.

    values for these thermochemical properties and for the enthalpies of formation in the gas state at T=298Critically Evaluated Thermochemical Properties of Polycyclic Aromatic Hydrocarbons María Victoria Experimental thermochemical properties of benzene, toluene, and 63 polycyclic aro- matic hydrocarbons

  10. Synergistic effect of mixing dimethyl ether with methane, ethane, propane, and ethylene fuels on polycyclic aromatic hydrocarbon and soot formation

    SciTech Connect (OSTI)

    Yoon, S.S.; Anh, D.H.; Chung, S.H.

    2008-08-15

    Characteristics of polycyclic aromatic hydrocarbon (PAH) and soot formation in counterflow diffusion flames of methane, ethane, propane, and ethylene fuels mixed with dimethyl ether (DME) have been investigated. Planar laser-induced incandescence and fluorescence techniques were employed to measure relative soot volume fractions and PAH concentrations, respectively. Results showed that even though DME is known to be a clean fuel in terms of soot formation, DME mixture with ethylene fuel increases PAH and soot formation significantly as compared to the pure ethylene case, while the mixture of DME with methane, ethane, and propane decreases PAH and soot formation. Numerical calculations adopting a detailed kinetics showed that DME can be decomposed to produce a relatively large number of methyl radicals in the low-temperature region where PAH forms and grows; thus the mixture of DME with ethylene increases CH{sub 3} radicals significantly in the PAH formation region. Considering that the increase in the concentration of O radicals is minimal in the PAH formation region with DME mixture, the enhancement of PAH and soot formation in the mixture flames of DME and ethylene can be explained based on the role of methyl radicals in PAH and soot formation. Methyl radicals can increase the concentration of propargyls, which could enhance incipient benzene ring formation through the propargyl recombination reaction and subsequent PAH growth. Thus, the result substantiates the importance of methyl radicals in PAH and soot formation, especially in the PAH formation region of diffusion flames. (author)

  11. Enhancement of PAH biomineralization rates by cyclodextrins under Fe(III)-reducing conditions

    E-Print Network [OSTI]

    Ramsay, Juliana

    biodegradation whereby the indi- genous microorganisms degrade the contaminants without intervention. However. Keywords: Cyclodextrin; Fe(III) reduction; Mineralization; PAH bioavailability; Polyaromatic hydrocarbons 1. Introduction Since polycyclic aromatic hydrocarbons (PAHs) are potentially toxic, mutagenic, and carcinogenic

  12. Trends in polycyclic aromatic hydrocarbon concentrations in the Great Lakes atmosphere

    SciTech Connect (OSTI)

    Ping Sun; Pierrette Blanchard; Kenneth A. Brice; Ronald A. Hites [Indiana University, Bloomington, IN (United States). School of Public and Environmental Affairs

    2006-10-15

    Atmospheric polycyclic aromatic hydrocarbon (PAHs) concentrations were measured in both the vapor and particle phases at seven sites near the Great Lakes as a part of the Integrated Atmospheric Deposition Network. Lower molecular weight PAHs, including fluorene, phenanthrene, fluoranthrene, and pyrene, were dominant in the vapor phase, and higher molecular weight PAHs, including chrysene, benzo(a)pyrene, and coronene, were dominant in the particle phase. The highest PAH concentrations in both the vapor and particle phases were observed in Chicago followed by the semiurban site at Sturgeon Point, NY. The major sources of PAHs in and around Chicago are vehicle emissions, coal and natural gas combustion, and coke production. The spatial difference of PAH concentrations can be explained by the local population density. Long-term decreasing trends of most PAH concentrations were observed in both the vapor and particle phases at Chicago, with half-lives ranging from 3-10 years in the vapor phase and 5-15 years in the particle phase. At Eagle Harbor, Sleeping Bear Dunes, and Sturgeon Point, total PAH concentrations in the vapor phase showed significant, but slow, long-term decreasing trends. At the Sturgeon Point site, which was impacted by a nearby city, particle-phase PAH concentrations also declined. However, most particle-phase PAH concentrations did not show significant long-term decreasing trends at the remote sites. Seasonal trends were also observed for particle-phase PAH concentrations, which were higher in the winter and lower in the summer. 36 refs., 4 figs., 1 tab.

  13. Continuous removal of polynuclear aromatics from hydrocarbon recycle oil

    SciTech Connect (OSTI)

    Bosserman, P.J.; Taniguchi, V.T.

    1992-06-23

    This patent describes an oil refining process. It comprises forming a liquid capable of solubilizing aromatic compounds having at least about 5 fused aromatic rings; and catalytically hydrocracking a hydrocarbon feedstock by: contacting the feedstock in a hydrocracking zone with added hydrogen and a hydrocracking zone with added hydrogen and a hydrocracking catalyst at a temperature and pressure sufficient to give a substantial conversion to lower boiling products; and condensing a hydrocarbon effluent from the hydrocracking zone and separating the condensed effluent into (AA) a low boiling hydrocarbon product and (BB) an unconverted hydrocarbon oil containing one or more fused polynuclear aromatic compounds.

  14. Properties of polycyclic aromatic hydrocarbons in local elliptical galaxies revealed by the Infrared Spectrograph on Spitzer

    E-Print Network [OSTI]

    H. Kaneda; T. Onaka; I. Sakon; T. Kitayama; Y. Okada; T. Suzuki

    2008-05-21

    We performed mid-infrared spectroscopic observations of 18 local dusty elliptical galaxies by using the Infrared Spectrograph (IRS) on board Spitzer. We have significantly detected polycyclic aromatic hydrocarbon (PAH) features from 14 out of the 18 galaxies, and thus found that the presence of PAHs is not rare but rather common in dusty elliptical galaxies. Most of these galaxies show an unusually weak 7.7 um emission feature relative to 11.3 um and 17 um emission features. A large fraction of the galaxies also exhibit H2 rotational line and ionic fine-structure line emissions, which have no significant correlation with the PAH emissions. The PAH features are well correlated with the continuum at 35 um, whereas they are not correlated with the continuum at 6 um. We conclude that the PAH emission of the elliptical galaxies is mostly of interstellar origin rather than of stellar origin, and that the unusual PAH interband strength ratios are likely to be due to a large fraction of neutral to ionized PAHs.

  15. Dust and Polycyclic Aromatic Hydrocarbon in the HD 34700 Debris Disk

    E-Print Network [OSTI]

    Seok, Ji Yeon

    2015-01-01

    The debris disk around the Vega-type star HD 34700 is detected in dust thermal emission from the near infrared (IR) to millimeter (mm) and submm wavelength range. Also detected is a distinct set of emission features at 3.3, 6.2, 7.7, 8.6, 11.3 and 12.7 $\\mu$m, which are commonly attributed to polycyclic aromatic hydrocarbon (PAH) molecules. We model the observed dust IR spectral energy distribution (SED) and PAH emission features of the HD 34700 disk in terms of porous dust and astronomical-PAHs. Porous dust together with a mixture of neutral and ionized PAHs closely explains the dust IR SED and PAH emission features observed in the HD 34700 disk. Due to the stellar radiation pressure and Poynting-Robertson drag together with the photodissociation of PAHs, substantial removal of dust and PAHs has occurred in the disk, and continuous replenishment of these materials is required to maintain their current abundances. This implies that these materials are not primitive but secondary products probably originating ...

  16. Anisotropy and Size Effects on the Optical Spectra of Polycyclic Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Caterina Cocchi; Deborah Prezzi; Alice Ruini; Marilia J. Caldas; Elisa Molinari

    2014-09-08

    The electronic and optical properties of polycyclic aromatic hydrocarbons (PAHs) present a strong dependence on their size and geometry. We tackle this issue by analyzing the spectral features of two prototypical classes of PAHs, belonging to D6h and D2h symmetry point groups and related to coronene as multifunctional seed. While the size variation induces an overall red shift of the spectra and a redistribution of the oscillator strength between the main peaks, a lower molecular symmetry is responsible for the appearance of new optical features. Along with broken molecular orbital degeneracies, optical peaks split and dark states are activated in the low-energy part of the spectrum. Supported by a systematic analysis of the composition and the character of the optical transitions, our results contribute in shedding light to the mechanisms responsible for spectral modifications in the visible and near UV absorption bands of medium-size PAHs.

  17. Spatial and temporal variation of polynuclear aromatic hydrocarbons, pesticides, and polychlorinated biphenyls in Crassostrea virginica and sediments from Galveston Bay, Texas 

    E-Print Network [OSTI]

    Fox, Richard George

    1988-01-01

    , such as pesticides and polychlorinated biphenyls (PCBs), enter coastal environments from riverine discharge, coastal sewage effluents, industrial wastes, runoff, and as aerosols (NAS, 1979 and Rapaport et al. , 1985). Polynuclear aromatic hydrocarbons (PAHs...SPATIAL AND TEMPORAL VARIATION OF POLYNUCLEAR AROMATIC HYDROCARBONS, PESTICIDES, AND POLYCHLORINATED BIPHENYLS IN CRASSOSTREA VZRGINICA AND SEDIMENTS FROM GALVESTON BAY, TEXAS A Thesis by RICHARD GEORGE FOX Submitted to the Graduate College...

  18. Estimation method for the thermochemical properties of polycyclic aromatic molecules

    E-Print Network [OSTI]

    Yu, Joanna

    2005-01-01

    Polycyclic aromatic molecules, including polycyclic aromatic hydrocarbons (PAHs) have attracted considerable attention in the past few decades. They are formed during the incomplete combustion of hydrocarbon fuels and are ...

  19. Stimulating the anaerobic degradation of aromatic hydrocarbons in contaminated sediments by providing

    E-Print Network [OSTI]

    Lovley, Derek

    Stimulating the anaerobic degradation of aromatic hydrocarbons in contaminated sediments to simulate the degradation of aromatic hydrocarbons in anaerobic contaminated sediments was investigated as the sole electron acceptor. Providing graphite electrodes as an electron acceptor in hydrocarbon

  20. High-resolution IR absorption spectroscopy of polycyclic aromatic hydrocarbons: the realm of anharmonicity

    E-Print Network [OSTI]

    Maltseva, Elena; Candian, Alessandra; Mackie, Cameron J; Huang, Xinchuan; Lee, Timothy J; Tielens, Alexander G G M; Oomens, Jos; Buma, Wybren Jan

    2015-01-01

    We report on an experimental and theoretical investigation of the importance of anharmonicity in the 3 micron CH stretching region of Polycyclic Aromatic Hydrocarbon (PAH) molecules. We present mass-resolved, high-resolution spectra of the gas-phase cold (~4K) linear PAH molecules naphthalene, anthracene, and tetracene. The measured IR spectra show a surprisingly high number of strong vibrational bands. For naphthalene, the observed bands are well separated and limited by the rotational contour, revealing the band symmetries. Comparisons are made to the harmonic and anharmonic approaches of the widely used Gaussian software. We also present calculated spectra of these acenes using the computational program SPECTRO, providing anharmonic predictions enhanced with a Fermi-resonance treatment that utilises intensity redistribution. We demonstrate that the anharmonicity of the investigated acenes is strong, dominated by Fermi resonances between the fundamental and double combination modes, with triple combination ...

  1. Manufacture of aromatic hydrocarbons from coal hydrogenation products

    SciTech Connect (OSTI)

    A.S. Maloletnev; M.A. Gyul'malieva [Institute for Fossil Fuels, Moscow (Russian Federation)

    2007-08-15

    The manufacture of aromatic hydrocarbons from coal distillates was experimentally studied. A flow chart for the production of benzene, ethylbenzene, toluene, and xylenes was designed, which comprised the hydrogen treatment of the total wide-cut (or preliminarily dephenolized) fraction with FBP 425{sup o}C; fractional distillation of the hydrotreated products into IBP-60, 60-180, 180-300, and 300-425{sup o}C fractions; the hydro-cracking of middle fractions for increasing the yield of gasoline fractions whenever necessary; the catalytic reform of the fractions with bp up to 180{sup o}C; and the extraction of aromatic hydrocarbons.

  2. Polycyclic aromatic hydrocarbons at selected burning grounds at Los Alamos National Laboratory

    SciTech Connect (OSTI)

    Harris, B.W.; Minor, L.K.M.; Flucas, B.J.

    1998-02-01

    A commercial immunoassay field test (IFT) was used to rapidly assess the total concentrations of polycyclic aromatic hydrocarbons (PAHs) in the soil at selected burning grounds within the explosives corridor at Los Alamos National Laboratory (LANL). Results were compared with analyses obtained from LANL Analytical Laboratory and from a commercial laboratory. Both used the Environmental Protection Agency`s (EPA`s) Methods 8270 and 8310. EPA`s Method 8270 employs gas chromatography and mass spectral analyses, whereas EPA`s Method 8310 uses an ultraviolet detector in a high-performance liquid chromatography procedure. One crude oil sample and one diesel fuel sample, analyzed by EPA Method 8270, were included for references. On an average the IFT results were lower for standard samples and lower than the analytical laboratory results for the unknown samples. Sites were selected to determine whether the PAHs came from the material burned or the fuel used to ignite the burn, or whether they are produced by a high-temperature chemical reaction during the burn. Even though the crude oil and diesel fuel samples did contain measurable quantities of PAHs, there were no significant concentrations of PAHs detected in the ashes and soil at the burning grounds. Tests were made on fresh soil and ashes collected after a large burn and on aged soil and ashes known to have been at the site more than three years. Also analyzed were twelve-year-old samples from an inactive open burn cage.

  3. Dissociative photoionization of polycyclic aromatic hydrocarbon molecules carrying an ethynyl group

    E-Print Network [OSTI]

    Rouillé, Gaël; Fulvio, Daniele; Jäger, Cornelia; Henning, Thomas; Garcia, Gustavo A; Tang, Xiao-Feng; Nahon, Laurent

    2015-01-01

    The life cycle of the population of interstellar polycyclic aromatic hydrocarbon (PAH) molecules depends partly on the photostability of the individual species. We have studied the dissociative photoionization of two ethynyl-substituted PAH species, namely, 9-ethynylphenanthrene and 1-ethynylpyrene. Their adiabatic ionization energy and the appearance energy of fragment ions have been measured with the photoelectron photoion coincidence (PEPICO) spectroscopy technique. The adiabatic ionization energy has been found at 7.84 +/- 0.02 eV for 9-ethynylphenanthrene and at 7.41 +/- 0.02 eV for 1-ethynylpyrene. These values are similar to those determined for the corresponding non-substituted PAH molecules phenanthrene and pyrene. The appearance energy of the fragment ion indicative of the loss of a H atom following photoionization is also similar for either ethynyl-substituted PAH molecule and its non-substituted counterpart. The measurements are used to estimate the critical energy for the loss of a H atom by the ...

  4. Isomer discrimination of polycyclic aromatic hydrocarbons in the Murchison meteorite by resonant ionization

    E-Print Network [OSTI]

    de Vries, Mattanjah S.

    Isomer discrimination of polycyclic aromatic hydrocarbons in the Murchison meteorite by resonant between isomers of polycyclic aromatic hydrocarbons in the Murchison meteorite. We measured the 2C-R2PI: Resonant ionization; Jet cooling; Mass spectrometry; Polycyclic aromatic hydrocarbons; Murchison meteorite

  5. Prediction of Solid Polycyclic Aromatic Hydrocarbons Solubility in Water with the NRTL-PR Model

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    Prediction of Solid Polycyclic Aromatic Hydrocarbons Solubility in Water with the NRTL-PR Model of solid polycyclic aromatic hydrocarbons in water. For this purpose, we first validate our methodology for fluid phase equilibria predictions of aromatic hydrocarbons and gas (CO2, C2H6) mixtures. Finally, we

  6. Modeling the biodegradability and physicochemical properties of polycyclic aromatic hydrocarbons 

    E-Print Network [OSTI]

    Dimitriou-Christidis, Petros

    2006-10-30

    .67c a From Howard and Meylan (1997). b From SRC (2005). c From Mackay et al. (1992). logK = aRI + b (2.1) where K is a... Bill Batchelor Kirby C. Donnelly Thomas J. McDonald David V. Rosowsky August 2005 Major Subject: Civil Engineering iii ABSTRACT Modeling the Biodegradability and Physicochemical Properties of Polycyclic Aromatic Hydrocarbons...

  7. Biodegradability of select polycyclic aromatic hydrocarbon (pah) mixtures 

    E-Print Network [OSTI]

    Desai, Anuradha M.

    2007-04-25

    of common enzyme systems. Competitive inhibition became pronounced under conditions of: Ks1 > Ks1 and S1 >> S. Experiments with equitable concentrations of substrates demonstrated the effect of concentration on competitive inhibition. Ternary...

  8. Distribution of polycyclic aromatic hydrocarbons in fly ash during coal and residual char combustion in a pressurized fluidized bed

    SciTech Connect (OSTI)

    Hongcang Zhou; Baosheng Jin; Rui Xiao; Zhaoping Zhong; Yaji Huang

    2009-04-15

    To investigate the distribution of polycyclic aromatic hydrocarbons (PAHs) in fly ash, the combustion of coal and residual char was performed in a pressurized spouted fluidized bed. After Soxhlet extraction and Kuderna-Danish (K-D) concentration, the contents of 16 PAHs recommended by the United States Environmental Protection Agency (U.S. EPA) in coal, residual char, and fly ash were analyzed by a high-performance liquid chromatography (HPLC) coupled with fluorescence and diode array detection. The experimental results show that the combustion efficiency is lower and the carbon content in fly ash is higher during coal pressurized combustion, compared to the residual char pressurized combustion at the pressure of 0.3 MPa. Under the same pressure, the PAH amounts in fly ash produced from residual char combustion are lower than that in fly ash produced from coal combustion. The total PAHs in fly ash produced from coal and residual char combustion are dominated by three- and four-ring PAHs. The amounts of PAHs in fly ash produced from residual char combustion increase and then decrease with the increase of pressure in a fluidized bed. 21 refs., 1 fig., 4 tabs.

  9. Ambient aromatic hydrocarbon measurements at Welgegund, South Africa

    SciTech Connect (OSTI)

    Jaars, K.; Beukes, J. P.; van Zyl, P. G.; Venter, A. D.; Josipovic, M.; Pienaar, J. J.; Vakkari, Ville; Aaltonen, H.; Laakso, H.; Kulmala, M.; Tiitta, P.; Guenther, Alex B.; Hellen, H.; Laakso, L.; Hakola, H.

    2014-07-11

    Aromatic hydrocarbons are associated with direct adverse human health effects and can have negative impacts on ecosystems due to their toxicity, as well as indirect negative effects through the formation of tropospheric ozone and secondary organic aerosol that affect human health, crop production and regional climate. Measurements were conducted at the Welgegund measurement station (South Africa) that is considered to be a regionally representative background site. However, the site is occasionally impacted by plumes from major anthropogenic source regions in the interior of South Africa, which include the western Bushveld Igneous Complex (e.g. platinum, base metal and ferrochrome smelters), the eastern Bushveld Igneous Complex (platinum and ferrochrome smelters), the Johannesburg-Pretoria metropolitan conurbation (>10 million people), the Vaal Triangle (e.g. petrochemical and industries), the Mpumalanga Highveld (e.g. coal-fired power plants and petrochemical industry) and also a region of anti-cyclonic recirculation of air mass over the interior of South Africa. The aromatic hydrocarbon measurements were conducted with an automated sampler on Tenax-TA and Carbopack-B adsorbent tubes with heated inlet for one year. Samples were collected twice a week for two hours during daytime and two hours 1 during night-time. A thermal desorption unit, connected to a gas chromatograph and a mass 2 selective detector was used for sample preparation and analysis. Results indicated that the 3 monthly median total aromatic hydrocarbon concentrations ranged between 0.01 to 3.1 ppb. 4 Benzene levels did not exceed local air quality standards. Toluene was the most abundant 5 species, with an annual median concentration of 0.63 ppb. No statistically significant 6 differences in the concentrations measured during daytime and night-time were found and no distinct seasonal patterns were observed. Air mass back trajectory analysis proved that the lack of seasonal cycles could be attributed to patterns determining the origin of the air masses sampled. Aromatic hydrocarbon concentrations were in general significantly higher in air masses that passed over anthropocentrically impacted regions. Interspecies correlations and ratios gave some indications of the possible sources for the different aromatic hydrocarbons in the source regions defined in the paper. The highest contribution of aromatic hydrocarbon concentrations to ozone formation potential was also observed in plumes passing over anthropocentrically impacted regions.

  10. On-line database of the spectral properties of polycyclic aromatic hydrocarbons

    E-Print Network [OSTI]

    G. Malloci; C. Joblin; G. Mulas

    2007-01-09

    We present an on-line database of computed molecular properties for a large sample of polycyclic aromatic hydrocarbons (PAHs) in four charge states: -1, 0, +1, and +2. At present our database includes 40 molecules ranging in size from naphthalene and azulene (C10H8) up to circumovalene (C66H20). We performed our calculations in the framework of the density functional theory (DFT) and the time-dependent DFT to obtain the most relevant molecular parameters needed for astrophysical applications. For each molecule in the sample, our database presents in a uniform way the energetic, rotational, vibrational, and electronic properties. It is freely accessible on the web at http://astrochemistry.ca.astro.it/database/ and http://www.cesr.fr/~joblin/database/.

  11. Aust. J. Mar. Freshw. Res., 1984, 35, 119-28 Aromatic Hydrocarbons in Waters of

    E-Print Network [OSTI]

    Canberra, University of

    Aust. J. Mar. Freshw. Res., 1984, 35, 119-28 Aromatic Hydrocarbons in Waters of Port Phillip Bay of aromatic hydrocarbons in coastal waters, using solvent extraction and fluorescence emission analysis, shows and the Yarra River estuary. Introduction Pollution of the marine environment by petroleum hydrocarbons

  12. Mitogen induced proliferative responses of lymphocytes from spot (Leiostomus xanthurus) exposed to polycyclic aromatic hydrocarbon contaminated environments

    SciTech Connect (OSTI)

    Faisal, M.; Marzouk, M.S.; Smith, C.L.; Huggett, R.J. (Virginia Institute of Marine Science, School of Marine Science, College of William Mary, Gloucester Point (United States))

    1991-01-01

    The marine fish spot, Leiostomus xanthurus, was collected from five sites in the lower Chesapeake Bay system representing a gradient of sediment polycyclic aromatic hydrocarbon (PAH) concentrations. The proliferative responses to mitogens by anterior kidney lymphocytes were assessed using (3H)-thymidine uptake by replicating DNA. The data show two different mitogen-dependent lymphocytic responses as the sediment PAH levels increase at the sampling sites; a suppression of the response to the T cell mitogens, concanavalin A (Con A) and phytohemagglutinin, and a sharp augmentation of the response to B cell mitogen, lipopolysaccharide (LPS), as well as to poke weed mitogen and peanut agglutinin. The magnitude of the lymphoproliferative responses correlated strongly with the total sediment PAH concentrations (r2 greater than 0.8). A similar correlation was also observed with 15 selected individual PAH compounds regardless of their molecular weights. By maintaining the fish in clean York River water for up to 24 weeks, it was possible to reverse the augmented proliferative responses to LPS of fish from all sampling sites and to increase the reduced responses to Con A, in fish from three sites, and partially in two sites where sediments were highly contaminated with PAH. These results suggest that the proliferative responses of fish lymphocytes to mitogens may be a potentially sensitive biomarker of exposure to, and effects of xenobiotics.

  13. Field application of a genetically engineered microorganism for polycyclic aromatic hydrocarbon bioremediation process monitoring and control

    SciTech Connect (OSTI)

    Sayler, G.S.; Cox, C.D.; Ripp, S.; Nivens, D.E.; Werner, C.; Ahn, Y.; Matrubutham, U.; Burlage, R.

    1998-11-01

    On October 30, 1996, the US Environmental Protection Agency (EPA) commenced the first test release of genetically engineered microorganisms (GEMs) for use in bioremediation. The specific objectives of the investigation were multifaceted and include (1) testing the hypothesis that a GEM can be successfully introduced and maintained in a bioremediation process, (2) testing the concept of using, at the field scale, reporter organisms for direct bioremediation process monitoring and control, and (3) acquiring data that can be used in risk assessment decision making and protocol development for future field release applications of GEMs. The genetically engineered strain under investigation is Pseudomonas fluorescens strain HK44 (King et al., 1990). The original P. fluorescens parent strain was isolated from polycyclic aromatic hydrocarbon (PAH) contaminated manufactured gas plant soil. Thus, this bacterium is able to biodegrade naphthalene (as well as other substituted naphthalenes and other PAHs) and is able to function as a living bioluminescent reporter for the presence of naphthalene contamination, its bioavailability, and the functional process of biodegradation. A unique component of this field investigation was the availability of an array of large subsurface soil lysimeters. This article describes the experience associated with the release of a genetically modified microorganism, the lysimeter facility and its associated instrumentation, as well as representative data collected during the first eighteen months of operation.

  14. Shock processing of interstellar dust and polycyclic aromatic hydrocarbons in the supernova remnant N132D

    E-Print Network [OSTI]

    A. Tappe; J. Rho; W. T. Reach

    2006-09-06

    We observed the oxygen-rich Large Magellanic Cloud (LMC) supernova remnant N132D (SNR 0525-69.6), using all instruments onboard the Spitzer Space Telescope, IRS, IRAC, and MIPS (Infrared Spectrograph, Infrared Array Camera, Multiband Imaging Photometer for Spitzer). The 5-40 micron IRS spectra toward the southeastern shell of the remnant show a steeply rising continuum with [NeIII] and [OIV] as well as PAH emission. We also present the spectrum of a fast moving ejecta knot, previously detected at optical wavelengths, which is dominated by strong [NeIII] and [OIV] emission lines. We interpret the continuum as thermal emission from swept-up, shock-heated dust grains in the expanding shell of N132D, which is clearly visible in the MIPS 24 micron image. A 15-20 micron emission hump appears superposed on the dust continuum, and we attribute this to PAH C-C-C bending modes. We also detect the well-known 11.3 micron PAH C-H bending feature, and find the integrated strength of the 15-20 micron hump about a factor of seven stronger than the 11.3 micron band in the shell of the remnant. IRAC 3-9 micron images do not show clear evidence of large-scale, shell-like emission from the remnant, partly due to confusion with the ambient ISM material. However, we identified several knots of shocked interstellar gas based on their distinct infrared colors. We discuss the bright infrared continuum and the polycyclic aromatic hydrocarbon features with respect to dust processing in young supernova remnants.

  15. Synthesis of condensed phases containing polycyclic aromatic hydrocarbons fullerenes and nanotubes

    DOE Patents [OSTI]

    Reilly, Peter T. A.

    2004-10-19

    The invention relates to methods for producing polycyclic aromatic hydrocarbons, fullerenes, and nanotubes, comprising: a. heating at least one carbon-containing material to form a condensed phase comprising at least one polycyclic aromatic hydrocarbon; b. collecting at least some of the condensed phase; c. reacting the condensed phase to form fullerenes and/or nanotubes.

  16. ON THE VIABILITY OF THE PAH MODEL AS AN EXPLANATION OF THE UNIDENTIFIED INFRARED EMISSION FEATURES

    SciTech Connect (OSTI)

    Zhang, Yong; Kwok, Sun E-mail: sunkwok@hku.hk

    2015-01-01

    Polycyclic aromatic hydrocarbon (PAH) molecules are widely considered the preferred candidate for the carrier of the unidentified infrared emission bands observed in the interstellar medium and circumstellar envelopes. In this paper, we report the results of fitting a variety of non-PAH spectra (silicates, hydrogenated amorphous carbon, coal, and even artificial spectra) using the theoretical infrared spectra of PAHs from the NASA Ames PAH IR Spectroscopic Database. We show that these non-PAH spectra can be well fitted by PAH mixtures. This suggests that a general match between astronomical spectra and those of PAH mixtures does not necessarily provide definitive support for the PAH hypothesis.

  17. Measurement of organophosphate pesticides, organochlorine pesticides, and polycyclic aromatic hydrocarbons in household dust from two rural villages in Nepal 

    E-Print Network [OSTI]

    Cizmas, Leslie; Ackerman, Lani; Donnelly, Danielle A.; Donnelly, Kirby C.; McDonald, Thomas J.

    2015-01-16

    to polycyclic aromatic hydrocarbons from wood smoke. This study measured the levels of four organophosphate pesticides, 22 organochlorine pesticides, and over thirty polycyclic aromatic hydrocarbons in house dust from two rural Nepali villages. Floor dust...

  18. NEAR-INFRARED SPECTROSCOPY OF NITROGENATED POLYCYCLIC AROMATIC HYDROCARBON CATIONS FROM 0.7 TO 2.5 m

    E-Print Network [OSTI]

    , are produced by mix- tures of highly vibrationally excited polycyclic aromatic hydro- carbons (PAHs), PAH ions. The small shift in the peak position of the in- terstellar emission band near 6.2 m is one such variation emission features assigned to PAHs in- dicated that these variations in peak position arose from small

  19. Single event-driven export of polycyclic aromatic hydrocarbons and suspended matter from coal tar-contaminated soil

    SciTech Connect (OSTI)

    Totsche, K.U.; Jann, S.; Kogel-Knabner, I. [University of Jena, Jena (Germany)

    2007-05-15

    Mobile colloidal and suspended matter is likely to affect the mobility of polycyclic aromatic hydrocarbons (PAHs) in the unsaturated soil zone at contaminated sites. We studied the release of mobile particles and dissolved organic matter as a function of variable climatic boundary conditions, and their effect on the export of PAHs at a coal tar-contaminated site using zero-tension lysimeters. Seepage water samples were analyzed for dissolved organic carbon (DOC), pH, electrical conductivity, turbidity, and particles larger than 0.7 {mu}m. The 16 Environmental Protection Agency PAHs were analyzed in the filtrate < 0.7 m and in the particle fraction. Our results show that extended no-flow periods that are followed by high-intensity rain events, such as thunderstorms, promote the mobilization of particles in the size 0.7 to 200 m. Mobilization is enforced by extended drying during summer. High particle concentrations are also associated with freezing and thawing cycles followed by either rain or snowmelt events. The export of PAHs is strongly connected to the release of particles in the 0.7- to 200-{mu}m size fraction. During the 2-yr monitoring period, up to 0.418 {mu}g kg{sup -1} PAHs were mobilized in the. ltrate (< 0.7 m) while the eightfold mass, 3.36 {mu}g kg{sup -1}, was exported with the retentate (0.7-200 {mu}m). Equilibrium dissolution of PAHs and transport in the dissolved phase seem to be of minor importance for the materials studied. Extreme singular-release events occurred in January 2003 and January 2004, when up to 55 {mu}g L{sup -1} PAHs per one single seepage event were observed within the retentate. Freezing and thawing cycles affect the PAH source materials, that is, the remnants of the nonaqueous phase liquid (NAPL). High mechanical strain during freezing results in the formation of particles. At the onset of the thawing and following rain or snowmelt events, PAHs associated with these particles are then exported from the lysimeter.

  20. Use of the phenanthrene to benzo(e)pyrene ambient air ratio as an indicator for the source of polycyclic aromatic hydrocarbons

    SciTech Connect (OSTI)

    Germain, A.; Ringuette, S.; Tremblay, J. [Environment Canada, Montreal, Quebec (Canada)

    1994-12-31

    Polycyclic aromatic hydrocarbons (PAH) are emitted by many industrial, domestic and natural sources. In 1990, the principal sources of PAH for the Province of Quebec were primary aluminum smelters (858 t), residential heating with wood (162 t), forest fires (148 t) and transportation (33 t). A sampling program was developed to measure PAH levels in ambient air at different locations influenced by these sources. The highest concentrations of PAH in ambient air (470 ng/m{sup 3} geometric mean) were measured near primary aluminum smelters using Horizontal Stud Soederberg technology. Areas influences by wood heating (157 ng/m{sup 3} winter geometric mean) and transportation (80 ng/m{sup 3} geometric mean) had lower total PAH concentrations. Ratios of ambient air concentration for phenanthrene/benzo(e)pyrene were lower in samples collected in the surroundings of the primary aluminum smelters (7--14), whereas high ratios were observed for residential heating with wood and transportation (20--45). The use of this ratio was found to be a good indicator for PAH originating from primary aluminum smelters.

  1. Source Contribution Analysis of Surface Particulate Polycyclic Aromatic Hydrocarbon Concentrations in Northeastern Asia by Source-receptor Relationships

    SciTech Connect (OSTI)

    Inomata, Yayoi; Kajino, Mizuo; Sato, Keiichi; Ohara, Toshimasa; Kurokawa, Jun-Ichi; Ueda, Hiromasa; Tang, Ning; Hayakawa, Kazuichi; Ohizumi, Tsuyoshi; Akimoto, Hajime

    2013-11-01

    We analyzed the sourceereceptor relationships for particulate polycyclic aromatic hydrocarbon (PAH) concentrations in northeastern Asia using an aerosol chemical transport model. The model successfully simulated the observed concentrations. In Beijing (China) benzo[a]pyren (BaP) concentrations are due to emissions from its own domain. In Noto, Oki and Tsushima (Japan), transboundary transport from northern China (>40°N, 40-60%) and central China (30-40°N, 10-40%) largely influences BaP concentrations from winter to spring, whereas the relative contribution from central China is dominant (90%) in Hedo. In the summer, the contribution from Japanese domestic sources increases (40-80%) at the 4 sites. Contributions from Japan and Russia are additional source of BaP over the northwestern Pacific Ocean in summer. The contribution rates for the concentrations from each domain are different among PAH species depending on their particulate phase oxidation rates. Reaction with O3 on particulate surfaces may be an important component of the PAH oxidation processes.

  2. Separation, characterization and instrumental analysis of polynuclear aromatic hydrocarbon ring classes in petroleum

    SciTech Connect (OSTI)

    Chmielowiec, J.; Beshai, J.E.; George, A.E.

    1980-08-01

    To develop effective utilization technology for heavy streams from conventional fuels and unconventional resources such as heavy oils and oilsand bitumens, detailed information on the chemical composition of the feedstocks is needed. Attempts were made during the seventies to modify the API Project 60 scheme of analysis or to develop chemically more efficient, and less time-consuming, separation and characterization methods. These attempts aimed to improve characterization by separating the samples into concentrates of different structural types. Samples throughput was increased by using pressure and higher performance chromatographic systems. Other valuable contributions, such as coal-liquid characterization in terms of different chemical functionalities have also been made. The separation of aromatic ring classes and characterization or identification of their major components was our primary objective in this study. A silica-R(NH/sub 2/)/sub 2/-based HPLC system was used in our laboratory to study the analytical potential of this approach; the work was described in a previous publication. In the present study, the applicability of HPLC separation by this system and instrumental spectrometric characterization of 3- and 4-ring PAHs isolated from two Canadian oils were investigated. The oils used, Medicine River and Lloydminster, are examples of hydrocarbon-dominated materials representing light and heavy processing feedstocks, respectively.

  3. Climate Change and Emissions Impacts on Atmospheric PAH Transport to the Arctic

    E-Print Network [OSTI]

    Zhang, Yanxu

    We investigate effects of 2000–2050 emissions and climate changes on the atmospheric transport of three polycyclic aromatic hydrocarbons (PAHs): phenanthrene (PHE), pyrene (PYR), and benzo[a]pyrene (BaP). We use the GEOS-Chem ...

  4. Influence of Hydrocarbons Exposure on Survival, Growth and Condition of Juvenile Flatfish: A Mesocosm Experiment

    E-Print Network [OSTI]

    Boyer, Edmond

    Influence of Hydrocarbons Exposure on Survival, Growth and Condition of Juvenile Flatfish experiments were conducted to determine whether short (24 h) but high exposure to petroleum hydrocarbons (1 to petroleum hydro- carbons and in particular Polycyclic Aromatic Hydrocarbons (PAHs). PAHs are regarded

  5. Method of upgrading oils containing hydroxyaromatic hydrocarbon compounds to highly aromatic gasoline

    DOE Patents [OSTI]

    Baker, Eddie G. (Richland, WA); Elliott, Douglas C. (Richland, WA)

    1993-01-01

    The present invention is a multi-stepped method of converting an oil which is produced by various biomass and coal conversion processes and contains primarily single and multiple ring hydroxyaromatic hydrocarbon compounds to highly aromatic gasoline. The single and multiple ring hydroxyaromatic hydrocarbon compounds in a raw oil material are first deoxygenated to produce a deoxygenated oil material containing single and multiple ring aromatic compounds. Then, water is removed from the deoxygenated oil material. The next step is distillation to remove the single ring aromatic compouns as gasoline. In the third step, the multiple ring aromatics remaining in the deoxygenated oil material are cracked in the presence of hydrogen to produce a cracked oil material containing single ring aromatic compounds. Finally, the cracked oil material is then distilled to remove the single ring aromatics as gasoline.

  6. Method of upgrading oils containing hydroxyaromatic hydrocarbon compounds to highly aromatic gasoline

    DOE Patents [OSTI]

    Baker, E.G.; Elliott, D.C.

    1993-01-19

    The present invention is a multi-stepped method of converting an oil which is produced by various biomass and coal conversion processes and contains primarily single and multiple ring hydroxyaromatic hydrocarbon compounds to highly aromatic gasoline. The single and multiple ring hydroxyaromatic hydrocarbon compounds in a raw oil material are first deoxygenated to produce a deoxygenated oil material containing single and multiple ring aromatic compounds. Then, water is removed from the deoxygenated oil material. The next step is distillation to remove the single ring aromatic compounds as gasoline. In the third step, the multiple ring aromatics remaining in the deoxygenated oil material are cracked in the presence of hydrogen to produce a cracked oil material containing single ring aromatic compounds. Finally, the cracked oil material is then distilled to remove the single ring aromatics as gasoline.

  7. Evaluation of a photoelectric aerosol sensor for real-time PAH monitoring. Project report

    SciTech Connect (OSTI)

    Ramamurthi, M.; Chuang, J.C.

    1997-04-01

    In this study, the performance of a Gossen, GmbH Model PAS 1000i Photoelectric Aerosol Sensors (PAS) was evaluated for monitoring the levels of polycyclic aromatic hydrocarbons (PAH) on airborne find particles. The response of the PAS to PAH vapors and to airborne particles of various sizes were determined. Estimated levels of PAH provided by the PAS were compared to the concentrations of PAH sampled and measured traditionally.

  8. Energetics of C-H Bond Activation of Fluorinated Aromatic Hydrocarbons Using a [TpRh(CNneopentyl)] Complex

    E-Print Network [OSTI]

    Jones, William D.

    Energetics of C-H Bond Activation of Fluorinated Aromatic Hydrocarbons Using a [Tp activation of fluorinated aromatic hydrocarbons by [TpRh(CNneopentyl)] resulted in the formation of products of homogeneous transition-metal catalysts to activate and functionalize C-H bonds of hydrocarbons for industrial

  9. Origin and significance of aromatic hydrocarbons in giant iron ore deposits of the late Archean Hamersley Basin,

    E-Print Network [OSTI]

    Brocks, Jochen J.

    Origin and significance of aromatic hydrocarbons in giant iron ore deposits of the late Archean extractable saturated and aromatic hydrocarbons. The host rocks belong to the $2.5 billion years (Ga) old Mt and Newman (Mt Whaleback). The saturated hydrocarbons in the rock extracts have the composition of highly

  10. ROTATIONAL SPECTRA OF SMALL PAHs: ACENAPHTHENE, ACENAPHTHYLENE, AZULENE, AND FLUORENE

    E-Print Network [OSTI]

    Thorwirth, Sven

    hydrocarbons have been observed by Fourier transform microwave spectroscopy of a molecular beam and fluorene have also been measured in the 3 mm region by conventional free-space absorption spectroscopy and their vibrational spectra, polycyclic aromatic hydrocarbons (PAHs) are widely be- lieved to be responsible molecular

  11. Phase Stability of Multicomponent NAPLs Containing PAHs

    E-Print Network [OSTI]

    Peters, Catherine A.

    of a contaminant is dependent on its phase state. For solid phase contaminants in contact with water, the maximum aromatic hydrocarbons (PAHs), most of which are solids in pure form at ambient temperatures. Because any of contaminants such as coal tars. NAPL/aqueous phase equilibrium studies were conducted to demonstrate

  12. Dispersion modeling of polycyclic aromatic hydrocarbons from combustion of biomass and fossil fuels and production of coke in Tianjin, China

    SciTech Connect (OSTI)

    Shu Tao; Xinrong Li; Yu Yang; Raymond M. Coveney, Jr.; Xiaoxia Lu; Haitao Chen; Weiran Shen [Peking University, Beijing (China). Laboratory for Earth Surface Processes, College of Environmental Sciences

    2006-08-01

    A USEPA procedure, ISCLT3 (Industrial Source Complex Long-Term), was applied to model the spatial distribution of polycyclic aromatic hydrocarbons (PAHs) emitted from various sources including coal, petroleum, natural gas, and biomass into the atmosphere of Tianjin, China. Benzo(a)pyrene equivalent concentrations (BaPeq) were calculated for risk assessment. Model results were provisionally validated for concentrations and profiles based on the observed data at two monitoring stations. The dominant emission sources in the area were domestic coal combustion, coke production, and biomass burning. Mainly because of the difference in the emission heights, the contributions of various sources to the average concentrations at receptors differ from proportions emitted. The shares of domestic coal increased from {approximately} 43% at the sources to 56% at the receptors, while the contributions of coking industry decreased from {approximately} 23% at the sources to 7% at the receptors. The spatial distributions of gaseous and particulate PAHs were similar, with higher concentrations occurring within urban districts because of domestic coal combustion. With relatively smaller contributions, the other minor sources had limited influences on the overall spatial distribution. The calculated average BaPeq value in air was 2.54 {+-} 2.87 ng/m{sup 3} on an annual basis. Although only 2.3% of the area in Tianjin exceeded the national standard of 10 ng/m{sup 3}, 41% of the entire population lives within this area. 37 refs., 9 figs.

  13. Mass Transport and Thermodynamic Analysis of PAHs in Partitioning Systems in the

    E-Print Network [OSTI]

    Daugulis, Andrew J.

    E Journal 2717October 2010 Vol. 56, No. 10 #12;contaminants directly from soil, water, and air, as polymers, equilibrium, solid­liquid partitioning systems, PAHs Introduction Polycyclic aromatic hydrocarbons (PAHs of contaminants are then transported and parti- tioned into the aqueous phase, where microbes degrade these toxic

  14. Remediation of PAH contaminated soils: Application of a solidliquid two-phase partitioning bioreactor

    E-Print Network [OSTI]

    Daugulis, Andrew J.

    Remediation of PAH contaminated soils: Application of a solid­liquid two-phase partitioning Available online 21 July 2008 keywords: Solid-phase absorption Biodegradation PAHs Bioremediation Soil scale for the remediation of soil contaminated with a model mixture of polycyclic aromatic hydrocarbons

  15. A Kekule-Crossing Model for the "Anomalous" Behavior of the b2u Modes of Aromatic Hydrocarbons in the Lowest

    E-Print Network [OSTI]

    Haas, Yehuda

    A Kekule´-Crossing Model for the "Anomalous" Behavior of the b2u Modes of Aromatic Hydrocarbons of Kekule´-type vibrational modes in the 11B2u excited state of benzene and other aromatic hydrocarbons´-type b2u modes in the 11B2u electronically excited state of several aromatic hydrocarbons (benzene

  16. Pulsed discharge nozzle cavity ringdown spectroscopy of cold polycyclic aromatic hydrocarbon ions

    E-Print Network [OSTI]

    Pulsed discharge nozzle cavity ringdown spectroscopy of cold polycyclic aromatic hydrocarbon ions absorption spectra of the naphthalene (C10H8 ) and acenaphthene (C12H10) cations have been measured environment. The direct absorption spectra of two out of four bands measured of the gas-phase cold naphthalene

  17. Tenax as sorption sink for in vitro bioaccessibility measurement of polycyclic aromatic hydrocarbons in soils

    E-Print Network [OSTI]

    Ma, Lena

    Tenax as sorption sink for in vitro bioaccessibility measurement of polycyclic aromatic hydrocarbons in soils Chao Li a , XinÀYi Cui a, * , YingÀYing Fan a , Ying Teng b , ZhongÀRen Nan c , Lena Q based in vitro methods have been developed to measure bioaccessibility of organic contaminants in soils

  18. Formation mechanism for polycyclic aromatic hydrocarbons in methane flames

    E-Print Network [OSTI]

    Sattler, Klaus

    applications including heating systems and gas turbines for electric power generation.62­64 The combustion of natural gas methane is a clean and efficient process. While gas turbines operating with methane pollution than other hydrocarbon fuels. Therefore, gas turbines pow- ered by methane are promising

  19. Polycyclic aromatic hydrocarbon distributions in Mississippi Fan sediments 

    E-Print Network [OSTI]

    Sandberg, William Allan

    1986-01-01

    on fractionation of carbon in phytoplankton; 3) the alteration of organic matter's isotopic composition during degradation and diagenesis; 4) upward and/or lateral migration of petrogenic hydrocarbons into shallower sediments; 5) anomalous isotopic compositions... ? acenaphthene fluorene phenanthrene/anthracene Gr-3 rings fluoranthene, pyr'ene benz(a)anthracene, chrysene benzopyrenes, perylene ?drz-perylene dibenzanthracenes (*internal standards) Gas GhromatograIrhv Injector: 300 C, splitless mode Total Run...

  20. Environmental dependence of polycyclic aromatic hydrocarbon emission at z~0.8. Investigation by observing the RX J0152.7-1357 with AKARI

    E-Print Network [OSTI]

    Murata, Kazumi; Tanaka, Masayuki; Matsuhara, Hideo; Kodama, Tadayuki

    2015-01-01

    We study the environmental dependence of the strength of polycyclic aromatic hydrocarbon (PAH) emission by AKARI observations of RX J0152.7-1357, a galaxy cluster at z=0.84. PAH emission reflects the physical conditions of galaxies and dominates 8 um luminosity (L8), which can directly be measured with the L15 band of AKARI. L8 to infrared luminosity (LIR) ratio is used as a tracer of the PAH strength. Both photometric and spectroscopic redshifts are applied to identify the cluster members. The L15-band-detected galaxies tend to reside in the outskirt of the cluster and have optically green colour, R-z'~ 1.2. We find no clear difference of the L8/LIR behaviour of galaxies in field and cluster environment. The L8/LIR of cluster galaxies decreases with specific-star-formation rate divided by that of main-sequence galaxies, and with LIR, consistent with the results for field galaxies. The relation between L8/LIR and LIR is between those at z=0 and z=2 in the literature. Our data also shows that starburst galaxie...

  1. Infrared spectra of methyl-, and nitrogen-modified void coronene; modeling a carrier of interstellar polycyclic aromatic hydrocarbon

    E-Print Network [OSTI]

    Ota, Norio

    2015-01-01

    Void induced coronene C23H12++ was suggested to be a possible carrier of the astronomically observed polycyclic aromatic hydrocarbon (PAH), which shows unique molecular structure with carbon two pentagons connected with five hexagons. Well observed astronomical infrared spectrum from 3-15 micron could be almost reproduced based on density functional theory. However, there remain several discrepancies with observed spectra, especially on 11-15 micron band weaker intensity. Observed 11.2 micron intensity is comparable to 7.6-7.8 micron one. Methyl-modified molecule C24H14++ revealed that calculated peak height of 11.4 micron show fairly large intensity up to 70-90% compared with that of 7.6-7.8 micron band. Also, nitrogen atom was substituted to peripheral C-H site of void coronene to be C22H11N1++. Pentagon site substituted case show 60% peak height. This molecule also reproduced well 12-15 micron peak position and relative intensity. Vibration mode analysis demonstrated that 11.3 micron mode comes from C-H ou...

  2. Measurement of Organophosphate Pesticides, Organochlorine Pesticides, and Polycyclic Aromatic Hydrocarbons in Household Dust from Two Rural Villages in Nepal 

    E-Print Network [OSTI]

    Cizmas, Leslie; Ackerman, Lani; Donnelly, Danielle A.; Donnelly, Kirby C.; McDonald, Thomas J.

    2015-01-16

    January 16, 2015 Citation: Cizmas L, Ackerman L, Donnelly DA, Donnelly KC, McDonald TJ (2015) Measurement of Organophosphate Pesticides, Organochlorine Pesticides, and Polycyclic Aromatic Hydrocarbons in Household Dust from Two Rural Villages in Nepal..., and reproduction in any medium, provided the original author and source are credited. Measurement of Organophosphate Pesticides, Organochlorine Pesticides, and Polycyclic Aromatic Hydrocarbons in Household Dust from Two Rural Villages in Nepal Leslie Cizmas1...

  3. Estimated IR and phosphorescence emission fluxes for specific Polycyclic Aromatic Hydrocarbons in the Red Rectangle

    E-Print Network [OSTI]

    G. Mulas; G. Malloci; C. Joblin; D. Toublanc

    2005-09-20

    Following the tentative identification of the blue luminescence in the Red Rectangle by Vijh et al. (2005), we compute absolute fluxes for the vibrational IR emission and phosphorescence bands of three small polycyclic aromatic hydrocarbons. The calculated IR spectra are compared with available ISO observations. A subset of the emission bands are predicted to be observable using presently available facilities, and can be used for an immediate, independent, discriminating test on their alleged presence in this well-known astronomical object.

  4. Assessment of natural and anthropogenic hydrocarbon inputs using PAHs as tracers.

    E-Print Network [OSTI]

    amounts of hydrocarbon compounds though combustion (liquid fuels, coal and wood), discharge of petroleum hydrocarbon sources from human activities including oil and refined oil products, burning of coal, liquid

  5. IARC Monographs on the Evaluation of Carcinogenic Risks to Humans Some Inorganic Substances, Chlorinated Hydrocarbons, Aromatic Amines, N-Nitroso Compounds,

    E-Print Network [OSTI]

    Barthelat, Francois

    Inorganic Substances, Chlorinated Hydrocarbons, Aromatic Amines, N-Nitroso Compounds, and Natural Products 1973; 181 pages ISBN 92 832 1202 9 (out of print) Volume 3 Certain Polycyclic Aromatic Hydrocarbons, and Acrolein 1979; 513 pages ISBN 92 832 1219 3 (out of print) Volume 20 Some Halogenated Hydrocarbons 1979

  6. Risk assessment of complex mixtures: development of toxic equivalency factors (TEFs) for polycyclic aromatic hydrocarbons (PAHs

    E-Print Network [OSTI]

    Reese, Erica Dawn

    2001-01-01

    Risk assessment is a very valuable tool with which to frame complex environmental problems. Although risk assessment is a very valuable tool it does have significant limitations. There are many aspects of the process ...

  7. Comparative Developmental Toxicity of Environmentally Relevant Oxygenated PAHs

    SciTech Connect (OSTI)

    Knecht, Andrea; Goodale, Britton; Truong, Lisa; Simonich, Michael; Swanson, Annika; Matzke, Melissa M.; Anderson, Kim A.; Waters, Katrina M.; Tanguay, Robert

    2013-09-01

    Polycyclic aromatic hydrocarbons (PAHs) are ubiquitous pollutants in urban air, dust and in the soil of most industrial coal gassification, coal burning, coke production and wood preservation sites (Howsam and Jones 1998). It is widely recognized that PAHs pose risks to human health,having been associated with increased risks of systemic inflammation (Delfino et al. 2010), cardiopulmonary mortality (Lee et al. 2011; Lewtas 2007) and lung cancer mortality (Grant 2009; Hoshuyama et al. 2006). The potential risks may be especially acute for the developing fetus and infant where PAH exposures have been linked to low birth weight, intrauterine growth retardation, in-utero mortality and lower intelligence (Dejmek et al. 1999; Dejmek et al. 2000; Perera et al. 1999; Perera et al. 2009; Perera et al. 2006; Perera et al. 1998; Wu et al. 2010). Despite the more than two decades of intensive study devoted to parent PAHs, they are only part of the hazard spectrum from PAH contamination.

  8. Comparison of aromatic hydrocarbon measurements made by PTR-MS, DOAS and GC-FID during the MCMA 2003 Field Experiment

    E-Print Network [OSTI]

    Jobson, B. T.

    A comparison of aromatic hydrocarbon measurements is reported for the CENICA supersite in the district of Iztapalapa during the Mexico City Metropolitan Area field experiment in April 2003 (MCMA 2003). Data from three ...

  9. Gas-phase reactions of polycyclic aromatic hydrocarbon cations and their nitrogen-containing analogs with H atoms

    SciTech Connect (OSTI)

    Demarais, Nicholas J.; Yang, Zhibo; Bierbaum, Veronica M. [Department of Chemistry and Biochemistry, 215 UCB, University of Colorado, Boulder, CO 80309-0215 (United States); Snow, Theodore P., E-mail: Nicholas.Demarais@Colorado.edu, E-mail: Zhibo.Yang@ou.edu, E-mail: Veronica.Bierbaum@Colorado.edu, E-mail: Theodore.Snow@Colorado.edu [Center for Astrophysics and Space Astronomy, 389 UCB, University of Colorado, Boulder, CO 80309-0389 (United States)

    2014-03-20

    We have studied the reactions of polycyclic aromatic hydrocarbon cations and their nitrogen-containing analogs with H atoms. Reaction rate constants are measured at 300 K using a flowing afterglow-selected ion flow tube. We have implemented the laser induced acoustic desorption technique to allow the study of large, non-volatile species in the gas phase. The extension of this work from previous studies shows that the reactivity of polycyclic aromatic hydrocarbon cations with H atoms reaches a constant value for large cations. There is a small difference in reactivity when comparing molecules of different size and geometry; however, no difference in reactivity was found when nitrogen was incorporated into the ring.

  10. Effects of partial charge-transfer solute -- solvent interactions in absorption spectra of aromatic hydrocarbons in aqueous and alcoholic solutions

    E-Print Network [OSTI]

    I. A. Ar'ev; N. I. Lebovka; E. A. Solovieva

    2013-03-03

    A method for study of charge-transfer interactions between solute molecules and solvent based on the comparison of the ratios of spectral shifts of different electronic transitions in solute molecules in chemically inert solvent is proposed. The method is applicable to molecules that do not change their dipole moment on excitation. As an example, a presence of charge transfer interactions in higher electronic states of aromatic hydrocarbons (benzene, phenanthrene, and naphthalene) dissolved in water and alcohols was demonstrated.

  11. PAH chemistry and IR emission from circumstellar disks

    E-Print Network [OSTI]

    R. Visser; V. C. Geers; C. P. Dullemond; J. -C. Augereau; K. M. Pontoppidan; E. F. van Dishoeck

    2007-01-22

    Aims. The chemistry of, and infrared (IR) emission from, polycyclic aromatic hydrocarbons (PAHs) in disks around Herbig Ae/Be and T Tauri stars are investigated. The equilibrium distribution of the PAHs over all accessible charge/hydrogenation states depends on the size and shape of the PAHs and on the physical properties of the star and surrounding disk. Methods. A chemistry model is created to calculate this equilibrium distribution. Destruction of PAHs by ultraviolet (UV) photons, possibly in multi-photon absorption events, is taken into account. The chemistry model is coupled to a radiative transfer code to provide the physical parameters and to combine the PAH emission with the spectral energy distribution (SED) from the star+disk system. Results. Normally hydrogenated PAHs in Herbig Ae/Be disks account for most of the observed PAH emission, with neutral and positively ionized species contributing in roughly equal amounts. Close to the midplane, the PAHs are more strongly hydrogenated and negatively ionized, but these species do not contribute to the overall emission because of the low UV/optical flux deep inside the disk. PAHs of 50 carbon atoms are destroyed out to 100 AU in the disk's surface layer, and the resulting spatial extent of the emission does not agree well with observations. Rather, PAHs of about 100 carbon atoms or more are predicted to cause most of the observed emission. The emission is extended on a scale similar to that of the size of the disk. Furthermore, the emission from T Tauri disks is much weaker and concentrated more towards the central star than that from Herbig Ae/Be disks. Positively ionized PAHs are predicted to be largely absent in T Tauri disks because of the weaker radiation field.

  12. The Luminous Polycyclic Aromatic Hydrocarbon Emission Features: Applications to High Redshift Galaxies and Active Galactic Nuclei 

    E-Print Network [OSTI]

    Shipley, Heath

    2015-08-07

    strongly with [Ne II]?12.8µm emission line, from which we conclude that the PAH luminosity directly traces the instantaneous star-formation rate (SFR) in both the IRAGN and star-forming galaxies. There is no measurable difference between the PAH luminosity...

  13. PARTICLE-ASSOCIATED POLYCYCLIC AROMATIC HYDROCARBONS IN THE ATMOSPHERE OF HONG KONG

    E-Print Network [OSTI]

    Zheng, Mei

    predominantly from pyrolysis, incomplete com- bustion and carbonization processes. Even in Antarctica, PAHs into the atmosphere as vapors where they are absorbed onto suspended particu- Water, Air, and Soil Pollution 117: 175

  14. Generation and distribution of PAHs in the process of medical waste incineration

    SciTech Connect (OSTI)

    Chen, Ying; Zhao, Rongzhi; Xue, Jun; Li, Jinhui

    2013-05-15

    Highlights: ? PAHs generation and distribution features of medical waste incineration are studied. ? More PAHs were found in fly ash than that in bottom ash. ? The highest proportion of PAHs consisted of the seven most carcinogenic ones. ? Increase of free oxygen molecule and burning temperature promote PAHs degradation. ? There is a moderate positive correlation between total PCDD/Fs and total PAHs. - Abstract: After the deadly earthquake on May 12, 2008 in Wenchuan county of China, several different incineration approaches were used for medical waste disposal. This paper investigates the generation properties of polycyclic aromatic hydrocarbons (PAHs) during the incineration. Samples were collected from the bottom ash in an open burning slash site, surface soil at the open burning site, bottom ash from a simple incinerator, bottom ash generated from the municipal solid waste (MSW) incinerator used for medical waste disposal, and bottom ash and fly ash from an incinerator exclusively used for medical waste. The species of PAHs were analyzed, and the toxicity equivalency quantities (TEQs) of samples calculated. Analysis results indicate that the content of total PAHs in fly ash was 1.8 × 10{sup 3} times higher than that in bottom ash, and that the strongly carcinogenic PAHs with four or more rings accumulated sensitively in fly ash. The test results of samples gathered from open burning site demonstrate that Acenaphthylene (ACY), Acenaphthene (ACE), Fluorene (FLU), Phenanthrene (PHE), Anthracene (ANT) and other PAHs were inclined to migrate into surrounding environment along air and surface watershed corridors, while 4- to 6-ring PAHs accumulated more likely in soil. Being consistent with other studies, it has also been confirmed that increases in both free oxygen molecules and combustion temperatures could promote the decomposition of polycyclic PAHs. In addition, without the influence of combustion conditions, there is a positive correlation between total PCDD/Fs and total PAHs, although no such relationship has been found for TEQ.

  15. Polynuclear aromatic hydrocarbons on the vegetation of a railroad right-of-way 

    E-Print Network [OSTI]

    Hancock, James Leonard

    1969-01-01

    of carcinogenic PAH in grain samples grown in the industrial Ruhr District were !. en times higher than in similar samples taken from lower Saxonia and other non industrial areas, GRAF and DIEHL (1966) presented evidence that the foliage of various trees...

  16. Persistent activation of DNA damage signaling in response to complex mixtures of PAHs in air particulate matter

    SciTech Connect (OSTI)

    Jarvis, Ian W.H.; Bergvall, Christoffer; Bottai, Matteo; Westerholm, Roger; Stenius, Ulla; Dreij, Kristian

    2013-02-01

    Complex mixtures of polycyclic aromatic hydrocarbons (PAHs) are present in air particulate matter (PM) and have been associated with many adverse human health effects including cancer and respiratory disease. However, due to their complexity, the risk of exposure to mixtures is difficult to estimate. In the present study the effects of binary mixtures of benzo[a]pyrene (BP) and dibenzo[a,l]pyrene (DBP) and complex mixtures of PAHs in urban air PM extracts on DNA damage signaling was investigated. Applying a statistical model to the data we observed a more than additive response for binary mixtures of BP and DBP on activation of DNA damage signaling. Persistent activation of checkpoint kinase 1 (Chk1) was observed at significantly lower BP equivalent concentrations in air PM extracts than BP alone. Activation of DNA damage signaling was also more persistent in air PM fractions containing PAHs with more than four aromatic rings suggesting larger PAHs contribute a greater risk to human health. Altogether our data suggests that human health risk assessment based on additivity such as toxicity equivalency factor scales may significantly underestimate the risk of exposure to complex mixtures of PAHs. The data confirms our previous findings with PAH-contaminated soil (Niziolek-Kierecka et al., 2012) and suggests a possible role for Chk1 Ser317 phosphorylation as a biological marker for future analyses of complex mixtures of PAHs. -- Highlights: ? Benzo[a]pyrene (BP), dibenzo[a,l]pyrene (DBP) and air PM PAH extracts were compared. ? Binary mixture of BP and DBP induced a more than additive DNA damage response. ? Air PM PAH extracts were more potent than toxicity equivalency factor estimates. ? Larger PAHs (> 4 rings) contribute more to the genotoxicity of PAHs in air PM. ? Chk1 is a sensitive marker for persistent activation of DNA damage signaling from PAH mixtures.

  17. Activated carbon and biochar amendments decrease pore-water concentrations of polycyclic aromatic hydrocarbons (PAHs) in sewage sludge

    E-Print Network [OSTI]

    Lehmann, Johannes

    sludge is an abundant organic waste or by-product gen- erated in wastewater treatment plants (WWTP) after it is frequently necessary to landfill sewage sludge in the area of a sewage treatment plant. Such sewage sludge primary and secondary treatment processes. In Europe, dry weight per capita production of sewage sludge

  18. Aromatic hydrocarbon metabolism by Rhodococcus sp. I24 : computational, biochemical and transcriptional analysis

    E-Print Network [OSTI]

    Parker, Jefferson A. (Jefferson Alexander), 1974-

    2004-01-01

    Rhodococcus sp. 124 is a Gram-positive soil bacterium being developed for the manufacture of (-)cis-(1S,2R)-1-aminoindan-2-ol, a key precursor in the production of the HIV-1 protease inhibitor CrixivanTM, from the aromatic ...

  19. Photoinduced Mechanism of Formation and Growth of Polycyclic Aromatic Hydrocarbons in Low-Temperature

    E-Print Network [OSTI]

    Kaiser, Ralf I.

    been shown to be major air pollutants exhibiting mutagenic and tumorogenic activities,1, Florida 33199, and Department of Chemistry, UniVersity of Hawai'i at Manoa, Honolulu, Hawaii 96822 University. University of Hawai'i at Manoa. (1) Ramdahl, T.; Bjorseth, J. Handbook of Polycyclic Aromatic

  20. Photochemistry of aromatic hydrocarbons: implications for ozone and secondary organic aerosol formation 

    E-Print Network [OSTI]

    Suh, Inseon

    2006-08-16

    -toluene reaction. The branching ratios of OH addition to ortho, para, meta, and ipso positions are predicted to be 0.52, 0.34, 0.11, and 0.03, respectively, significantly different from a recent theoretical study of the same reaction system. Aromatic peroxy...

  1. Electron correlations and two-photon states in polycyclic aromatic hydrocarbon molecules: A peculiar role of geometry

    SciTech Connect (OSTI)

    Aryanpour, Karan; Shukla, Alok; Mazumdar, Sumit; College of Optical Sciences, University of Arizona, Tucson, Arizona 85721

    2014-03-14

    We present numerical studies of one- and two-photon excited states ordering in a number of polycyclic aromatic hydrocarbon molecules: coronene, hexa-peri-hexabenzocoronene, and circumcoronene, all possessing D{sub 6h} point group symmetry versus ovalene with D{sub 2h} symmetry, within the Pariser-Parr-Pople model of interacting ?-electrons. The calculated energies of the two-photon states as well as their relative two-photon absorption cross-sections within the interacting model are qualitatively different from single-particle descriptions. More remarkably, a peculiar role of molecular geometry is found. The consequence of electron correlations is far stronger for ovalene, where the lowest spin-singlet two-photon state is a quantum superposition of pairs of lowest spin triplet states, as in the linear polyenes. The same is not true for D{sub 6h} group hydrocarbons. Our work indicates significant covalent character, in valence bond language, of the ground state, the lowest spin triplet state and a few of the lowest two-photon states in D{sub 2h} ovalene but not in those with D{sub 6h} symmetry.

  2. Polycyclic Aromatic Hydrocarbons Orbiting HD 233517, an Evolved Oxygen-Rich Red Giant

    E-Print Network [OSTI]

    M. Jura; J. Bohac; B. Sargent; W. J. Forrest; J. Green; D. M. Watson; G. C. Sloan; F. Markwick-Kemper; C. H. Chen; J. Najita

    2005-12-14

    We report spectra obtained with the Spitzer Space Telescope in the 5 to 35 micron range of HD 233517, an evolved K2 III giant with circumstellar dust. At wavelengths longer than 13 microns, the flux is a smooth continuum that varies approximately as frequency to the -5/3 power. For wavelengths shorter than 13 microns, although the star is oxygen-rich, PAH features produced by carbon-rich species at 6.3 microns, 8.2 microns, 11.3 microns and 12.7 microns are detected along with likely broad silicate emission near 20 microns. These results can be explained if there is a passive, flared disk orbiting HD 233517. Our data support the hypothesis that organic molecules in orbiting disks may be synthesized in situ as well as being incorporated from the interstellar medium.

  3. PAH bioconcentration in Mytilus sp from Sinclair Inlet, WA

    SciTech Connect (OSTI)

    Frazier, J.; Young, D.; Ozretich, R.; Echols, S.

    1995-12-31

    Approximately 20 polynuclear aromatic hydrocarbons (PAH) were measured by GC/MS in seawater and whole soft tissues of the intertidal mussel Mytilus sp. collected in July 1991 within and around Puget Sound`s Sinclair Inlet. Low variability was observed in the water concentrations collected over three days at control sites, yielding reliable values for the exposure levels experienced by this bioindicator mollusk. Mean water concentrations of acenaphthene, phenanthrene, and fluoranthene in the control region were 2.7 {+-} 0.8, 2.8 {+-} 0.8, and 3.1 {+-} 0.7 ng/liter, respectively. Levels measured near sites of vessel activity were higher but much more variable; this reduced the reliability of the tissue/water bioconcentration factors (BCF) obtained from these samples. An empirical model relating values of Log BCF and Log Kow for the control zone samples supports the utility of this estuarine bioindicator for monitoring general levels of PAH in nearshore surface waters.

  4. On-line instrumentation for the real-time monitoring of polynuclear aromatic hydrocarbons in the effluents from a fluidized bed combustor - a feasibility study

    SciTech Connect (OSTI)

    D'Silva, A.P.; Iles, M.; Rice, G.; Fassel, V.A.

    1984-04-01

    When polynuclear aromatic hydrocargons in the vapor phase are diluted preferably in a rare gas and undergo supersonic jet expansion, rotationally cooled molecules with absorption bandwidths of the order of 0.01 nm (FWHM) are obtained. Selective excitation with a tunable dye laser into such narrow absorption bands leads to the observation of highly specific luminescence spectra. Such an approach has been utilized for the on-line, real-time monitoring of polynuclear aromatic hydrocarbons in the effluents from a fluidized bed combustor.

  5. H2 formation on PAHs in photodissociation regions: a high-temperature pathway to molecular hydrogen

    E-Print Network [OSTI]

    Boschman, Leon; Spaans, Marco; Hoekstra, Ronnie; Schlathölter, Thomas

    2015-01-01

    Molecular hydrogen is the most abundant molecule in the Universe. It is thought that a large portion of H2 forms by association of hydrogen atoms to polycyclic aromatic hydrocarbons (PAHs). We model the influence of PAHs on total H2 formation rates in photodissociation regions (PDRs) and assess the effect of these formation rates on the total cloud structure. We set up a chemical kinetic model at steady state in a PDR environment and included adiative transfer to calculate the chemistry at different depths in the PDR. This model includes known dust grain chemistry for the formation of H2 and a H2 formation mechanism on PAHs. Since H2 formation on PAHs is impeded by thermal barriers, this pathway is only efficient at higher temperatures (T > 200 K). At these temperatures the conventional route of H2 formation via H atoms physisorbed on dust grains is no longer feasible, so the PAH mechanism enlarges the region where H2 formation is possible. We find that PAHs have a significant influence on the structure of PD...

  6. Mechanism-based classification of PAH mixtures to predict carcinogenic potential

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Tilton, Susan C.; Siddens, Lisbeth K.; Krueger, Sharon K.; Larkin, Andrew J.; Löhr, Christiane V.; Williams, David E.; Baird, William M.; Waters, Katrina M.

    2015-04-22

    We have previously shown that relative potency factors and DNA adduct measurements are inadequate for predicting carcinogenicity of certain polycyclic aromatic hydrocarbons (PAHs) and PAH mixtures, particularly those that function through alternate pathways or exhibit greater promotional activity compared to benzo[a]pyrene (BaP). Therefore, we developed a pathway based approach for classification of tumor outcome after dermal exposure to PAH/mixtures. FVB/N mice were exposed to dibenzo[def,p]chrysene (DBC), BaP or environmental PAH mixtures (Mix 1-3) following a two-stage initiation/promotion skin tumor protocol. Resulting tumor incidence could be categorized by carcinogenic potency as DBC>>BaP=Mix2=Mix3>Mix1=Control, based on statistical significance. Gene expression profiles measured inmore »skin of mice collected 12 h post-initiation were compared to tumor outcome for identification of short-term bioactivity profiles. A Bayesian integration model was utilized to identify biological pathways predictive of PAH carcinogenic potential during initiation. Integration of probability matrices from four enriched pathways (p« less

  7. Long-term monitoring data to describe the fate of polycyclic aromatic hydrocarbons in Deepwater Horizon oil submerged off

    E-Print Network [OSTI]

    Clement, Prabhakar

    Clement Environmental Engineering Program, Department of Civil Engineering, Auburn University, AL 36849 The 2010 Deepwater Horizon (DWH) catastrophe had considerable impact on the 50 km long sandy beach sys- tem over the open ocean system in the Gulf of Mexico. Light PAHs, such as naphthalenes, were fully depleted

  8. Analysis of Nitro-Polycyclic Aromatic Hydrocarbons in Conventional Diesel and Fischer--Tropsch Diesel Fuel Emissions Using Electron Monochromator-Mass Spectrometry

    SciTech Connect (OSTI)

    Havey, C. D.; McCormick, R. L.; Hayes, R. R.; Dane, A. J.; Voorhees, K. J.

    2006-01-01

    The presence of nitro-polycyclic aromatic hydrocarbons (NPAHs) in diesel fuel emissions has been studied for a number of years predominantly because of their contribution to the overall health and environmental risks associated with these emissions. Electron monochromator-mass spectrometry (EM-MS) is a highly selective and sensitive method for detection of NPAHs in complex matrixes, such as diesel emissions. Here, EM-MS was used to compare the levels of NPAHs in fuel emissions from conventional (petroleum) diesel, ultra-low sulfur/low-aromatic content diesel, Fischer-Tropsch synthetic diesel, and conventional diesel/synthetic diesel blend. The largest quantities of NPAHs were detected in the conventional diesel fuel emissions, while the ultra-low sulfur diesel and synthetic diesel fuel demonstrated a more than 50% reduction of NPAH quantities when compared to the conventional diesel fuel emissions. The emissions from the blend of conventional diesel with 30% synthetic diesel fuel also demonstrated a more than 30% reduction of the NPAH content when compared to the conventional diesel fuel emissions. In addition, a correlation was made between the aromatic content of the different fuel types and NPAH quantities and between the nitrogen oxides emissions from the different fuel types and NPAH quantities. The EM-MS system demonstrated high selectivity and sensitivity for detection of the NPAHs in the emissions with minimal sample cleanup required.

  9. A Case Against Spinning PAHs as the Source of the Anomalous Microwave Emission

    E-Print Network [OSTI]

    Hensley, Brandon S

    2015-01-01

    We employ the all-sky map of the anomalous microwave emission (AME) produced by component separation of the microwave sky to study correlations between the AME and Galactic dust properties. We find that while the AME is highly correlated with all tracers of dust emission, fluctuations in the AME intensity per dust optical depth are uncorrelated with fluctuations in the emission from polycyclic aromatic hydrocarbons (PAHs), casting doubt on the association between AME and PAHs. Further, we find that the best predictor of the AME strength is the dust radiance and that the AME intensity increases with increasing radiation field strength, at variance with predictions from the spinning dust hypothesis. A reconsideration of other emission mechanisms, such as magnetic dipole emission, is warranted.

  10. Aromatic hydrocarbon receptor inhibits lysophosphatidic acid-induced vascular endothelial growth factor-A expression in PC-3 prostate cancer cells

    SciTech Connect (OSTI)

    Wu, Pei-Yi; Lin, Yueh-Chien; Lan, Shun-Yan [Institute of Zoology, National Taiwan University, Taipei, Taiwan (China)] [Institute of Zoology, National Taiwan University, Taipei, Taiwan (China); Huang, Yuan-Li [Department of Biotechnology, Asia University, Taichung, Taiwan (China)] [Department of Biotechnology, Asia University, Taichung, Taiwan (China); Lee, Hsinyu, E-mail: hsinyu@ntu.edu.tw [Institute of Zoology, National Taiwan University, Taipei, Taiwan (China) [Institute of Zoology, National Taiwan University, Taipei, Taiwan (China); Department of Life Science, National Taiwan University, Taipei, Taiwan (China)

    2013-08-02

    Highlights: •LPA-induced VEGF-A expression was regulated by HIF-1? and ARNT. •PI3K mediated LPA-induced VEGF-A expression. •AHR signaling inhibited LPA-induced VEGF-A expression in PC-3 cells. -- Abstract: Lysophosphatidic acid (LPA) is a lipid growth factor with multiple biological functions and has been shown to stimulate cancer cell secretion of vascular endothelial growth factor-A (VEGF-A) and trigger angiogenesis. Hypoxia-inducible factor-1 (HIF-1), a heterodimer consisting of HIF-1? and HIF-1? (also known as aromatic hydrocarbon receptor nuclear translocator (ARNT)) subunits, is an important regulator of angiogenesis in prostate cancer (PC) through the enhancement of VEGF-A expression. In this study, we first confirmed the ability of LPA to induce VEGF-A expression in PC-3 cells and then validated that LPA-induced VEGF-A expression was regulated by HIF-1? and ARNT through phosphatidylinositol 3-kinase activation. Aromatic hydrocarbon receptor (AHR), a receptor for dioxin-like compounds, functions as a transcription factor through dimerization with ARNT and was found to inhibit prostate carcinogenesis and vanadate-induced VEGF-A production. Since ARNT is a common dimerization partner of AHR and HIF-1?, we hypothesized that AHR might suppress LPA-induced VEGF-A expression in PC-3 cells by competing with HIF-1? for ARNT. Here we demonstrated that overexpression and ligand activation of AHR inhibited HIF-1-mediated VEGF-A induction by LPA treatment of PC-3 cells. In conclusion, our results suggested that AHR activation may inhibit LPA-induced VEGF-A expression in PC-3 cells by attenuating HIF-1? signaling, and subsequently, suppressing angiogenesis and metastasis of PC. These results suggested that AHR presents a potential therapeutic target for the prevention of PC metastasis.

  11. Nutrient-stimulated biodegradation of aged refinery hydrocarbons in soil

    SciTech Connect (OSTI)

    Drake, E.N.; Stokley, K.E.; Calcavecchio, P.; Bare, R.E.; Rothenburger, S.J.; Prince, R.C. [Exxon Research and Engineering, Annandale, NJ (United States); Douglas, G.S. [Arthur D. Little, Inc., Cambridge, MA (United States)

    1995-12-31

    Aged hydrocarbon-contaminated refinery soil was amended with water and nutrients and tilled weekly for 1 year to stimulate biodegradation. Gas chromatography/mass spectrometry (GC/MS) analysis of polycyclic aromatic compounds (PAHs) and triterpane biomarkers, and Freon IR analysis of total petroleum hydrocarbons (TPH), were used to determine the extent of biodegradation. There was significant degradation of extractable hydrocarbon (up to 60%), but neither hopane, oleanane, nor the amount of polars decreased during this period of bioremediation, allowing them to be used as conserved internal markers for estimating biodegradation. Significant degradation of the more alkylated two- and three-ring compounds, and of the four-ring species pyrene and chrysene and their alkylated congeners, was seen. Substantial degradation (> 40%) of benzo(b)fluoranthene, benzo(k)fluoranthene, and benzo(a)pyrene also was seen. The results show that bioremediation can be a useful treatment in the cleanup of contaminated refinery sites.

  12. Particle-Scale Investigation of PAH Desorption Kinetics and

    E-Print Network [OSTI]

    organic compounds (HOCs), including polycyclic aromatic hydro- carbons (PAHs), from the solid and sequestration of HOCs, like PAHs, on geosorbents do not provide information about where toxic contaminants point to the need for improved understanding of sequestration processes and the effect of such processes

  13. Significance of Cytochrome P450 System Responses and Levels of Bile Fluorescent Aromatic Compounds in Marine Wildlife Following Oil Spills

    SciTech Connect (OSTI)

    Lee, Richard F.; Anderson, Jack W.

    2005-07-01

    The relationships among cytochrome P450 induction in marine wildlife species, levels of fluorescent aromatic compounds (FAC) in their bile, the chemical composition of the inducing compounds, the significance of the exposure pathway, and any resulting injury, as a consequence of exposure to crude oil following a spill, are reviewed. Fish collected after oil spills often show increases in cytochrome P450 system activity, cytochrome P4501A (CYP1A) and bile fluorescent aromatic compounds (FAC), that are correlated with exposure to polycyclic aromatic hydrocarbons (PAH) in the oil. There is also some evidence for increases in bile FAC and induction of cytochrome P450 in marine birds and mammals after oil spills. However, when observed, increases in these exposure indicators are transitory and generally decrease to background levels within one year after the exposure. Laboratory studies have shown induction of cytochrome P450 systems occurs after exposure of fish to crude oil in water, sediment or food. Most of the PAH found in crude oil (dominantly 2- and 3-ring PAH) are not strong inducers of cytochrome P450. Exposure to the 4-ring chrysenes or the photooxidized products of the PAH may account for the cytochrome P450 responses in fish collected from oil-spill sites. The contribution of non-spill background PAH, particularly combustion-derived (pyrogenic) PAH, to bile FAC and cytochrome P450 system responses can be confounding and needs to be considered when evaluating oil spill effects. The ubiquity of pyrogenic PAH makes it important to fully characterize all sources of PAH, including PAH from natural resources, e.g. retene, in oil spill studies. In addition, such parameters as species, sex, age, ambient temperature and season need to be taken into account. While increases in fish bile FAC and cytochrome P450 system responses, can together, be sensitive general indicators of PAH exposure after an oil spill, there is little unequivocal evidence to suggest a linkage to higher order biological effects, e.g. toxicity, lesions, reproductive failure.

  14. Polycyclic Aromatic Triptycenes: Oxygen Substitution Cyclization Strategies

    E-Print Network [OSTI]

    VanVeller, Brett

    The cyclization and planarization of polycyclic aromatic hydrocarbons with concomitant oxygen substitution was achieved through acid catalyzed transetherification and oxygen-radical reactions. The triptycene scaffold ...

  15. Petroleum hydrocarbons in near-surface seawater of Prince William Sound, Alaska, following the Exxon Valdez oil spill II: Analysis of caged mussels. Air/water study number 3. Subtidal study number 3a. Exxon Valdez oil spill state/federal natural resource damage assessment final report

    SciTech Connect (OSTI)

    Short, J.W.; Harris, P.M.

    1995-07-01

    Mussels (Mytilus trossulus) were deployed at 22 locations inside Prince William Sound and 16 locations outside the Sound at depths of 1, 5 and 25 m for 2 to 8 weeks to determine the biological availability and persistence of petroleum-derived hydrocarbons from the Exxon Valdez Oil (EVO) spill. Four successive deployments were made in 1989, and two each in 1990 and 1991. Mussels were analyzed for 27 alkane and 43 polynuclear aromatic hydrocarbon (PAH) analytes. PAH concentrations derived from EVO in mussels decreased with depth, time, and distance from heavily oiled beaches. Hydrocarbon accumulation derived from EVO by deployed mussels indicates petroleum hydrocarbons were available to subsurface marine fauna the summer following the spill, which may be a route of oil ingestion exposure by fauna at high trophic levels.

  16. Multi-sediment-trap study on the temporal and spatial variability of polycyclic aromatic hydrocarbons and lead in an anthropogenic influenced archipelago

    SciTech Connect (OSTI)

    Broman, D.; Colmsjoe, A.; Ganning, B.; Naef, C.; Zebuehr, Y.

    1984-10-01

    Sixteen sediment traps have been used to collect seston for more than 8 months to study the spatial and temporal distribution of 18 PAH compounds and lead in the Stockholm archipelago (Baltic Proper). Concentrations and especially fluxes exhibit a steep logarithmic decline with distance from urban areas. PAH concentrations and fluxes are higher during the winter-spring period than during the summer due to increased emissions, more extensive washout of land-deposited PAH during snow melting, and resuspension caused by nonstratified water conditions and mixing zone effects. Microbial degradation and photooxidation during summer are of secondary importance to the lower concentrations during that period. Results indicate that air-transported black carbon particles from a variety of nonpoint pollution sources are the probably main carriers of PAH in combination with particles from direct runoff for the stations in the immediate surroundings of the urban area.

  17. Methods for polynuclear aromatic hydrocarbon determination in air samples using polar-bonded phase HPLC and GC-MS with application to oil refinery samples

    SciTech Connect (OSTI)

    Karlesky, K.L.

    1985-01-01

    Particle samples were collected using high volume air samplers fitted with glass fiber filters or with a cascade impactor containing paper filters. They were then cleaned using either extraction with dimethylsulfoxide and pentane or utilizing a small cartridge containing a diamine polar-bonded phase material, the second method being more effective. Vapor phase PAH were sampled using an apparatus designed in the laboratory. After collection, the resins were desorbed with solvent and the PAH content was determined. The suitability of the resins decrease in the following order: Amberlite XAD-2, Chromosorb 105, Tenax GC, coconut charcoal, and Ambesorb XE-348. High performance liquid chromatography (HPLC) was used to determine the behavior of PAH in the normal and reversed phase on polar-bonded phases containing amine, diamine, and pyrrolidone substrates. Results support the proposed mechanism in the normal phase and indicate that both a partitioning and liquid-solid adsorption mechanism takes place in the reversed phase depending upon the mobile phase. Occasionally, these polar-bonded phases can be deactivated by the formation of amine-carbonyl complexes from polar aldehydes or ketones in the solvent or sample. Deactivation can be reversed by flushing with water to hydrolyze the Schiff's base imine back to the amine. Gas chromatography-mass spectroscopy (GC-MS) was used to analyze air samples from oil refineries in Port Arthur, collected over a period of three years. The analytical procedures are applied to the collected samples to determine if they contain detectable amounts of PAH. The GC-MS analysis was adequate for this study but the use of SIM detection is preferred because of the greater sensitivity for PAH.

  18. Factors regulating PAH transformations in disturbed coastal sediments

    SciTech Connect (OSTI)

    LeBlanc, L.A.; Gulnick, J.D.; Brownawell, B.J.; Taylor, G.T. [State Univ. of New York, Stony Brook, NY (United States). Marine Sciences Research Center

    1995-12-31

    Important limitations to bacterial transformations of polycyclic aromatic hydrocarbon (PAH) compounds in sediments include compound structure, dissolved concentration and oxygen availability. Here the authors present evidence suggesting that dissolved concentration is as important as structure in controlling degradation in radiolabeled sediments in flow through microcosms. Results from experiments where the mineralization rates of naphthalene phenanthrene and benzo[a]pyrene were related to the degree of oxygenation of suboxic sediments via sediment resuspension, showed that differences between mineralization rates and percent maximum degradation never varied by more than a factor of two between naphthalene and phenanthrene, despite phenanthrene having sixteen-fold greater hydrophobicity. The results also showed that dissolved naphthalene concentrations in the overlying water from frequently resuspended sediments were much farther below equilibrium predictions than dissolved concentrations of phenanthrene and B[a]P. The authors postulate that kinetic limitations to desorption into the aqueous phase limits the biodegradation of naphthalene to a greater extent than for phenanthrene and B[a]P. Results from experiments relating desorption from sediment to mineralization in side-by-side comparisons showed that labeled sediments undergoing resuspension in microcosms desorbed much less naphthalene than phenanthrene, and that the amount desorbed was largely underpredicted by a kinetic radial diffusion model, especially for naphthalene. Desorption rate limitation in the system may help to explain the similar degree of mineralization of naphthalene and phenanthrene seen in the experiments.

  19. ALS Evidence Confirms Combustion Theory

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    stars turn into carbon-based matter in space. What are PAHs? Polycyclic aromatic hydrocarbons (PAHs) are hydrocarbons-organic compounds containing only carbon and hydrogen-that...

  20. THE NASA AMES PAH IR SPECTROSCOPIC DATABASE VERSION 2.00: UPDATED CONTENT, WEB SITE, AND ON(OFF)LINE TOOLS

    SciTech Connect (OSTI)

    Boersma, C.; Mattioda, A. L.; Allamandola, L. J.; Bauschlicher, C. W. Jr.; Ricca, A.; Cami, J.; Peeters, E.; De Armas, F. Sánchez; Saborido, G. Puerta; Hudgins, D. M.

    2014-03-01

    A significantly updated version of the NASA Ames PAH IR Spectroscopic Database, the first major revision since its release in 2010, is presented. The current version, version 2.00, contains 700 computational and 75 experimental spectra compared, respectively, with 583 and 60 in the initial release. The spectra span the 2.5-4000 ?m (4000-2.5 cm{sup -1}) range. New tools are available on the site that allow one to analyze spectra in the database and compare them with imported astronomical spectra as well as a suite of IDL object classes (a collection of programs utilizing IDL's object-oriented programming capabilities) that permit offline analysis called the AmesPAHdbIDLSuite. Most noteworthy among the additions are the extension of the computational spectroscopic database to include a number of significantly larger polycyclic aromatic hydrocarbons (PAHs), the ability to visualize the molecular atomic motions corresponding to each vibrational mode, and a new tool that allows one to perform a non-negative least-squares fit of an imported astronomical spectrum with PAH spectra in the computational database. Finally, a methodology is described in the Appendix, and implemented using the AmesPAHdbIDLSuite, that allows the user to enforce charge balance during the fitting procedure.

  1. Numerical analysis of the effect of acetylene and benzene addition to low-pressure benzene-rich flat flames on polycyclic aromatic hydrocarbon formation

    SciTech Connect (OSTI)

    Kunioshi, Nilson; Komori, Seisaku; Fukutani, Seishiro

    2006-10-15

    A modification of the CHEMKIN II package has been proposed for modeling addition of an arbitrary species at an arbitrary temperature to an arbitrary distance from the burner along a flat flame. The modified program was applied to the problem of addition of acetylene or benzene to different positions of a 40-Torr, {phi}=2.4 benzene/O{sub 2}/40%-N{sub 2} premixed flame to reach final equivalence ratios of {phi}=2.5 and 2.681. The results obtained showed that acetylene addition to early positions of the flame led to significant increase in pyrene production rates, but pyrene concentrations were lower in the flames with acetylene addition in both the {phi}=2.5 and 2.681 cases. Addition of benzene to the flame did not alter pyrene production rates in either the {phi}=2.5 or 2.681 cases; however, for {phi}=2.5, pyrene concentrations increased with benzene addition, while for {phi}=2.681, pyrene contents decreased in comparison to the correspondent flames with no addition. Acetylene addition led to a significant increase in pyrene production rates, but the pyrene levels dropped due to increase in the flow velocity. Pyrene production rates were not sensitive to benzene addition, but pyrene contents increased with benzene addition when the flow velocity decreased. These results show that PAH concentration changes accompanying species addition to flames should be interpreted carefully, because an increase or decrease in the content of a PAH species does not necessarily reflect an effect on its formation rate or mechanism. (author)

  2. Photochemistry of the PAH pyrene in water ice: the case for ion-mediated solid-state astrochemistry

    E-Print Network [OSTI]

    Bouwman, J; Bakker, A; Allamandola, L J; Linnartz, H

    2009-01-01

    Context. Icy dust grains play an important role in the formation of complex inter- and circumstellar molecules. Observational studies show that polycyclic aromatic hydrocarbons (PAHs) are abundantly present in the ISM in the gas phase. It is likely that these non-volatile species freeze out onto dust grains as well and participate in the astrochemical solid-state network, but experimental PAH ice studies are largely lacking. Methods. Near UV/VIS spectroscopy is used to track the in situ VUV driven photochemistry of pyrene containing ices at temperatures ranging from 10 to 125 K. Results. The main photoproducts of VUV photolyzed pyrene ices are spectroscopically identified and their band positions are listed for two host ices, \\water and CO. Pyrene ionisation is found to be most efficient in \\water ices at low temperatures. The reaction products, triplet pyrene and the 1-hydro-1-pyrenyl radical are most efficiently formed in higher temperature water ices and in low temperature CO ice. Formation routes and band...

  3. Mass transfer and biodegradation of PAH compounds from coal tar. Quarterly technical report, January--March 1993

    SciTech Connect (OSTI)

    Ramaswami, A.; Ghoshal, S.; Luthy, R.G.

    1994-09-01

    This study examines the role of physico-chemical mass transfer processes on the rate of biotransformation of polycyclic aromatic hydrocarbon (PAH) compounds released from non-aqueous phase liquid (NAPL) coal tar present at residual saturation within a microporous medium. A simplified coupled dissolution-degradation model is developed that describes the concurrent mass transfer and biokinetic processes occurring in the system. Model results indicate that a dimensionless Damkohler number can be utilized to distinguish between systems that are mass transfer limited, and those that are limited by biological phenomena. The Damkohler number is estimated from independent laboratory experiments that measure the rates of aqueous phase dissolution and biodegradation of naphthalene from coal tar. Experimental data for Stroudsburg coal tar imbibed within 236 {mu}m diameter silica particles yield Damkohler numbers smaller than unity, indicating, for the particular system under study, that the overall rate of biotransformation of naphthalene is not limited by the mass transfer of naphthalene from coal tar to the bulk aqueous phase. There is a need for investigation of mass transfer for larger particles and/or other PAH compounds, and study of microbial rate-limiting phenomena including toxicity, inhibition and competitive substrate utilization.

  4. RICH METHANE PREMIXED LAMINAR FLAMES DOPED BY LIGHT UNSATURATED HYDROCARBONS

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    RICH METHANE PREMIXED LAMINAR FLAMES DOPED BY LIGHT UNSATURATED HYDROCARBONS PART I: ALLENE developed in our laboratory for the reactions of C3-C4 unsaturated hydrocarbons. The main reaction pathways2007 #12;3 INTRODUCTION Soots and polyaromatic hydrocarbons (PAH), which are present in the exhaust gas

  5. Effects of the furnace temperature on the CO, CO{sub 2}, NO{sub x} and unburned hydrocarbon emissions from the combustion of coal and alternative fuels

    SciTech Connect (OSTI)

    Levendis, Y.A.; Atal, A.; Courtemanche, B.

    1999-07-01

    Results are presented on the emissions of carbon monoxide (CO), carbon dioxide (CO{sub 2}), unburned aromatic hydrocarbons, as well as oxides of nitrogen (NO{sub x}) from the combustion of pulverized bituminous coal, tire-derived fuel and, for a limited number of runs, waste plastics-derived fuel. The particle size cuts of pulverized coal, tire and plastics were 63--75 {micro}m and 180--300 {micro}m, respectively. Combustion experiments were conducted in a laboratory-scale drop-tube furnace at gas temperatures, in the range of 1,300--1,600 K, and several fuel mass loadings in the furnace, expressed in terms of global equivalence ratios in the range of 0.4--2.4. The CO, CO{sub 2} and NO{sub x} emissions were monitored continuously with infrared absorption and chemiluminescent instruments. Up to sixty 2-7 ring polynuclear aromatic hydrocarbons (PAH) were detected by capillary gas chromatography - mass spectrometry (GC-MS) techniques. Results showed that the PAH emission yields (mg/g fuel introduced) increased drastically with increasing bulk equivalence ratio (in the aforementioned range), at fixed furnace temperatures. This was also true for the CO yields, while the CO{sub 2} yields increased with increasing {o}, reached a maximum around stoichiometry and then decreased mildly. NO{sub x} yields decreased precipitously with increasing equivalence ratio. The CO and, especially, the PAH yields from tire-derived and plastics-derived fuels were much higher than those from coal, but the relative amounts of individual PAH components were remarkably similar in the combustion effluent of all fuels. The CO{sub 2} emissions and, especially, the NO{sub x} emissions from tire crumb were lower than those from coal. The CO{sub 2} emissions from plastics were comparable to those from coal, but their NO {sub x} emissions were much lower than those from tire. At fixed bulk equivalence ratios, however, as the furnace gas temperature increased the PAH yields from coal, tire crumb, and plastics decreased drastically, while the CO emission yields increased. At the highest temperature tested herein, 1,600 K ({approx}1,300 C), the effluent of the combustion of the fuels appeared to be devoid of PAHs. No{sub x} yields increased mildly with temperature. The influence of temperature, in this range, on the CO{sub 2} emissions was not significant. 65 refs., 2 figs., 1 tab.

  6. Cavity ring-down spectroscopy and vibronic activity of benzoghiperylene Xiaofeng Tana

    E-Print Network [OSTI]

    extensive laboratory astrophysics program for the study of interstellar polycyclic aromatic hydrocarbons aromatic hydrocarbons PAHs . PAHs have been suggested to be the possible molecular carriers the absorption spectra of these species in the gas phase with conventional spectroscopic techniques

  7. 7, 1569315721, 2007 Particulate PAH

    E-Print Network [OSTI]

    Boyer, Edmond

    dioxide, particulate PAHs are most strongly correlated with NOx. Mexico City's PAH-to-black carbon mass and particu- late properties at six locations throughout the city. The measurements were intended to5 support of sources and15 ages of particles are present. Among carbon monoxide, nitrogen oxides (NOx), and carbon

  8. PC66CH03-Kaiser ARI 13 November 2014 13:55 Reaction Dynamics in

    E-Print Network [OSTI]

    Kaiser, Ralf I.

    and (methyl-substituted) 1,3-butadiene have been found to synthesize polycyclic aromatic hydrocarbons (PAHs

  9. Factors Affecting Quantitative Analysis in Laser Desorption/Laser Ionization Mass Spectrometry

    E-Print Network [OSTI]

    Zare, Richard N.

    for polycyclic aromatic hydrocarbons (PAHs), lower than many conventional analytical techniques.20,21 * To whom of trace organic compounds, particularly polycyclic aromatic hydrocarbons (PAHs). Recent efforts have of complex mixtures. µL2MS has been most widely used to detect polycyclic aromatic hydrocarbons (PAHs

  10. Secondary Organic Aerosol Formation From Aromatic Hydrocarbon

    E-Print Network [OSTI]

    Tang, Ping

    2013-01-01

    Sources and Role in Atmospheric Chemistry. Science 276,2.5. Journal of Atmospheric Chemistry 47, 79–100. Kleinman,toluene and benzene. Atmospheric Chemistry and Physics 7,

  11. Secondary Organic Aerosol Formation From Aromatic Hydrocarbon

    E-Print Network [OSTI]

    Tang, Ping

    2013-01-01

    E.O. , Driscoll, D.J. , Speer, R.E. , Weathers, W.S. , 1999.E.O. , Driscoll, D.J. , Speer, R.E. , Weathers, W.S. ,

  12. Toxicity Analysis of Polycyclic Aromatic Hydrocarbon Mixtures 

    E-Print Network [OSTI]

    Naspinski, Christine S.

    2010-01-16

    . The collection of dust samples was coordinated by Dr. Leslie Cizmas, Dr. Ziad Naufal and Rebecca Lingenfelter in Texas, China, and Azerbaijan, respectively. Soil and mouse samples were collected from Azerbaijan by Dr. John Bickham and Dr. Cole Matson. Dust... Phillips, Dr. Ziad Naufal, Molly Richardson, Shirley Wang, Dr. Xinsheng Gu, Sui Ke, Dr. Liu Duan, Ying vi Xie, Dr. Cole Matson, Dr. Petros Dimitriou-Christidis, Dr. Erica Bruce, Dr. Henry Huebner, and Dr. Evans Afriyie-Gyawu. Finally, I would like...

  13. Photophysical Properties of Protonated Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Blake, Geoffrey

    Solyom from the Biology Division fixed a few chillers and vacuum pumps for me. I also enjoyed our long Eisner used my weakness for good food to introduce me to the sport of orienteering. Together, we had many

  14. Hydrocarbon cracking

    SciTech Connect (OSTI)

    McCoy, R.D.

    1980-12-02

    A cracking reactor is controlled in response to the proportion of heavy aromatic constituents in a feedstock to be cracked.

  15. Hydrocarbon conversion

    SciTech Connect (OSTI)

    Koepke, J.W.; Abdo, S.F.

    1989-10-03

    This patent describes a hydrocracking process. It comprises: catalyzing a hydrocracking reaction by contacting a hydrocarbon feedstock with a hydrocracking catalyst under hydrocracking conditions to produce a product hydrocarbon having an increased octane number than the hydrocarbon feedstock. The hydrocracking catalyst consists essentially of at least one niobium component, at least one Group VIII metal component and at least one cracking component.

  16. IUPAC-NIST Solubility Data Series. 81. Hydrocarbons with Water and Seawater Revised and Updated. Part 7. C8H12C8H18 Hydrocarbons

    E-Print Network [OSTI]

    IUPAC-NIST Solubility Data Series. 81. Hydrocarbons with Water and Seawater Revised and Updated. Part 7. C8H12­C8H18 Hydrocarbons with Water Volume Editors David G. Shawa... University of Alaska on the evaluation of the all experimental data for a given homologous series of aliphatic and aromatic hydrocarbons

  17. Selective thermal and photooxidation of hydrocarbons in zeolites by oxygen

    DOE Patents [OSTI]

    Frei, Heinz (Berkeley, CA); Blatter, Fritz (Basel, CH); Sun, Hai (Saint Charles, MO)

    2001-01-01

    A process for a combined selective thermal oxidation and photooxidation of hydrocarbons adsorbed onto zeolite matrices. A highly combined selective thermal oxidation and photooxidation of unsubstituted or alkyl substituted alkanes, alkenes, aromatics and cycloalkyls in solvent free zeolites under dark thermal conditions or under irradiation with visible light. The process oxidizes hydrocarbons almost completely selectively without substantial production of byproducts.

  18. Selective thermal and photooxidation of hydrocarbons in zeolites by oxygen

    DOE Patents [OSTI]

    Frei, H.; Blatter, F.; Sun, H.

    1999-06-22

    A process is described for selective thermal oxidation or photooxidation of hydrocarbons adsorbed onto zeolite matrices. A highly selective thermal oxidation and photooxidation of unsubstituted or alkyl substituted alkanes, alkenes, aromatics and cycloalkyls in solvent free zeolites under dark thermal conditions or under irradiation with visible light. The process oxidizes hydrocarbons almost completely selectively without substantial production of byproducts. 19 figs.

  19. Selective thermal and photooxidation of hydrocarbons in zeolites by oxygen

    DOE Patents [OSTI]

    Frei, Heinz (Berkeley, CA); Blatter, Fritz (Basel, CH); Sun, Hai (Saint Charles, MO)

    1999-01-01

    A process for selective thermal oxidation or photooxidation of hydrocarbons adsorbed onto zeolite matrices. A highly selective thermal oxidation and photooxidation of unsubstituted or alkyl substituted alkanes, alkenes, aromatics and cycloalkyls in solvent free zeolites under dark thermal conditions or under irradiation with visible light. The process oxidizes hydrocarbons almost completely selectively without substantial production of byproducts.

  20. Selective thermal oxidation of hydrocarbons in zeolites by oxygen

    DOE Patents [OSTI]

    Frei, Heinz (Berkeley, CA); Blatter, Fritz (Basel, CH); Sun, Hai (Saint Charles, MO)

    2000-01-01

    A process for selective thermal oxidation of hydrocarbons adsorbed onto zeolite matrices. A highly selective thermal oxidation of unsubstituted or alkyl substituted alkanes, alkenes, aromatics and cycloalkyls is carried out in solvent free zeolites under dark thermal conditions. The process oxidizes hydrocarbons almost completely selectively without substantial production of byproducts.

  1. Hydrocracking and recovering polynuclear aromatic compounds in slop wax stream

    SciTech Connect (OSTI)

    Gruia, A.J.

    1987-10-06

    This patent describes a catalytic hydrocracking process which comprises: (a) introducing a reduced crude into a fractionation zone to produce a vacuum gas oil stream having a propensity to form polynuclear aromatic compounds in a hydrocracking zone and a slop wax stream; (b) contacting the vacuum gas oil stream in a hydrocracking zone with added hydrogen and a metal promoted hydrocracking catalyst at elevated temperature and pressure sufficient to gain a substantial conversion to lower boiling products; (c) partially condensing the hydrocarbon effluent from the hydrocracking zone and separating the same into a low boiling hydrocarbon product stream and an unconverted hydrocarbon stream boiling above about 650/sup 0/F (343/sup 0/C) and containing trace quantities of polynuclear aromatic compounds; and (d) introducing at least a portion of the unconverted hydrocarbon stream containing polynuclear aromatic compounds into the fractionation zone thereby recovering a substantial portion of the polynuclear aromatic compounds in the slop wax stream which significantly minimizes the introduction of the polynuclear aromatic compounds into the hydrocracking zone.

  2. Environmental Toxicology and Chemistry, Vol. 22, No. 3, pp. 671677, 2003 Printed in the USA

    E-Print Network [OSTI]

    Fabrizio, Mary C.

    FROM POLYCYCLIC AROMATIC HYDROCARBON-CONTAMINATED SITES MARGARET MULVEY, MICHAEL C. NEWMAN,* WOLFGANG K or nucleotide diversity for mummichog from polycyclic aromatic hydrocarbon (PAH)­contaminated sites was observed of polycyclic aromatic hydrocarbons (PAHs), tributyltin, and other toxicants in water, sediments, and organisms

  3. Hydrous pyrolysis/oxidation process for in situ destruction of chlorinated hydrocarbon and fuel hydrocarbon contaminants in water and soil

    DOE Patents [OSTI]

    Knauss, Kevin G. (Livermore, CA); Copenhaver, Sally C. (Livermore, CA); Aines, Roger D. (Livermore, CA)

    2000-01-01

    In situ hydrous pyrolysis/oxidation process is useful for in situ degradation of hydrocarbon water and soil contaminants. Fuel hydrocarbons, chlorinated hydrocarbons, polycyclic aromatic hydrocarbons, petroleum distillates and other organic contaminants present in the soil and water are degraded by the process involving hydrous pyrolysis/oxidation into non-toxic products of the degradation. The process uses heat which is distributed through soils and water, optionally combined with oxygen and/or hydrocarbon degradation catalysts, and is particularly useful for remediation of solvent, fuel or other industrially contaminated sites.

  4. Lecture Session (LeS): E.1 In-situ chemical oxidation-1 ENA OF HETEROCYCLIC HYDROCARBONS USING HYDROGEN PEROXIDE AND

    E-Print Network [OSTI]

    Cirpka, Olaf Arie

    , In situ Biological Degradation, Heterocyclic Hydrocarbons, PAH, Field Trial, Groundwater Circulation WellsLecture Session (LeS): E.1 In-situ chemical oxidation-1 ENA OF HETEROCYCLIC HYDROCARBONS USING (GCW), Hydrogen Peroxide Introduction Heterocyclic hydrocarbons (NSO-HET) containing nitrogen (N

  5. Review Revised.2 ACS#62#86D7A1Printed 3/9/09 1 RESERVE THIS SPACE

    E-Print Network [OSTI]

    and laboratory astrophysics. Ionized polycyclic aromatic hydrocarbons (PAHs), shockingly large molecules and ice particles forming mixed molecular ices dominated by simple species such as water, methanol polycyclic aromatic hydrocarbons are ubiquitous throughout the modern Universe and there is mounting evidence

  6. Make aromatics from LPG

    SciTech Connect (OSTI)

    Doolan, P.C. ); Pujado, P.R. )

    1989-09-01

    Liquefied petroleum gas (LPG) consists mainly of the propane and butane fraction recovered from gas fields, associated petroleum gas and refinery operations. Apart from its use in steam cracking and stream reforming, LPG has few petrochemical applications. The relative abundance of LPG and the strong demand for aromatics - benzene, toluene and xylenes (BTX) - make it economically attractive to produce aromatics via the aromatization of propane and butanes. This paper describes the Cyclar process, which is based on a catalyst formulation developed by BP and which uses UOP's CCR catalyst regeneration technology, converts propane, butanes or mixtures thereof to petrochemical-quality aromatics in a single step.

  7. LeS D.4 Monitored Natural Attenuation -3 ENA OF HETEROCYCLIC HYDROCARBONS BY ADDING HYDROGEN PEROXIDE IN GROUND-

    E-Print Network [OSTI]

    Cirpka, Olaf Arie

    LeS D.4 Monitored Natural Attenuation - 3 ENA OF HETEROCYCLIC HYDROCARBONS BY ADDING HYDROGEN.troetschler@iws.uni-stuttgart.de Keywords: Enhanced Natural Attenuation, Aerobic Biological Degradation, Heterocyclic Hydro- carbons, PAH, Field Trial, Groundwater Circulation Wells (GCW) 1 Introduction Heterocyclic Hydrocarbons (NSO

  8. Relationship between hydrocarbon measurements and toxicity to a chironomid, fish larva and daphnid for oils and oil spill chemical

    E-Print Network [OSTI]

    Nyman, John

    Relationship between hydrocarbon measurements and toxicity to a chironomid, fish larva and daphnid the extent to which various common hydrocarbon measures can be used to predict toxicity to fresh- water measures used were TPHg, TPHFID, TPHMS, TTAH (sum of 41 target aromatic hydrocarbons), principal components

  9. BOND LENGTH IN BENZENOID HYDROCARBONS Mrcia M. C. Fereira and Rudolf Kiralj, Universidade Estadual de Campinas, Campinas, SP, 13084-

    E-Print Network [OSTI]

    Ferreira, Márcia M. C.

    1 BOND LENGTH IN BENZENOID HYDROCARBONS Márcia M. C. Fereira and Rudolf Kiralj, Universidade-carbon bond length in organic compounds, especially in aromatic hydrocarbons, is a tradicional subject calculation in planar benzenoid hydrocarbons, we must first to explain concepts like benzenoid system, data

  10. Ultrafast UV Pump/IR Probe Studies of C-H Activation in Linear, Cyclic, and Aryl Hydrocarbons

    E-Print Network [OSTI]

    Harris, Charles B.

    Ultrafast UV Pump/IR Probe Studies of C-H Activation in Linear, Cyclic, and Aryl Hydrocarbons, cyclic, and aromatic hydrocarbon solvents on a femtosecond to microsecond time scale. These results have revealed that the structure of the hydrocarbon substrate affects the final C-H bond activation step, which

  11. Apparatus for hydrocarbon extraction

    DOE Patents [OSTI]

    Bohnert, George W.; Verhulst, Galen G.

    2013-03-19

    Systems and methods for hydrocarbon extraction from hydrocarbon-containing material. Such systems and methods relate to extracting hydrocarbon from hydrocarbon-containing material employing a non-aqueous extractant. Additionally, such systems and methods relate to recovering and reusing non-aqueous extractant employed for extracting hydrocarbon from hydrocarbon-containing material.

  12. PLEASE SCROLL DOWN FOR ARTICLE This article was downloaded by: [CDL Journals Account

    E-Print Network [OSTI]

    Senkan, Selim M.

    Effects of three oxygenate additives (methanol, ethanol, and MTBE) on the formation of polycyclic aromatic://www.informaworld.com/smpp/title~content=t713456315 EFFECTS OF OXYGENATE ADDITIVES ON POLYCYCLIC AROMATIC HYDROCARBONS(PAHs) AND SOOT FORMATION Fikret, Selim M.(2002)'EFFECTS OF OXYGENATE ADDITIVES ON POLYCYCLIC AROMATIC HYDROCARBONS(PAHs) AND SOOT

  13. Operation of a two-phase partitioning bioreactor for the oxidation of anthracene by the enzyme manganese peroxidase

    E-Print Network [OSTI]

    Daugulis, Andrew J.

    Polycyclic aromatic hydrocarbons (PAHs) are ubiqui- tous pollutants released into the environment, generated are often contaminated with PAHs. There is toxicological concern about the presence of PAHs biodegradation of PAHs is mainly restricted by two factors: (i) the low water solubility of the PAHs and (ii

  14. Manipulation of ring strain and antiaromaticity in the design and synthesis of unique optoelectronic materials

    E-Print Network [OSTI]

    Parkhurst, Rebecca R. (Rebecca Rosenberg)

    2012-01-01

    Polycyclic aromatic hydrocarbons (PAHs) and fully-conjugated ladder polymers are leading candidates for organics electronics, as their inherent conformational rigidity encourages electron delocalization. Many of these ...

  15. Process for converting light alkanes to higher hydrocarbons

    DOE Patents [OSTI]

    Noceti, Richard P. (Pittsburgh, PA); Taylor, Charles E. (Pittsburgh, PA)

    1988-01-01

    A process is disclosed for the production of aromatic-rich, gasoline boiling range hydrocarbons from the lower alkanes, particularly from methane. The process is carried out in two stages. In the first, alkane is reacted with oxygen and hydrogen chloride over an oxyhydrochlorination catalyst such as copper chloride with minor proportions of potassium chloride and rare earth chloride. This produces an intermediate gaseous mixture containing water and chlorinated alkanes. The chlorinated alkanes are contacted with a crystalline aluminosilicate catalyst in the hydrogen or metal promoted form to produce gasoline range hydrocarbons with a high proportion of aromatics and a small percentage of light hydrocarbons (C.sub.2 -C.sub.4). The light hydrocarbons can be recycled for further processing over the oxyhydrochlorination catalyst.

  16. HYDROCARBONS & ENERGY FROM PLANTS

    E-Print Network [OSTI]

    Nemethy, E.K.

    2011-01-01

    LBL-8596 itr-t C,d.. HYDROCARBONS & ENERGY FROM PLANTS jmethods of isolating the hydrocarbon-like material from I.privatelyownedrights. HYDROCARBONS AND ENERGY FROM PLANTS

  17. Molecular and isotopic records of the combustion inputs to the environment over the last 250 yrs

    E-Print Network [OSTI]

    Lima, Ana Lúcia Cessel de, 1969-

    2004-01-01

    The most ubiquitous source of polycyclic aromatic hydrocarbons (PAHs) to the environment is incomplete combustion. This study generated a high-resolution historical record of pyrogenic PAH emissions since pre-industrial ...

  18. APPLIED AND ENVIRONMENTAL MICROBIOLOGY, 0099-2240/98/$04.00 0

    E-Print Network [OSTI]

    Ahmad, Sajjad

    , substituted naphthalenes, phenanthrene, biphenyl, anthracene, acenaphthene, and fluorene. Degradation Polycyclic Aromatic Hydrocarbon (PAH)- Degrading Cycloclasticus Strains from the Gulf of Mexico and Comparison of Their PAH Degradation Ability with That of Puget Sound Cycloclasticus Strains ALLISON D

  19. Fundamental spectroscopic studies of carbenes and hydrocarbon radicals

    SciTech Connect (OSTI)

    Gottlieb, C.A.; Thaddeus, P. [Harvard Univ., Cambridge, MA (United States)

    1993-12-01

    Highly reactive carbenes and carbon-chain radicals are studied at millimeter wavelengths by observing their rotational spectra. The purpose is to provide definitive spectroscopic identification, accurate spectroscopic constants in the lowest vibrational states, and reliable structures of the key intermediates in reactions leading to aromatic hydrocarbons and soot particles in combustion.

  20. PAH Sorption Mechanism and Partitioning Behavior in

    E-Print Network [OSTI]

    Zare, Richard N.

    of crude oil at high temperatures in the gas-making operation and is coated or impregnated with oil of oil at high temperatures. Lampblack Production. Lampblack and tar were byprod- ucts of the oilPAH Sorption Mechanism and Partitioning Behavior in Lampblack-Impacted Soils from Former Oil

  1. Polycyclic aromatic hydrocarbon and mid-infrared continuum emission...

    Office of Scientific and Technical Information (OSTI)

    fr Astronomie, Knigstuhl 17, D-69117 Heidelberg (Germany) Canada-France-Hawaii Telescope, 65-1238 Mamalahoa Hwy, Kamuela, HI 96743-8432 (United States) National...

  2. FROM INTERSTELLAR POLYCYCLIC AROMATIC HYDROCARBONS AND ICE TO ASTROBIOLOGY

    E-Print Network [OSTI]

    these interstellar materials simply providing the raw materials used for a completely endoginous origin-1000, USA Abstract Tremendous strides have been made in our understanding of interstellar material over materials comprised of amorphous and crystalline silicates mixed with an amorphous carbonaceous material

  3. Omeprazole Stimulates the Induction of Human Insulin-Like Growth Factor Binding Protein-1 through Aryl Hydrocarbon

    E-Print Network [OSTI]

    Perdew, Gary

    gene reveals the presence of an aryl hydrocarbon binding/dioxin response element (DRE). Quan- titative factor capable of binding dioxin response elements (DRE) and initiating transcription of Ah,3,7,8-tetrachlorodibenzo-p- dioxin (TCDD) being the prototypical example; polycyclic aromatic hydrocarbons, e.g., benzo

  4. Interlaboratory Analytical Comparison Study to Support Deepwater Horizon

    E-Print Network [OSTI]

    R. Kucklick Analytical Chemistry Division Material Measurement Laboratory National Institute tissue QA10TIS01 reported here. In this exercise, selected polycyclic aromatic hydrocarbons (PAHs have collected environmental samples for hydrocarbon analysis and submitted them to different

  5. Hydrocarbon in Catalyst in

    E-Print Network [OSTI]

    Ladkin, Peter B.

    #12;Hydrocarbon in Steam in Catalyst in Vent 1 Vent 2 Product out Tank Pressure controller Computer;#12;Vent 1 Vent 2 Product outHydrocarbon in Steam in Catalyst in light Warning Computer controller Tank

  6. Hydrocarbon in Catalyst in

    E-Print Network [OSTI]

    Ladkin, Peter B.

    Hydrocarbon in Steam in Catalyst in Vent 1 Vent 2 Product out Tank Pressure #12;#12;#12;#12;#12;#12;#12;#12;Hydrocarbon in Steam in Catalyst in Vent 1 Vent 2 Product out Tank Pressure controller Computer operator

  7. Process for conversion of lignin to reformulated hydrocarbon gasoline

    DOE Patents [OSTI]

    Shabtai, Joseph S. (Salt Lake City, UT); Zmierczak, Wlodzimierz W. (Salt Lake City, UT); Chornet, Esteban (Golden, CO)

    1999-09-28

    A process for converting lignin into high-quality reformulated hydrocarbon gasoline compositions in high yields is disclosed. The process is a two-stage, catalytic reaction process that produces a reformulated hydrocarbon gasoline product with a controlled amount of aromatics. In the first stage, a lignin material is subjected to a base-catalyzed depolymerization reaction in the presence of a supercritical alcohol as a reaction medium, to thereby produce a depolymerized lignin product. In the second stage, the depolymerized lignin product is subjected to a sequential two-step hydroprocessing reaction to produce a reformulated hydrocarbon gasoline product. In the first hydroprocessing step, the depolymerized lignin is contacted with a hydrodeoxygenation catalyst to produce a hydrodeoxygenated intermediate product. In the second hydroprocessing step, the hydrodeoxygenated intermediate product is contacted with a hydrocracking/ring hydrogenation catalyst to produce the reformulated hydrocarbon gasoline product which includes various desirable naphthenic and paraffinic compounds.

  8. Aromatic molecules as spintronic devices

    SciTech Connect (OSTI)

    Ojeda, J. H.; Orellana, P. A.; Laroze, D.

    2014-03-14

    In this paper, we study the spin-dependent electron transport through aromatic molecular chains attached to two semi-infinite leads. We model this system taking into account different geometrical configurations which are all characterized by a tight binding Hamiltonian. Based on the Green's function approach with a Landauer formalism, we find spin-dependent transport in short aromatic molecules by applying external magnetic fields. Additionally, we find that the magnetoresistance of aromatic molecules can reach different values, which are dependent on the variations in the applied magnetic field, length of the molecules, and the interactions between the contacts and the aromatic molecule.

  9. NATURAL MARINE HYDROCARBON SEEPAGE

    E-Print Network [OSTI]

    Luyendyk, Bruce

    oil and gas (Fischer, 1977).The offshore gaseous seepage is controlled Geology; November 1999; v. 27; no. 11; p. 1047­1050; 4 figures. 1047 Decrease in natural marine hydrocarbon seepage near Coal OilNATURAL MARINE HYDROCARBON SEEPAGE Hydrocarbon seepage from the world's conti- nental shelves

  10. 2, 16451664, 2005 Hydrocarbon

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    BGD 2, 1645­1664, 2005 Hydrocarbon emissions from a boreal fen S. Haapanala et al. Title Page Discussions is the access reviewed discussion forum of Biogeosciences Measurements of hydrocarbon emissions Hydrocarbon emissions from a boreal fen S. Haapanala et al. Title Page Abstract Introduction Conclusions

  11. Is cyclobutane a hydrocarbon?

    E-Print Network [OSTI]

    Martin, Ralph R.

    Is cyclobutane a hydrocarbon? Biologically interesting entities possibly > 1,000,000 Does cyclobutane have a four- membered ring? Is cyclobutane a hydrocarbon? Expressive and decidable formalism needs to be classified under chemical classes: Is dinitrogen inorganic? Is acetylene a hydrocarbon

  12. Anaerobic Hydrocarbon Degradation in

    E-Print Network [OSTI]

    Bruns, Tom

    Anaerobic Hydrocarbon Degradation in Petroleum-Contaminated Harbor Sediments under Sulfate of iron(III) oxide to stimulate in- situ hydrocarbon degradation in anaerobic petroleum- contaminated did not stimulate anaerobic hydrocarbon oxidation. Exposure of the sediment to air [to reoxidize Fe

  13. Catalytic Fast Pyrolysis for the Production of the Hydrocarbon Biofuels

    SciTech Connect (OSTI)

    Nimlos, M. R.; Robichaud, D. J.; Mukaratate, C.; Donohoe, B. S.; Iisa, K.

    2013-01-01

    Catalytic fast pyrolysis is a promising technique for conversion of biomass into hydrocarbons for use as transportation fuels. For over 30 years this process has been studied and it has been demonstrated that oils can be produced with high concentrations of hydrocarbons and low levels of oxygen. However, the yields from this type of conversion are typically low and the catalysts, which are often zeolites, are quickly deactivated through coking. In addition, the hydrocarbons produced are primarily aromatic molecules (benzene, toluene, xylene) that not desirable for petroleum refineries and are not well suited for diesel or jet engines. The goals of our research are to develop new multifunction catalysts for the production of gasoline, diesel and jet fuel range molecules and to improve process conditions for higher yields and low coking rates. We are investigating filtration and the use of hydrogen donor molecules to improve catalyst performance.

  14. Fuel-flexible partial oxidation reforming of hydrocarbons for automotive applications.

    SciTech Connect (OSTI)

    Ahmed, S.; Carter, J. D.; Kopasz, J. P.; Krumpelt, M.; Wilkenhoener, R.

    1999-06-07

    Micro-reactor tests indicate that our partial oxidation catalyst is fuel-flexible and can reform conventional (gasoline and diesel) and alternative (ethanol, methanol, natural gas) fuels to hydrogen rich product gases with high hydrogen selectivity. Alcohols are reformed at lower temperatures (< 600 C) while alkanes and unsaturated hydrocarbons require slightly higher temperatures. Cyclic hydrocarbons and aromatics have also been reformed at relatively low temperatures, however, a different mechanism appears to be responsible for their reforming. Complex fuels like gasoline and diesel, which are mixtures of a broad range of hydrocarbons, require temperatures of > 700 C for maximum hydrogen production.

  15. Recovering hydrocarbons from hydrocarbon-containing vapors

    DOE Patents [OSTI]

    Mirza, Zia I. (La Verne, CA); Knell, Everett W. (Los Alamitos, CA); Winter, Bruce L. (Danville, CA)

    1980-09-30

    Values are recovered from a hydrocarbon-containing vapor by contacting the vapor with quench liquid consisting essentially of hydrocarbons to form a condensate and a vapor residue, the condensate and quench fluid forming a combined liquid stream. The combined liquid stream is mixed with a viscosity-lowering liquid to form a mixed liquid having a viscosity lower than the viscosity of the combined liquid stream to permit easy handling of the combined liquid stream. The quench liquid is a cooled portion of the mixed liquid. Viscosity-lowering liquid is separated from a portion of the mixed liquid and cycled to form additional mixed liquid.

  16. Engineering Chlorinated hydrocarbons such as

    E-Print Network [OSTI]

    Chemical Engineering Abstract Chlorinated hydrocarbons such as trichloroethylene (TCE) form a class carriers/supports for NZVI particles to address the in situ remediation of chlorinated hydrocarbons. We

  17. The particulate and vapor phase components of airborne polyaromatic hydrocarbons (PAHs) in coal gasification pilot plants 

    E-Print Network [OSTI]

    Brink, Eric Jon

    1980-01-01

    gas, ammonia, and other chemicals from coal. For example, coal is being gasified today in Turkey, India, South Africa, Scotland, Morocco, Yugoslavia, and Korea, Coal conversion was a large scale operation in Germany in World War II and supplied 85... on the process, such as: process options, type of coal feedstock, gasifier operational mode, and purification processes. However, there are similarities that permit a discussion of the fundamental process steps. A block diagram of a generalized coal...

  18. Evidence of Reactive Aromatics As a Major Source of Peroxy Acetyl Nitrate over China

    SciTech Connect (OSTI)

    Liu, Zhen; Wang, Yuhang; Gu, Dasa; Zhao, Chun; Huey, L. G.; Stickel, Robert; Liao, Jin; Shao, Min; Zhu, T.; Zeng, Limin; Liu, Shaw C.; Chang, Chih-Chung; Amoroso, Antonio; Costabile, Francesa

    2010-09-15

    We analyze the observations of near-surface peroxy acetyl nitrate (PAN) and its precursors in Beijing, China in August of 2007. The levels of PAN are remarkably high (up to 14 ppbv), surpassing those measured over other urban regions in recent years. Analyses employing a 1-D version of a chemical transport model (Regional chEmical and trAnsport Model, REAM) indicate that aromatic non-methane hydrocarbons (NMHCs) are the dominant (55-75%) PAN source. The major oxidation product of aromatics that produces acetyl peroxy radicals is methylglyoxal (MGLY). PAN and O3 in the observations are correlated at daytime; aromatic NMHCs appear to play an important role in O3 photochemistry. Previous NMHC measurements indicate the presence of reactive aromatics at high levels over broad polluted regions of China. Aromatics are often ignored in global and (to a lesser degree) regional 3D photochemical transport models; their emissions over China as well as photochemistry are quite uncertain.Our findings suggest that critical assessments of aromatics emissions and chemistry (such as the yields of MGLY) are necessary to understand and assess ozone photochemistry and regional pollution export in China.

  19. Plasma Processing Of Hydrocarbon

    SciTech Connect (OSTI)

    Grandy, Jon D; Peter C. Kong; Brent A. Detering; Larry D. Zuck

    2007-05-01

    The Idaho National Laboratory (INL) developed several patented plasma technologies for hydrocarbon processing. The INL patents include nonthermal and thermal plasma technologies for direct natural gas to liquid conversion, upgrading low value heavy oil to synthetic light crude, and to convert refinery bottom heavy streams directly to transportation fuel products. Proof of concepts has been demonstrated with bench scale plasma processes and systems to convert heavy and light hydrocarbons to higher market value products. This paper provides an overview of three selected INL patented plasma technologies for hydrocarbon conversion or upgrade.

  20. Optical Spectroscopic Studies of Mononitrated Benzo[a]pyrenes Shubham Vyas,

    E-Print Network [OSTI]

    Dutta, Prabir K.

    Ps in methanol. On the basis of optimization of the triplet states, different photochemical consequences to the aromatic plane and the observed properties of the NBaP are discussed. 1. Introduction Emitted particulate compounds. Significantly, polycyclic aromatic hydrocarbons (including nitro-PAHs and oxy-PAHs) comprise 50

  1. Phytoremediation offers an ecologically and economically attractive remediation technique for soils contaminated with

    E-Print Network [OSTI]

    for soils contaminated with polycyclic aromatic hydrocarbons (PAHs). In addition to the choice of plant decade, phytoremediation of contaminated soils, sediments, and ground water has emerged of fertilization and clipping on PAH dissipation in a nutrient-poor, aged PAH-contaminated soil, a 14-mo

  2. Detection of chlorinated aromatic compounds

    DOE Patents [OSTI]

    Ekechukwu, A.A.

    1996-02-06

    A method for making a composition for measuring the concentration of chlorinated aromatic compounds in aqueous fluids, and an optical probe for use with the method are disclosed. The composition comprises a hydrophobic polymer matrix, preferably polyamide, with a fluorescent indicator uniformly dispersed therein. The indicator fluoresces in the presence of the chlorinated aromatic compounds with an intensity dependent on the concentration of these compounds in the fluid of interest, such as 8-amino-2-naphthalene sulfonate. The probe includes a hollow cylindrical housing that contains the composition in its distal end. The probe admits an aqueous fluid to the probe interior for exposure to the composition. An optical fiber transmits excitation light from a remote source to the composition while the indicator reacts with chlorinated aromatic compounds present in the fluid. The resulting fluorescence light signal is reflected to a second optical fiber that transmits the light to a spectrophotometer for analysis. 5 figs.

  3. Chemistry of Furan Conversion into Aromatics and Olefins over HZSM-5: A Model Biomass Conversion Reaction

    SciTech Connect (OSTI)

    Cheng, Yu-Ting; Huber, George W.

    2011-06-03

    The conversion of furan (a model of cellulosic biomass) over HZSM-5 was investigated in a thermogravimetric analysis–mass spectrometry system, in situ Fourier transform infrared analysis, and in a continuous-flow fixed-bed reactor. Furan adsorbed as oligomers at room temperature with a 1.73 of adsorbed furan/Al ratio. These oligomers were polycyclic aromatic compounds that were converted to CO, CO?, aromatics, and olefins at temperatures from 400 to 600 °C. Aromatics (e.g., benzene, toluene, and naphthalene), oligomer isomers (e.g., benzofuran, 2,2-methylenebisfuran, and benzodioxane), and heavy oxygenates (C??{sub +} oligomers) were identified as intermediates formed inside HZSM-5 at different reaction temperatures. During furan conversion, graphite-type coke formed on the catalyst surface, which caused the aromatics and olefins formation to deactivate within the first 30 min of time on-stream. We have measured the effects of space velocity and temperature for furan conversion to help us understand the chemistry of biomass conversion inside zeolite catalysts. The major products for furan conversion included CO, CO?, allene, C?–C? olefins, benzene, toluene, styrene, benzofuran, indene, and naphthalene. The aromatics (benzene and toluene) and olefins (ethylene and propylene) selectivity decreased with increasing space velocity. Unsaturated hydrocarbons such as allene, cyclopentadiene, and aromatics selectivity increased with increasing space velocity. The product distribution was selective to olefins and CO at high temperatures (650 °C) but was selective to aromatics (benzene and toluene) at intermediate temperatures (450–600 °C). At low temperatures (450 °C), benzofuran and coke contributed 60% of the carbon selectivity. Several different reactions were occurring for furan conversion over zeolites. Some important reactions that we have identified in this study include Diels–Alder condensation (e.g., two furans form benzofuran and water), decarbonylation (e.g., furan forms CO and allene), oligomerization (allene forms olefins and aromatics plus hydrogen), and alkylation (e.g., furan plus olefins). The product distribution was far from thermodynamic equilibrium.

  4. Membrane separation of hydrocarbons

    DOE Patents [OSTI]

    Funk, Edward W. (Highland Park, IL); Kulkarni, Sudhir S. (Hoffman Estates, IL); Chang, Y. Alice (Des Plaines, IL)

    1986-01-01

    Mixtures of heavy oils and light hydrocarbons may be separated by passing the mixture over a polymeric membrane which comprises a polymer capable of maintaining its integrity in the presence of hydrocarbon compounds at temperature ranging from about ambient to about 100.degree. C. and pressures ranging from about 50 to about 1000 psi. The membranes which possess pore sizes ranging from about 10 to about 500 Angstroms are cast from a solvent solution and recovered.

  5. HYDROCARBONS FROM PLANTS: ANALYTICAL METHODS AND OBSERVATIONS

    E-Print Network [OSTI]

    Calvin, Melvin

    2013-01-01

    molecular weights of various hydrocarbon materials for fuelof oil and alcohol from hydrocarbon-producing plants. Into Die Naturwissenschaften HYDROCARBONS FROM PLANTS: METHODS

  6. Hydrocarbon Reservoir Parameter Estimation Using

    E-Print Network [OSTI]

    van Vliet, Lucas J.

    Hydrocarbon Reservoir Parameter Estimation Using Production Data and Time-Lapse Seismic #12;#12;Hydrocarbon Reservoir Parameter Estimation Using Production Data and Time-Lapse Seismic PROEFSCHRIFT ter . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1.2 Recovery process . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1.3 Field

  7. Catalysts and process for liquid hydrocarbon fuel production

    DOE Patents [OSTI]

    White, Mark G; Liu, Shetian

    2014-12-09

    The present invention provides a novel process and system in which a mixture of carbon monoxide and hydrogen synthesis gas, or syngas, is converted into hydrocarbon mixtures composed of high quality gasoline components, aromatic compounds, and lower molecular weight gaseous olefins in one reactor or step. The invention utilizes a novel molybdenum-zeolite catalyst in high pressure hydrogen for conversion, as well as a novel rhenium-zeolite catalyst in place of the molybdenum-zeolite catalyst, and provides for use of the novel catalysts in the process and system of the invention.

  8. Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop: Agenda and Objectives Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop:...

  9. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, L.A. Jr.; Arganbright, R.P.; Hearn, D.

    1994-06-14

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C[sub 2] to C[sub 10] olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80 C to 500 C, using as the catalyst a molecular sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene below the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms. 1 fig.

  10. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, L.A. Jr.; Arganbright, R.P.; Hearn, D.

    1993-09-07

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C[sub 2] to C[sub 10] olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80 C to 500 C, using as the catalyst a molecular sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene to about the mid point of the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms. 1 figures.

  11. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, Jr., Lawrence A. (Bellaire, TX); Arganbright, Robert P. (Seabrook, TX); Hearn, Dennis (Houston, TX)

    1994-01-01

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C.sub.2 to C.sub.10 olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80.degree. C. to 500.degree. C., using as the catalyst a mole sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene below the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms.

  12. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, Jr., Lawrence A. (Houston, TX)

    1989-01-01

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C.sub.2 to C.sub.10 olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80.degree. C. to 500.degree. C., using as the catalyst a mole sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene below the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms.

  13. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, L.A. Jr.

    1989-07-18

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C[sub 2] to C[sub 10] olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80 C to 500 C, using as the catalyst a mole sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene below the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms. 1 fig.

  14. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, Jr., Lawrence A. (Bellaire, TX); Arganbright, Robert P. (Seabrook, TX); Hearn, Dennis (Houston, TX)

    1993-01-01

    Aromatic compounds are alkylated in a catalytic distillation, wherein the catalyst structure also serves as a distillation component by contacting the aromatic compound with a C.sub.2 to C.sub.10 olefin in the catalyst bed under 0.25 to 50 atmospheres of pressure and at temperatures in the range of 80.degree. C. to 500.degree. C., using as the catalyst a mole sieve characterized as acidic or an acidic cation exchange resin. For example, ethyl benzene is produced by feeding ethylene to about the mid point of the catalyst bed while benzene is conveniently added through the reflux in molar excess to that required to react with ethylene, thereby reacting substantially all of the ethylene and recovering benzene as the principal overhead and ethyl benzene in the bottoms.

  15. Nucleophilic fluorination of aromatic compounds

    DOE Patents [OSTI]

    Satyamurthy, Nagichettiar; Barrio, Jorge R

    2014-03-18

    Iodylbenzene derivatives substituted with electron donating as well as electron withdrawing groups on the aromatic ring are used as precursors in aromatic nucleophilic substitution reactions. The iodyl group (IO.sub.2) is regiospecifically substituted by nucleophilic fluoride to provide the corresponding fluoroaryl derivatives. No-carrier-added [F-18]fluoride ion derived from anhydrous [F-18](F/Kryptofix, [F-18]CsF or a quaternary ammonium fluoride (e.g., Me.sub.4NF, Et.sub.4NF, n-Bu.sub.4NF, (PhCH.sub.2).sub.4NF) exclusively substitutes the iodyl moiety in these derivatives and provides high specific activity F-18 labeled fluoroaryl analogs. Iodyl derivatives of a benzothiazole analog and 6-iodyl-L-dopa derivatives have been synthesized as precursors and have been used in the preparation of no-carrier-added [F-18]fluorobenzothiazole as well as 6-[F-18]fluoro-L-dopa.

  16. Dispersant solutions for dispersing hydrocarbons

    DOE Patents [OSTI]

    Tyndall, R.L.

    1997-03-11

    A dispersant solution includes a hydrocarbon dispersing solution derived from a bacterium from ATCC 75527, ATCC 75529, or ATCC 55638.

  17. Dispersant solutions for dispersing hydrocarbons

    DOE Patents [OSTI]

    Tyndall, Richard L. (Clinton, TN)

    1997-01-01

    A dispersant solution includes a hydrocarbon dispersing solution derived from a bacterium from ATCC 75527, ATCC 75529, or ATCC 55638.

  18. Oil biodegradation and bioremediation: A tale of the two worst spills in U.S. history

    E-Print Network [OSTI]

    Atlas, R.M.

    2012-01-01

    Exxon Valdez oil spill: A multispecies assessment. Environ.PAH exposure assessment: weathering of Oil in the waterAssessment of polycyclic aromatic hydrocarbon exposure in the waters of Prince William Sound after the Exxon Valdez oil

  19. Growth of large molecules and small grains T. J. Millar 1

    E-Print Network [OSTI]

    Millar, Tom

    but have large abun- dances of both small, H 2 O, NH 3 , H 2 S, CH 4 , and large, methanol CH 3 OH, ethanol from a family of molecules, the polycyclic aromatic hydrocarbons (PAHs) [12]. They are normally

  20. Agron. Sustain. Dev. 26 (2006) 269275 269 c INRA, EDP Sciences, 2007

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    2006-01-01

    extractable by methanol up to 64 days of incubation, amounting from 44.5 to 80.2% of initial radioactivity / agricultural soil / water quality 1. INTRODUCTION Polycyclic aromatic hydrocarbons (PAHs) of anthropic ori- gin

  1. Induction of murine CYP1A2 gene expression by acenaphthylene 

    E-Print Network [OSTI]

    Miggins, John Wesley

    1996-01-01

    Acenaphthylene and related polynuclear aromatic hydrocarbons (PAH) are industrial combustion by-products which are also found in cooked foods. Recent studies in this laboratory have shown that acenaphthylene induces Cypla2 ...

  2. Computer simulation of carcinogenic processes

    SciTech Connect (OSTI)

    Silverman, B.D. (International Business Machines Corp., Yorktown Heights, NY (USA). Thomas J. Watson Research Center)

    1988-01-01

    This book contains six chapters. Some of the titles are: Protein Structure and Oncogenesis: A Study of the P21 Protein; Confirmational Calculations on Oncogene Products; and Molecular Conformation and Polycyclic Aromatic Hydrocarbon (PAH) Carcinogenesis.

  3. Biomarkers of Exposure to Foodborne and Environmental Carcinogens: Enterosorbent Intervention in a High Risk Population 

    E-Print Network [OSTI]

    Johnson, Natalie Malek

    2011-10-21

    and polycyclic aromatic hydrocarbons (PAHs) have been useful in providing information on population exposure and reducing associated public health impacts. Aflatoxins are fungal metabolites found in a variety of foods. Among these toxins, aflatoxin B1 (AFB1...

  4. Optrode for sensing hydrocarbons

    DOE Patents [OSTI]

    Miller, H.; Milanovich, F.P.; Hirschfeld, T.B.; Miller, F.S.

    1987-05-19

    A two-phase system employing the Fujiwara reaction is provided for the fluorometric detection of halogenated hydrocarbons. A fiber optic is utilized to illuminate a column of pyridine trapped in a capillary tube coaxially attached at one end to the illuminating end of the fiber optic. A strongly alkaline condition necessary for the reaction is maintained by providing a reservoir of alkali in contact with the column of pyridine, the surface of contact being adjacent to the illuminating end of the fiber optic. A semipermeable membrane caps the other end of the capillary tube, the membrane being preferentially permeable to the halogenated hydrocarbon but preferentially impermeable to water and pyridine. As the halogenated hydrocarbon diffuses through the membrane and into the column of pyridine, fluorescent reaction products are formed. Light propagated by the fiber optic from a light source, excites the fluorescent products. Light from the fluorescence emission is also collected by the same fiber optic and transmitted to a detector. The intensity of the fluorescence gives a measure of the concentration of the halogenated hydrocarbons. 6 figs.

  5. Environmental Toxicology and Chemistry, Vol. 22, No. 10, pp. 22802292, 2003 Printed in the USA

    E-Print Network [OSTI]

    Rockne, Karl J.

    --Polycyclic aromatic hydrocarbon (PAH) contamination of the environment represents a serious threat to the health of contamination to drinking water supplies and thereby consti- tute a substantial health hazard for current IN ENHANCING BIODEGRADATION OF POLYCYCLIC AROMATIC HYDROCARBONS RANDHIR S. MAKKAR and KARL J. ROCKNE

  6. Revisiting the photodissociation dynamics of the phenyl radical Neil C. Cole-Filipiak, Mark Shapero, Bogdan Negru, and Daniel M. Neumark

    E-Print Network [OSTI]

    Neumark, Daniel M.

    and desorption by 157-nm photoirradiation of amorphous solid water J. Chem. Phys. 140, 094702 (2014); 10 at reducing the nascent internal energy of the phenyl radical and eliminating signal from contaminants. Under intermediate in the combustion of aromatic hydrocarbons1 and formation of polycyclic aromatic hydrocarbons (PAH

  7. Life Sciences Division Open Literature Publications

    E-Print Network [OSTI]

    Pennycook, Steve

    Aromatic Hydrocarbons (PAH) Vapors at High Temperatures," Spectrochimica Acta, Part A, 57:1377­1384 (2001- Dinh, "High-temperature vapor detection of polycyclic aromatic hydrocarbon fluorescence," Fuel 80(12):1819­1824 (Oct. 2001). Coleman, R. L., "A Method for Concurrent and Continuous Measurement of Rn-222 and Rn-220

  8. Published: April 05, 2011 r 2011 American Chemical Society 1296 dx.doi.org/10.1021/ct100607w |J. Chem. Theory Comput. 2011, 7, 12961306

    E-Print Network [OSTI]

    Herbert, John

    -Functional Description of the 1 La State in Polycyclic Aromatic Hydrocarbons: Charge-Transfer Character in Disguise? Ryan aromatic hydrocarbons (PAHs) includes two singlet excited states that are often denoted 1 La and 1 Lb. Time operator into short- and long-range components.8,15,21À23 While conventional TD-DFT's propensity

  9. Hydrocarbonization research: completion report

    SciTech Connect (OSTI)

    Youngblood, E.L.; Cochran, H.D. Jr.; Westmoreland, P.R.; Brown, C.H. Jr.; Oswald, G.E.; Barker, R.E.

    1981-01-01

    Hydrocarbonization is a relatively simple process used for producing oil, substitute natural gas, and char by heating coal under a hydrogen-rich atmosphere. This report describes studies that were performed in a bench-scale hydrocarbonization system at Oak Ridge National Laboratory (ORNL) during the period 1975 to 1978. The results of mock-up studies, coal metering valve and flowmeter development, and supporting work in an atmospheric hydrocarbonization system are also described. Oil, gas, and char yields were determined by hydrocarbonization of coal in a 0.1-m-diam fluidized-bed reactor operated at a pressure of 2170 kPa and at temperatures ranging from 694 to 854 K. The nominal coal feed rate was 4.5 kg/h. Wyodak subbituminous coal was used for most of the experiments. A maximum oil yield of approx. 21% based on moisture- and ash-free (maf) coal was achieved in the temperature range of 810 to 840 K. Recirculating fluidized-bed, uniformly fluidized-bed, and rapid hydropyrolysis reactors were used. A series of operability tests was made with Illinois No. 6 coal to determine whether caking coal could be processed in the recirculating fluidized-bed reactor. These tests were generally unsuccessful because of agglomeration and caking problems; however, these problems were eliminated by the use of chemically pretreated coal. Hydrocarbonization experiments were carried out with Illinois No. 6 coal that had been pretreated with CaO-NaOH, Na/sub 2/CO/sub 3/, and CaO-Na/sub 2/CO/sub 3/. Oil yields of 14, 24, and 21%, respectively, were obtained from the runs with treated coal. Gas and char yield data and the composition of the oil, gas, and char products are presented.

  10. Process and catalyst for converting synthesis gas to liquid hydrocarbon mixture

    DOE Patents [OSTI]

    Rao, V. Udaya S. (Monroeville, PA); Gormley, Robert J. (Pittsburgh, PA)

    1987-01-01

    Synthesis gas containing CO and H.sub.2 is converted to a high-octane hydrocarbon liquid in the gasoline boiling point range by bringing the gas into contact with a heterogeneous catalyst including, in physical mixture, a zeolite molecular sieve, cobalt at 6-20% by weight, and thoria at 0.5-3.9% by weight. The contacting occurs at a temperature of 250.degree.-300.degree. C., and a pressure of 10-30 atmospheres. The conditions can be selected to form a major portion of the hydrocarbon product in the gasoline boiling range with a research octane of more than 80 and less than 10% by weight aromatics.

  11. Hydrocarbon anomaly in soil gas as near-surface expressions of upflows and outflows in geothermal systems

    SciTech Connect (OSTI)

    Ong, H.L.; Higashihara, M.; Klusman, R.W.; Voorhees, K.J.; Pudjianto, R.; Ong, J

    1996-01-24

    A variety of hydrocarbons, C1 - C12, have been found in volcanic gases (fumarolic) and in geothermal waters and gases. The hydrocarbons are thought to have come from products of pyrolysis of kerogen in sedimentary rocks or they could be fed into the geothermal system by the recharging waters which may contain dissolved hydrocarbons or hydrocarbons extracted by the waters from the rocks. In the hot geothermal zone, 300°+ C, many of these hydrocarbons are in their critical state. It is thought that they move upwards due to buoyancy and flux up with the upflowing geothermal fluids in the upflow zones together with the magmatic gases. Permeability which could be provided by faults, fissures, mini and micro fractures are thought to provide pathways for the upward flux. A sensitive technique (Petrex) utilizing passive integrative adsorption of the hydrocarbons in soil gas on activated charcoal followed by desorption and analysis of the hydrocarbons by direct introduction mass spectrometry allows mapping of the anomalous areas. Surveys for geothermal resources conducted in Japan and in Indonesia show that the hydrocarbon anomaly occur over known fields and over areas strongly suspected of geothermal potential. The hydrocarbons found and identified were n-paraffins (C7-C9) and aromatics (C7-C8). Detection of permeable, i.e. active or open faults, parts of older faults which have been reactivated, e.g. by younger intersecting faults, and the area surrounding these faulted and permeable region is possible. The mechanism leading to the appearance of the hydrocarbon in the soil gas over upflow zones of the geothermal reservoir is proposed. The paraffins seems to be better pathfinders for the location of upflows than the aromatics. However the aromatics may, under certain circumstances, give better indications of the direction of the outflow of the geothermal system. It is thought that an upflow zone can be defined when conditions exist where the recharging waters containing the hydrocarbons feed into the geothermal kitchen. The existence of open and active faults, fissures, mini and micro fractures allow sufficient permeability for the gases to flux up and express themselves at the surface as hydrocarbon anomaly in the soil gas. When any of the requirements is absent, i.e. in the absence of the recharging waters, hydrocarbons, temperature, or permeability, no anomaly can be expected. It assumes a dynamic convective system, i.e. recharging waters, upflow and outflow. The anomalies however can define to a certain extent, regions of geothermal upflow, buoyant transport of gases, and frequently down-gradient of cooling waters.

  12. Membrane separation of hydrocarbons

    DOE Patents [OSTI]

    Chang, Y. Alice (Des Plaines, IL); Kulkarni, Sudhir S. (Hoffman Estates, IL); Funk, Edward W. (Highland Park, IL)

    1986-01-01

    Mixtures of heavy oils and light hydrocarbons may be separated by passing the mixture through a polymeric membrane. The membrane which is utilized to effect the separation comprises a polymer which is capable of maintaining its integrity in the presence of hydrocarbon compounds and which has been modified by being subjected to the action of a sulfonating agent. Sulfonating agents which may be employed will include fuming sulfuric acid, chlorosulfonic acid, sulfur trioxide, etc., the surface or bulk modified polymer will contain a degree of sulfonation ranging from about 15 to about 50%. The separation process is effected at temperatures ranging from about ambient to about 100.degree. C. and pressures ranging from about 50 to about 1000 psig.

  13. Quantum transport through aromatic molecules

    SciTech Connect (OSTI)

    Ojeda, J. H.; Rey-González, R. R.; Laroze, D.

    2013-12-07

    In this paper, we study the electronic transport properties through aromatic molecules connected to two semi-infinite leads. The molecules are in different geometrical configurations including arrays. Using a nearest neighbor tight-binding approach, the transport properties are analyzed into a Green's function technique within a real-space renormalization scheme. We calculate the transmission probability and the Current-Voltage characteristics as a function of a molecule-leads coupling parameter. Our results show different transport regimes for these systems, exhibiting metal-semiconductor-insulator transitions and the possibility to employ them in molecular devices.

  14. Direct hydrocarbon fuel cells

    DOE Patents [OSTI]

    Barnett, Scott A.; Lai, Tammy; Liu, Jiang

    2010-05-04

    The direct electrochemical oxidation of hydrocarbons in solid oxide fuel cells, to generate greater power densities at lower temperatures without carbon deposition. The performance obtained is comparable to that of fuel cells used for hydrogen, and is achieved by using novel anode composites at low operating temperatures. Such solid oxide fuel cells, regardless of fuel source or operation, can be configured advantageously using the structural geometries of this invention.

  15. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, Jr., Lawrence A. (Bellaire, TX); Arganbright, Robert P. (Seabrook, TX); Hearn, Dennis (Houston, TX)

    1993-01-01

    Aromatic compounds are alkylated in a combination reactor/distillation column comprising a vessel suitable for operating between 70.degree. C. and 500.degree. C. and from 0.5 to 20 atmospheres pressure; an inert distillation packing in the lower one-third of said vessel; solid acidic catalytic material such as zeolites or an acidic cation exchange resin supported in the middle one-third of said vessel; and inert distillation packing in the upper one-third of said vessel. A benzene inlet is located near the upper end of the vessel; an olefin inlet is juxtaposed with said solid acidic catalytic material; a bottoms outlet is positioned near the bottom of said vessel for removing said cumene and ethyl benzene; and an overhead outlet is placed at the top of said vessel for removing any unreacted benzene and olefin.

  16. Alkylation of organic aromatic compounds

    DOE Patents [OSTI]

    Smith, L.A. Jr.; Arganbright, R.P.; Hearn, D.

    1993-01-05

    Aromatic compounds are alkylated in a combination reactor/distillation column comprising a vessel suitable for operating between 70 C and 500 C and from 0.5 to 20 atmospheres pressure; an inert distillation packing in the lower one-third of said vessel; solid acidic catalytic material such as zeolites or an acidic cation exchange resin supported in the middle one-third of said vessel; and inert distillation packing in the upper one-third of said vessel. A benzene inlet is located near the upper end of the vessel; an olefin inlet is juxtaposed with said solid acidic catalytic material; a bottoms outlet is positioned near the bottom of said vessel for removing said cumene and ethyl benzene; and an overhead outlet is placed at the top of said vessel for removing any unreacted benzene and olefin.

  17. HYDROCARBON FORMATION ON POLYMER-SUPPORTED COBALT

    E-Print Network [OSTI]

    Benner, Linda S.

    2013-01-01

    NV~ August 25-29, 1980 HYDROCARBON FORMATION ON POLYMER-catalyzed reduction of CO to hydrocarbons Tropscb. Among theof CO to saturated linear hydrocarbons and appears to retain

  18. Engineering Chlorinated hydrocarbons such as trichloroethylene

    E-Print Network [OSTI]

    Chemical Engineering Abstract Chlorinated hydrocarbons such as trichloroethylene (TCE) form a class carriers/supports for NZVI particles to address the in situ remediation of chlorinated hydrocarbons. We Remediation of Chlorinated Hydrocarbons Dr. Vijay John Department of Chemical & Biomolecular Engineering

  19. HYDROCARBON CONSTITUENTS OF ICELAND LEAF FOSSIL

    E-Print Network [OSTI]

    Han, Jerry; Calvin, Melvin.

    2008-01-01

    L.S. (1962) Isoprenoid hydrocarbons in petroleum. Anal.and EVANS E. D. (1965) Hydrocarbons in non-reservo; r-rockVI. Distribution of wax hydrocarbons in plants at different

  20. Thermocatalytic process for CO.sub.2-free production of hydrogen and carbon from hydrocarbons

    DOE Patents [OSTI]

    Muradov, Nazim Z. (Melbourne, FL)

    2011-08-23

    A novel process and apparatus are disclosed for sustainable CO.sub.2-free production of hydrogen and carbon by thermocatalytic decomposition (dissociation, pyrolysis, cracking) of hydrocarbon fuels over carbon-based catalysts in the absence of air and/or water. The apparatus and thermocatalytic process improve the activity and stability of carbon catalysts during the thermocatalytic process and produce both high purity hydrogen (at least, 99.0 volume %) and carbon, from any hydrocarbon fuel, including sulfurous fuels. In a preferred embodiment, production of hydrogen and carbon is achieved by both internal and external activation of carbon catalysts. Internal activation of carbon catalyst is accomplished by recycling of hydrogen-depleted gas containing unsaturated and aromatic hydrocarbons back to the reactor. External activation of the catalyst can be achieved via surface gasification with hot combustion gases during catalyst heating. The process and apparatus can be conveniently integrated with any type of fuel cell to generate electricity.

  1. Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop March 18, 2015 8:00AM EDT to...

  2. Biological Conversion of Sugars To Hydrocarbons | Department...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Biological Conversion of Sugars To Hydrocarbons Biological Conversion of Sugars To Hydrocarbons PDF explaining the biological process of bioenergy Biological Conversion of Sugars...

  3. Enhanced Anaerobic Digestion and Hydrocarbon Precursor Production...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Workshop held March 18-19, 2015. Enhanced Anaerobic Digestion and Hydrocarbon Precursor Production More Documents & Publications Enhanced Anaerobic Digestion and Hydrocarbon...

  4. MULTIPHOTON DISSOCIATION PRODUCTS FROM HALOGENATED HYDROCARBONS

    E-Print Network [OSTI]

    Sudbo, Aa. S.

    2011-01-01

    FROM HALOGENATED HYDROCARBONS RECE1VED Aa. S. Sudbo, P. A.FROM HALOGENATED HYDROCARBONS LBL-6966 Aa. S. Sudbo, t P. A.

  5. Hydrocarbon sensors and materials therefor

    DOE Patents [OSTI]

    Pham, Ai Quoc (San Jose, CA); Glass, Robert S. (Livermore, CA)

    2000-01-01

    An electrochemical hydrocarbon sensor and materials for use in sensors. A suitable proton conducting electrolyte and catalytic materials have been found for specific application in the detection and measurement of non-methane hydrocarbons. The sensor comprises a proton conducting electrolyte sandwiched between two electrodes. At least one of the electrodes is covered with a hydrocarbon decomposition catalyst. Two different modes of operation for the hydrocarbon sensors can be used: equilibrium versus non-equilibrium measurements and differential catalytic. The sensor has particular application for on-board monitoring of automobile exhaust gases to evaluate the performance of catalytic converters. In addition, the sensor can be utilized in monitoring any process where hydrocarbons are exhausted, for instance, industrial power plants. The sensor is low cost, rugged, sensitive, simple to fabricate, miniature, and does not suffer cross sensitivities.

  6. Aromatics Extraction Plant Design Using Synthesis Techniques 

    E-Print Network [OSTI]

    Wilcox, R. J.; Nedwick, R.

    1987-01-01

    and condenser duties and temperatures and estimating the traffic and number of trays in each column to estimate its capital cost. APPUCATION TO THE SPECIFIC DESIGN A new plant was designed to produce benzene, toluene, and xylene by extraction... to extract an aromatics stream from a C 6 -C o heart cut of hydrogenated pyrolysis gasoline, leaving a raffinate containing paraffins and naphthenes. The Distillation Section distills the aromatics stream into high purity benzene, toluene, and Co...

  7. Microscale Characterization of the Location and Association of TNT in Soils U. Ghosh and R.G. Luthy

    E-Print Network [OSTI]

    in making TNT transformation products unavailable for further degradation [3]. However, TNT residue may also aromatic hydrocarbons (PAHs) on coal-derived particles in sediment [4,5]. We showed in that work that PAH is that crystalline or pure TNT is toxic to microorganisms and not easily biotreatable and that differences

  8. 10510 | Phys. Chem. Chem. Phys., 2015, 17, 10510--10519 This journal is the Owner Societies 2015 Cite this: Phys.Chem.Chem.Phys.,

    E-Print Network [OSTI]

    Kaiser, Ralf I.

    the underlying reaction pathways comprehensively. 1. Introduction Polycyclic aromatic hydrocarbons (PAHs to date,8 and hence the underlying formation mechanisms have still remained conjecture. In terrestrial warming as well.20 Conse- quently, the increasing concerns about the impact of PAHs in terrestrial

  9. PAHs and crystalline silicates in the bipolar post-AGB star IRAS 16279-4757 12

    E-Print Network [OSTI]

    Zijlstra, Albert

    PAHs and crystalline silicates in the bipolar post-AGB star IRAS 16279-4757 12 M. Matsuura1 , A bands and crystalline silicates. We present mid-infrared images, that resolve the object for the first with PAHs and crystalline silicates. A two-component model and images suggest a dense oxygen-rich torus

  10. Conversion of methanol to hydrocarbons III. Methylation, ethylation, and propylation of benzene with methanol

    SciTech Connect (OSTI)

    Kaeding, W.W. (Mobil Chemical Company, Princeton, NJ (USA))

    1988-12-01

    Methanol is converted to hydrocarbons (and water) over HZSM-5 zeolite catalyst in the presence of 1-8M excesses of benzene. Methanol products are primarily aliphatic hydrocarbon gases and C{sub 1} to C{sub 4} aliphatic substituents on the aromatic ring. Methylation of benzene to produce toluene increases as the feed ratio of methanol/benzene decreases. Mild conditions minimize aromatic ring production from methanol. Molar distribution of the methylene group (-CH{sub 2}-) in the product, is tabulated according to carbon number. Methane plus methyl substituents on the aromatic ring measure C{sub 1}; ethane, ethylene, and ethyl ring substituents measure C{sub 2}, etc. At temperatures up to 325 C, methylene distribution in the product is methyl = ethyl > propyl {much gt} butyl. Above 350 C, methyl {much gt} ethyl > propyl. This distribution of the methylene group, under mild conditions, may be a measure of the early production of light olefins, from methanol, within the zeolite pores.

  11. Hydroconversion of liquid hydrocarbons in a staged autothermal reactor

    SciTech Connect (OSTI)

    Blass, SD; Bhan, A; Schmidt, LD

    2013-01-31

    An autothermal staged reactor was assembled containing a top stage of Rh-Ce/alpha-Al2O3 which generated heat and H-2 by reacting CH4 and air that passed through a downstream stage containing 0.5 wt% Pt/gamma-Al2O3 mixed with either HBEA, HZSM-5, or USY in a heat-integrated non-isothermal reactor. The H-2 produced subsequently reacts in a 20:1 ratio with a co-feed of hexane or decane or 2-decanone fed to the reactor between the stages. The large-sized pores of HBEA and USY allowed deoxygenation of 2-decanone to form decene isomers which can crack or cyclize to form up to a 36% yield of methylated and ethylated monoaromatics. The medium-sized pores of HZSM-5 restricted decene formation from 2-decanone by catalyzing cracking reactions to C2-6 compounds which can cyclize to form aromatics. By contrast, the reactor effluent from non-oxygenated reactants decane and hexane contained less than 5% aromatics. Thus, we extend the scope of staged autothermal reactor functionality to hydrocracking and hydroisomerization of higher saturated and oxygenated hydrocarbons. (C) 2012 Elsevier B.V. All rights reserved.

  12. HYDROCARBONS FROM AUSTRALIAN OIL, 200 MILLION YEARS OLD

    E-Print Network [OSTI]

    Van Hoeven, William; Haug, Pat; Burlingame, A.L.; Calvin, Kelvin.

    1966-01-01

    of Moonie Oil "Branched- Cyclic" Hydrocarbon FractionNo. W -7405 -eng -48 HYDROCARBONS FROM AUSTRALIAN OIL, 200and Melvin Calvin July HYDROCARBONS FROM AUSTRALIAN OIL, 200

  13. Parenteral Hydrocarbon Injection and Associated Toxicities: Two Case Reports

    E-Print Network [OSTI]

    Nelson, Michael E.; Nasr, Isam

    2013-01-01

    Products Containing Hydrocarbons. JAMA. 1981;246:840–843.Tissue Injection of Hydrocarbons: A Case Report and Reviewand Nasr Parenteral Hydrocarbon Injection and Associated

  14. Effect of hydrotropic salts on phase relationships involving hydrocarbons, water, and alcohols

    SciTech Connect (OSTI)

    Ho, P.C.; Kraus, K.A.

    1980-01-01

    Hydrotropic salts, which can increase the solubility of organic materials in aqueous solutions, are useful to tertiary oil recovery. We have examined effects on solubility of hydrocarbons in water (with and without alcohols) through addition of inorganic hydrotropic salts, such as perchlorates, thiocyanates, and iodides - high in the usual Hofmeister series - and of organic salts such as short chain alkyl benzene sulfonates and other salts based on substituted benzene derivatives. Although the inorganic salts are relatively ineffective in increasing solubility of hydrocarbons in water, many of the organic salts are excellent hydrotropic agents for hydrocarbons. We have examined the phase relationships for several series of aromatic salts such as sulfonates, carboxylates and hydroxycarboxylates, as a function of alkyl-carbon substitution in three-component (hydrocarbon, salt, water) and in four-component (hydrocarbon, salt, alcohol, water) systems. We have also examined miscibility relationships for a given hydrotropic salt as the chain length of alkanes and alkyl benzenes is systematically varied. While miscibilities decrease with increase in chain length of the hydrocarbon, the hydrotropic properties in these systems increase rapidly with the number of alkyl carbons on the benzene ring of the salts and they are relatively insensitive to the type of charged group (sulfonate vs carboxylate) attached to the benzene ring. However, there were significant increases in hydrotropy as one goes from equally substituted sulfonates or carboxylates to salicylates. A number of salts have been identified which have much greater hydrotropic properties for hydrocarbons than such well-known hydrotropic materials as toluene and xylene sulfonates.

  15. Design and Applications of Anti Albumin-Adduct Antibodies to Assess Human Exposure to Aromatic Hydrocarbons

    E-Print Network [OSTI]

    Chung, Ming Kei

    2013-01-01

    albumin  adducts  in   foundry  workers  and  roofers,  albumin  adducts  in   foundry  workers  and  roofers,  Biological   monitoring  of  foundry  workers  exposed  to  

  16. Atmospheric Environment 41 (2007) 20612072 Atmospheric polycyclic aromatic hydrocarbons observed over

    E-Print Network [OSTI]

    Zheng, Mei

    2007-01-01

    or pyrolysis of materials containing carbon and hydrogen. They have both anthropogenic and natural sources of environmental media, including air (Halsall et al., 1994; Buehler et al., 2001), soil (Motelay-Massei et al

  17. Sorption of polycyclic aromatic hydrocarbons to minerals and low-organic-carbon aquifer sediments 

    E-Print Network [OSTI]

    Grimaldi, Gabriel Orlando

    1999-01-01

    The molecular mechanisms and major geochemical factors ics. controlling the sorption of nontoxic organic chemicals (NOC) to mineral surfaces in low-organic-carbon soils and sediments remain unclear. The objectives of this research were to study...

  18. Attenuation of dilute aromatic hydrocarbon transport by a block copolymer in a compacted vertisol 

    E-Print Network [OSTI]

    Akin, James Browning

    2001-01-01

    supplies. The study was performed to determine if the modification of a compacted soil liner with a thermoplastic elastomer block copolymer could successfully sequester benzene, toluene, ethylbenzene, and xylenes and meet the United States Environmental...

  19. Quantification of in situ polycyclic aromatic hydrocarbon biodegradation at a petroleum contaminated site 

    E-Print Network [OSTI]

    Conti, Enzo Mario

    1994-01-01

    A major difficulty in applying bioremediation to field sites is the quantification ofin situ bioremediation. This study is based on the hypothesis that molecular markers can be used to quantify in situ biodegradation. By ...

  20. Determination of the mutagenic potential of individual and binary mixtures of polycyclic aromatic and nitroaromatic hydrocarbons 

    E-Print Network [OSTI]

    Keller, Tracie A

    1987-01-01

    LEGEND & ~ 16 mlcrogroms/plote SAP o-8 aag 0 0. 0 1. 0 2. 0 3. 0 4. 0 S. O 6. 0 7. 0 8. 0 Dose of BEP-micrograms/plate Figure 5. 12. Dose/Response Curves for BAP/BEP Mixtures Mith Metabolic Activation 0. 0 10. 0 33 The highest response... LEGEND 0 ~ 16 mlcrograms/plate SAP oa 8 aa g &~ 2 800. 0 400. 0 0. 0 0. 0 LO 2. 0 3. 0 4. 0 5. 0 8. 0 T. O 8. 0 8. 0 10. 0 11. 0 12. 0 13. 0 H. O 15. 0 lb. 0 17. 0 18. 0 18. 0 20. 0 Dose of l-NP-mlcrograms/plate Figure 5. 20. Oese...

  1. A method for using polyethylene passive samplers to measure polycyclic aromatic hydrocarbon chemical activity in sediments

    E-Print Network [OSTI]

    Fernandez, Loretta A. (Loretta Ana)

    2005-01-01

    In order to aid in the determination of the hazards posed by hydrophobic organic compounds (HOCs) in sediment beds, a method for the use of polyethylene (PE) sheets as passive sampling devices for measuring chemical ...

  2. Polycyclic aromatic hydrocarbon and mid-infrared continuum emission in a z

    Office of Scientific and Technical Information (OSTI)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Homesum_a_epg0_fpd_mmcf_m.xls" ,"Available from WebQuantity of NaturalDukeWakefieldSulfateSciTech ConnectSpeeding accessusers' guide.representationComplexsame (Patent)> 4

  3. Fluorescence method for enzyme analysis which couples aromatic amines with aromatic aldehydes

    DOE Patents [OSTI]

    Smith, Robert E. [557 Escondido Cir., Livermore, CA 94550; Dolbeare, Frank A. [5178 Diane La., Livermore, CA 94550

    1980-10-21

    Analysis of proteinases is accomplished using conventional amino acid containing aromatic amine substrates. Aromatic amines such as 4-methoxy-2-naphthylamine (4M2NA), 2-naphthylamine, aminoisophthalic acid dimethyl ester, p-nitroaniline, 4-methoxy-1-aminofluorene and coumarin derivatives resulting from enzymatic hydrolysis of the substrate couples with aromatic aldehydes such as 5-nitrosalicylaldehyde (5-NSA), benzaldehyde and p-nitrobenzaldehyde to produce Schiff-base complexes which are water insoluble. Certain Schiff-base complexes produce a shift from blue to orange-red (visible) fluorescence. Such complexes are useful in the assay of enzymes.

  4. Fluorescence method for enzyme analysis which couples aromatic amines with aromatic aldehydes

    DOE Patents [OSTI]

    Smith, R.E.; Dolbeare, F.A.

    1980-10-21

    Analysis of proteinases is accomplished using conventional amino acid containing aromatic amine substrates. Aromatic amines such as 4-methoxy-2-naphthylamine (4M2NA), 2-naphthylamine, aminoisophthalic acid dimethyl ester, p-nitroaniline, 4-methoxy-1-aminofluorene and coumarin derivatives resulting from enzymatic hydrolysis of the substrate couples with aromatic aldehydes such as 5-nitrosalicylaldehyde (5-NSA), benzaldehyde and p-nitrobenzaldehyde to produce Schiff-base complexes which are water insoluble. Certain Schiff-base complexes produce a shift from blue to orange-red (visible) fluorescence. Such complexes are useful in the assay of enzymes. No Drawings

  5. Enrichment of light hydrocarbon mixture

    DOE Patents [OSTI]

    Yang, Dali (Los Alamos, NM); Devlin, David (Santa Fe, NM); Barbero, Robert S. (Santa Cruz, NM); Carrera, Martin E. (Naperville, IL); Colling, Craig W. (Warrenville, IL)

    2011-11-29

    Light hydrocarbon enrichment is accomplished using a vertically oriented distillation column having a plurality of vertically oriented, nonselective micro/mesoporous hollow fibers. Vapor having, for example, both propylene and propane is sent upward through the distillation column in between the hollow fibers. Vapor exits neat the top of the column and is condensed to form a liquid phase that is directed back downward through the lumen of the hollow fibers. As vapor continues to ascend and liquid continues to countercurrently descend, the liquid at the bottom of the column becomes enriched in a higher boiling point, light hydrocarbon (propane, for example) and the vapor at the top becomes enriched in a lower boiling point light hydrocarbon (propylene, for example). The hollow fiber becomes wetted with liquid during the process.

  6. Enrichment of light hydrocarbon mixture

    DOE Patents [OSTI]

    Yang; Dali (Los Alamos, NM); Devlin, David (Santa Fe, NM); Barbero, Robert S. (Santa Cruz, NM); Carrera, Martin E. (Naperville, IL); Colling, Craig W. (Warrenville, IL)

    2010-08-10

    Light hydrocarbon enrichment is accomplished using a vertically oriented distillation column having a plurality of vertically oriented, nonselective micro/mesoporous hollow fibers. Vapor having, for example, both propylene and propane is sent upward through the distillation column in between the hollow fibers. Vapor exits neat the top of the column and is condensed to form a liquid phase that is directed back downward through the lumen of the hollow fibers. As vapor continues to ascend and liquid continues to countercurrently descend, the liquid at the bottom of the column becomes enriched in a higher boiling point, light hydrocarbon (propane, for example) and the vapor at the top becomes enriched in a lower boiling point light hydrocarbon (propylene, for example). The hollow fiber becomes wetted with liquid during the process.

  7. Introduction Tobacco has been extensively studied in order to assess the

    E-Print Network [OSTI]

    Ferreira, Márcia M. C.

    contains numerous cytotoxic substances, such as polycyclic aromatics hydrocarbons (PAHs), aromatics amines (conventional, light, and flavor) by ICP OES after previous acid digestion, and used as chemical descriptors for the determination of Al, Ba, Ca, Cu, Fe, K, Mg, Mn, Na, P and Sr in conventional, light, and flavorized cigarettes

  8. Biological enhancement of hydrocarbon extraction

    DOE Patents [OSTI]

    Brigmon, Robin L. (North Augusta, SC); Berry, Christopher J. (Aiken, SC)

    2009-01-06

    A method of microbial enhanced oil recovery for recovering oil from an oil-bearing rock formation is provided. The methodology uses a consortium of bacteria including a mixture of surfactant producing bacteria and non-surfactant enzyme producing bacteria which may release hydrocarbons from bitumen containing sands. The described bioprocess can work with existing petroleum recovery protocols. The consortium microorganisms are also useful for treatment of above oil sands, ground waste tailings, subsurface oil recovery, and similar materials to enhance remediation and/or recovery of additional hydrocarbons from the materials.

  9. Method for producing viscous hydrocarbons

    DOE Patents [OSTI]

    Poston, Robert S. (Winter Park, FL)

    1982-01-01

    A method for recovering viscous hydrocarbons and synthetic fuels from a subterranean formation by drilling a well bore through the formation and completing the well by cementing a casing means in the upper part of the pay zone. The well is completed as an open hole completion and a superheated thermal vapor stream comprised of steam and combustion gases is injected into the lower part of the pay zone. The combustion gases migrate to the top of the pay zone and form a gas cap which provides formation pressure to produce the viscous hydrocarbons and synthetic fuels.

  10. Supersized contorted aromatics Shengxiong Xiao,a

    E-Print Network [OSTI]

    . The peripheral groups that are bent out of the ring plane produce several advantageous consequences for the materials properties. In thin lms and crystals, they are able to adopt unique p-to-p contacts that produce aromatics are shape- and size-complementary to fullerenes in thin lms and co-crystals. The association

  11. Electronic Aromaticity Index for Large Rings

    E-Print Network [OSTI]

    Matito, Eduard

    2015-01-01

    We introduce a new electronic aromaticity index, AV1245, consisting in the average of the 4-center MCI values along the ring that keep a positional relationship of 1,2,4,5. AV1245 measures the extent of transferability of the delocalized electrons between bonds 1-2 and 4-5, which is expected to be large in conjugated circuits and, therefore, in aromatic molecules. A new algorithm for the calculation of MCI for large rings is also introduced and used to produce the data for the calibration of the new aromaticity index. AV1245 does not rely on reference values, does not suffer from large numerical precision errors, and it does not present any limitation on the nature of atoms, the molecular geometry or the level of calculation. It is a size-extensive measure with a small computational cost that grows linearly with the number of ring members. Therefore, it is specially suitable to study the aromaticity of large molecular rings as those occurring in belt-shaped M\\"obius structures or porphyrins.

  12. Catalysis of PAH Biodegradation by Humic Acid Shown in Synchrotron Infrared Studies

    E-Print Network [OSTI]

    National Laboratory, Berkeley, CA 94720 2 Utah Water Research Laboratory, Utah State University, Logan, UT in the bioremediation of several anthropogenic pollutants, its role in the detoxification of PAHs by microbes remains

  13. Removal Efficiencies of a Bioretention System for Trace Metals, PCBs, PAHs, and Dioxins in a Semiarid

    E-Print Network [OSTI]

    Removal Efficiencies of a Bioretention System for Trace Metals, PCBs, PAHs, and Dioxins (concentration or load reductions) were demonstrated for total Hg, polychlori- nated biphenols (PCBs) and dioxins); Metals; Mercury; Dioxins; Stormwater. Introduction Stormwater runoff from streets and parking lots

  14. Analysis of Ultrasonic Velocities in Hydrocarbon Mixtures

    E-Print Network [OSTI]

    of measurements on ultrasonic velocities of liquid hydrocarbons and mixtures. They found that their dataAnalysis of Ultrasonic Velocities in Hydrocarbon Mixtures James G. Berryman Lawrence Livermore on hydrocarbon mixtures was shown by Wang and Nur [JASA 89, 2725 (1991)] to agree quite well with the predictions

  15. Clar number of catacondensed benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Clar number of catacondensed benzenoid hydrocarbons Sandi Klavzara, , Petra Zigerta , Ivan Gutmanb sextets in any of the Clar formulae) of a catacondensed benzenoid hydrocarbon: CL is equal to the minimum; Resonance graph; Benzenoid hydrocarbons 1. Introduction Within the theory that was formulated [1, 2

  16. Cuticular Hydrocarbon Research1 Marion Page2

    E-Print Network [OSTI]

    Cuticular Hydrocarbon Research1 Marion Page2 We have been studying existing taxonomies of forest in the utility of cuticular (surface) hydrocarbons as taxonomic characters (Haverty and others 1988, 1989, Page to be genetically fixed. Because the insects studied so far synthesize all or most of their hydrocarbon components

  17. Clar number of catacondensed benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Clar number of catacondensed benzenoid hydrocarbons Sandi KlavŸzar a,# , Petra Ÿ Zigert a , Ivan hydrocarbon: CL is equal to the minimum number of straight lines required to intersect all hexagons theory; Clar formula; Clar number; Resonance graph; Benzenoid hydrocarbons 1. Introduction Within

  18. Carbonyl Emissions from Gasoline and Diesel Motor Vehicles

    E-Print Network [OSTI]

    Jakober, Chris A.

    2008-01-01

    aromatic hydrocarbon and carbonyl measurements in heavy-dutyMeasurements Measurement of polycyclic aromatic hydrocarbon

  19. Intra-Aggregate Mass Transport-Limited Bioavailability of

    E-Print Network [OSTI]

    Shor, Leslie McCabe

    hydrocarbons (PAHs) are a class of common sediment contaminants characterized by low aqueous solubilityIntra-Aggregate Mass Transport-Limited Bioavailability of Polycyclic Aromatic Hydrocarbons mathematical model was developed to describe sediment-pore water partitioning and rapid aqueous-phase diffusion

  20. Interlaboratory Analytical Comparison Study to Support Deepwater Horizon

    E-Print Network [OSTI]

    . Kucklick Analytical Chemistry Division Material Measurement Laboratory National Institute of Standards, crude oil QA10OIL01 reported here. In this exercise, selected polycyclic aromatic hydrocarbons (PAHs will be required. In addition, numerous other entities have collected environmental samples for hydrocarbon

  1. Cey. J. Sci. (Bio. Sci.) 35 (1): 25-39, 2006 PHYTOREMEDIATION: AN AFFORDABLE GREEN TECHNOLOGY FOR THE

    E-Print Network [OSTI]

    Rajakaruna, Nishanta

    -driven, green technology is often favored over more conventional methods of clean-up due to its low cost, low and Schnoor, 1997), explosives such as trinitrotoluene (TNT) (Hughes et al., 1997), hydrocarbons such as oil, gasoline, benzene, toluene, and polycyclic aromatic hydrocarbons (PAHs) (Schnoor et al., 1995, Aprill

  2. Adsorption and desorption hysteresis of PAHs in surface sediment

    SciTech Connect (OSTI)

    Fu, G.; Kan, A.T.; Tomson, M. (Rice Univ., Houston, TX (United States). Dept. of Environmental Science and Engineering)

    1994-10-01

    The overall objective of this research is to investigate the desorption reversibility of two PAHs (naphthalene and phenanthrene) from sediment materials. Batch adsorption and desorption experiments were designed to minimize the contribution of experimental artifacts. The sorbent was sediment obtained from Johnson Ranch (Lula, OK) that contained 92% sand, 6% silt, 2% clay, and 0.27% organic matter. Batch adsorption and desorption experiments with radiolabeled chemicals were conducted at various pH levels and ionic strengths, solute concentrations ranging over several orders of magnitude, and equilibrium times up to five months. These models pollutants appear to be readily adsorbed by sediment, but a portion of the bound pollutants resists desorption. The adsorption is rapid and predictable using published K[sub oc] and K[sub ow] relationships. From 30 to 50% of the adsorbed amount resists desorption. The resistant fraction can be desorbed in water only at rates one to three orders of magnitude slower than previous observations or theories. It is hypothesized that some multistep chemical or mechanical effects promote soil aggregation and/or entrapment of pollutants in the soil organic matter during adsorption.

  3. Kinetics and mechanisms of reactions involving small aromatic reactive intermediates

    SciTech Connect (OSTI)

    Lin, M.C. [Emory Univ., Atlanta, GA (United States)

    1993-12-01

    Small aromatic radicals such as C{sub 6}H{sub 5}, C{sub 6}H{sub 5}O and C{sub 6}H{sub 4} are key prototype species of their homologs. C{sub 6}H{sub 5} and its oxidation product, C{sub 6}H{sub 5}O are believed to be important intermediates which play a pivotal role in hydrocarbon combustion, particularly with regard to soot formation. Despite their fundamental importance, experimental data on the reaction mechanisms and reactivities of these species are very limited. For C{sub 6}H{sub 5}, most kinetic data except its reactions with NO and NO{sub 2}, were obtained by relative rate measurements. For C{sub 6}H{sub 5}O, the authors have earlier measured its fragmentation reaction producing C{sub 5}H{sub 5} + CO in shock waves. For C{sub 6}H{sub 4}, the only rate constant measured in the gas phase is its recombination rate at room temperature. The authors have proposed to investigate systematically the kinetics and mechanisms of this important class of molecules using two parallel laser diagnostic techniques--laser resonance absorption (LRA) and resonance enhanced multiphoton ionization mass spectrometry (REMPI/MS). In the past two years, study has been focused on the development of a new multipass adsorption technique--the {open_quotes}cavity-ring-down{close_quotes} technique for kinetic applications. The preliminary results of this study appear to be quite good and the sensitivity of the technique is at least comparable to that of the laser-induced fluorescence method.

  4. Dry reforming of hydrocarbon feedstocks

    SciTech Connect (OSTI)

    Shah, Yatish T.; Gardner, Todd H.

    2014-09-25

    Developments in catalyst technology for the dry reforming of hydrocarbon feedstocks are reviewed for methane, higher hydrocarbons and alcohols. Thermodynamics, mechanisms and the kinetics of dry reforming are also reviewed. The literature on Ni catalysts, bi-metallic Ni catalysts and the role of promoters on Ni catalysts is critically evaluated. The use of noble and transitional metal catalysts for dry reforming is discussed. The application of solid oxide and metal carbide catalysts to dry reforming is also evaluated. Finally, various mechanisms for catalyst deactivation are assessed. This review also examines the various process related issues associated with dry reforming such as its application and heat optimization. Novel approaches such as supercritical dry reforming and microwave assisted dry reforming are briefly expanded upon.

  5. Investigation of Nitro-Organic Compounds in Diesel Engine Exhaust: Final Report, February 2007 - April 2008

    SciTech Connect (OSTI)

    Dane, J.; Voorhees, K. J.

    2010-06-01

    The National Renewable Energy Laboratory upgraded its ReFUEL engine and vehicle testing facility to speciate unregulated gas-phase emissions. To complement this capability, the laboratory contracted with the Colorado School of Mines (CSM) to study the effects of soy biodiesel fuel and a diesel particle filter (DPF) on emissions of polycyclic aromatic hydrocarbons (PAH) and nitro-polycyclic aromatic hydrocarbons (NPAH). CSM developed procedures to sample diesel particulate matter (PM) emissions from raw and diluted exhaust, with and without a DPF. They also developed improved procedures for extracting PAH and NPAH from the PM and quantifying them with a gas chromatograph-electron monochromator mass spectrometer. The study found the DPF generally reduced PAH emissions by 1 to 3 orders of magnitude. PAH conversion was lowest for B100, suggesting that PAHs were forming in the DPF. Orders of magnitude reductions were also found for NPAH emissions exiting the DPF.

  6. Catalytic method for synthesizing hydrocarbons

    DOE Patents [OSTI]

    Sapienza, Richard S. (Shoreham, NY); Sansone, Michael J. (Summit, NJ); Slegeir, William A. R. (Hampton Bays, NY)

    1984-01-01

    A method for synthesizing hydrocarbons from carbon monoxide and hydrogen by contacting said gases with a slurry of a catalyst composed of palladium or platinum and cobalt supported on a solid phase is disclosed. The catalyst is prepared by heating a heterogeneous component of the palladium or platinum deposited on the solid support in a solution of cobalt carbonyl or precursors thereof. The catalyst exhibits excellent activity, stability in air, and produces highly desirable product fractions even with dilute gaseous reactants.

  7. Deep desulfurization of hydrocarbon fuels

    DOE Patents [OSTI]

    Song, Chunshan (State College, PA); Ma, Xiaoliang (State College, PA); Sprague, Michael J. (Calgary, CA); Subramani, Velu (State College, PA)

    2012-04-17

    The invention relates to processes for reducing the sulfur content in hydrocarbon fuels such as gasoline, diesel fuel and jet fuel. The invention provides a method and materials for producing ultra low sulfur content transportation fuels for motor vehicles as well as for applications such as fuel cells. The materials and method of the invention may be used at ambient or elevated temperatures and at ambient or elevated pressures without the need for hydrogen.

  8. The use of fluorescence spectroscopy to monitor operation in petroleum hydrocracking units

    SciTech Connect (OSTI)

    Fetzer, J.C.

    1994-12-31

    The catalytic hydrocracking is used in refineries to convert petroleum-derived feedstocks into motor fuels and lubricating oils. Polycyclic aromatic hydrocarbons (PAHs) are produced as by-products in the process. The PAHs lead to a variety of process and product problems. The specific PAHs produced have been identified through the use of HPLC-DAD and fluorescence and mass spectroscopies. A set of production reactions have been determined that explain the observed PAHs. A synchronous-scanning fluorescence (SSF) method has been used to determine the levels of several kerge PAHs, including dicoronylene. This fifteen-ring PAH is the main cause of plugging in process piping, which necessitates expensive shutdown and cleaning of the process. This PAH is too large to be amenable to chromatographic methods. Its extremely low solubility, in a mixture of other PAHs show the advantages of SSF.

  9. Temporal trends in and influence of wind on PAH concentrations measured near the Great Lakes

    SciTech Connect (OSTI)

    Cortes, D.R.; Basu, I.; Sweet, C.W.; Hites, R.A.

    2000-02-01

    This paper reports on temporal trends in gas- and particle-phase PAH concentrations measured at three sites in the Great Lakes' Integrated Atmospheric Deposition Network: Eagle Harbor, near Lake Superior, Sleeping Bear Dunes, near Lake Michigan, and Sturgeon Point, near Lake Erie. While gas-phase concentrations have been decreasing since 1991 at all sites, particle-phase concentrations have been decreasing only at Sleeping Bear Dunes. To determine whether these results represent trends in background levels or regional emissions, the average concentrations are compared to those found in urban and rural studies. In addition, the influence of local wind direction on PAH concentrations is investigated, with the assumption that dependence on wind direction implies regional sources. Using these two methods, it is found that PAH concentrations at Eagle Harbor and Sleeping Bear Dunes represent regional background levels but that PAH from the Buffalo Region intrude on the background levels measured at the Sturgeon Point site. At this site, wind from over Lake Erie reduces local PAH concentrations.

  10. PAHs and organic matter partitioning and mass transfer from coal tar particles to water

    SciTech Connect (OSTI)

    Karim Benhabib; Marie-Odile Simonnot; Michel Sardin [LSGC - Laboratory of Chemical Engineering Science, Nancy (France)

    2006-10-01

    The coal tar found in contaminated soils of former manufactured gas plants and coking plants acts as a long-term source of PAHs. Organic carbon and PAH transfer from coal tar particles to water was investigated with closed-looped laboratory column experiments run at various particle sizes and temperatures. Two models were derived. The first one represented the extraction process at equilibrium and was based on a linear partitioning of TOC and PAHs between coal tar and water. The partition coefficient was derived as well as the mass of extractable organic matter in the particles. The second model dealt with mass transfer. Particle diffusion was the limiting step; organic matter diffusivity in the coal tar was then computed in the different conditions. A good consistency was obtained between experimental and computed results. Hence, the modeling of PAH migration in contaminated soils at the field scale requires taking into account coal tar as the source-term for PAH release. 28 refs., 5 figs., 3 tabs.

  11. Device for aqueous detection of nitro-aromatic compounds

    DOE Patents [OSTI]

    Reagen, W.K.; Schulz, A.L.; Ingram, J.C.; Lancaster, G.D.; Grey, A.E.

    1994-04-26

    This invention relates to a compact and portable detection apparatus for nitro-aromatic based chemical compounds, such as nitrotoluenes, dinitrotoluenes, and trinitrotoluene (TNT). The apparatus is based upon the use of fiber optics using filtered light. The preferred process of the invention relies upon a reflective chemical sensor and optical and electronic components to monitor a decrease in fluorescence when the nitro-aromatic molecules in aqueous solution combine and react with a fluorescent polycyclic aromatic compound. 4 figures.

  12. Device for aqueous detection of nitro-aromatic compounds

    DOE Patents [OSTI]

    Reagen, William K. (Stillwater, MN); Schulz, Amber L. (Bremerton, WA); Ingram, Jani C. (Idaho Falls, ID); Lancaster, Gregory D. (Idaho Falls, ID); Grey, Alan E. (Idaho Falls, ID)

    1994-01-01

    This invention relates to a compact and portable detection apparatus for ro-aromatic based chemical compounds, such as nitrotoluenes, dinitrotoluenes, and trinitrotoluene (TNT). The apparatus is based upon the use of fiber optics using filtered light. The preferred process of the invention relies upon a reflective chemical sensor and optical and electronic components to monitor a decrease in fluorescence when the nitro-aromatic molecules in aqueous solution combine and react with a fluorescent polycyclic aromatic compound.

  13. HYDROCARBON AND SULFUR SENSORS FOR SOFC SYSTEMS

    SciTech Connect (OSTI)

    A.M. Azad; Chris Holt; Todd Lesousky; Scott Swartz

    2003-11-01

    The following report summarizes work conducted during the Phase I program Hydrocarbon and Sulfur Sensors for SOFC Systems under contract No. DE-FC26-02NT41576. For the SOFC application, sensors are required to monitor hydrocarbons and sulfur in order to increase the operation life of SOFC components. This report discusses the development of two such sensors, one based on thick film approach for sulfur monitoring and the second galvanic based for hydrocarbon monitoring.

  14. Membrane separation of hydrocarbons using cycloparaffinic solvents

    DOE Patents [OSTI]

    Kulkarni, S.S.; Chang, Y.A.; Gatsis, J.G.; Funk, E.W.

    1988-06-14

    Heavy crude oils which contain metal contaminants such as nickel, vanadium and iron may be separated from light hydrocarbon oils by passing a solution of the crude oil dissolved in a cycloparaffinic hydrocarbon solvent containing from about 5 to about 8 carbon atoms by passing through a polymeric membrane which is capable of maintaining its integrity in the presence of hydrocarbon compounds. The light hydrocarbon oils which possess relatively low molecular weights will be recovered as the permeate while the heavy oils which possess relatively high molecular weights as well as the metal contaminants will be recovered as the retentate.

  15. Membrane separation of hydrocarbons using cycloparaffinic solvents

    DOE Patents [OSTI]

    Kulkarni, Sudhir S. (Hoffman Estates, IL); Chang, Y. Alice (Westmont, IL); Gatsis, John G. (Des Plaines, IL); Funk, Edward W. (Highland Park, IL)

    1988-01-01

    Heavy crude oils which contain metal contaminants such as nickel, vanadium and iron may be separated from light hydrocarbon oils by passing a solution of the crude oil dissolved in a cycloparaffinic hydrocarbon solvent containing from about 5 to about 8 carbon atoms by passing through a polymeric membrane which is capable of maintaining its integrity in the presence of hydrocarbon compounds. The light hydrocarbon oils which possess relatively low molecular weights will be recovered as the permeate while the heavy oils which possess relatively high molecular weights as well as the metal contaminants will be recovered as the retentate.

  16. Nox reduction system utilizing pulsed hydrocarbon injection

    DOE Patents [OSTI]

    Brusasco, Raymond M. (Livermore, CA); Penetrante, Bernardino M. (San Ramon, CA); Vogtlin, George E. (Fremont, CA); Merritt, Bernard T. (Livermore, CA)

    2001-01-01

    Hydrocarbon co-reductants, such as diesel fuel, are added by pulsed injection to internal combustion engine exhaust to reduce exhaust NO.sub.x to N.sub.2 in the presence of a catalyst. Exhaust NO.sub.x reduction of at least 50% in the emissions is achieved with the addition of less than 5% fuel as a source of the hydrocarbon co-reductants. By means of pulsing the hydrocarbon flow, the amount of pulsed hydrocarbon vapor (itself a pollutant) can be minimized relative to the amount of NO.sub.x species removed.

  17. Enhanced Anaerobic Digestion and Hydrocarbon Precursor Production...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    and Hydrocarbon Precursor Production from Sewage Sludge Breakout Session 2-C: Biogas and Beyond: Challenges and Opportunities for Advanced Biofuels from Wet-Waste...

  18. A Novel, Green Technology for the Production of Aromatic Thiol from Aromatic Sulfonyl Chloride 

    E-Print Network [OSTI]

    Atkinson, Bradley R.

    2010-01-16

    ....................................................................... 26 3.3 Palladium Catalyst Simulation ............................................................. 27 3.4 Adsorption of Aromatic Sulfonyl Chloride.......................................... 30 3.5 Adsorption of Other Reaction Species... ....................................................... 26 3-3 A diagram of each of the three palladium structures ........................ 30 3-4 The minimized structure of 2,5-dimethylbenzene sulfonyl chloride...

  19. Aromatics oxidation and soot formation in flames

    SciTech Connect (OSTI)

    Howard, J.B.; Pope, C.J.; Shandross, R.A.; Yadav, T. [Massachusetts Institute of Technology, Cambridge (United States)

    1993-12-01

    This project is concerned with the kinetics and mechanisms of aromatics oxidation and soot and fullerenes formation in flames. The scope includes detailed measurements of profiles of stable and radical species concentrations in low-pressure one-dimensional premixed flames. Intermediate species identifications and mole fractions, fluxes, and net reaction rates calculated from the measured profiles are used to test postulated reaction mechanisms. Particular objectives are to identify and to determine or confirm rate constants for the main benzene oxidation reactions in flames, and to characterize fullerenes and their formation mechanisms and kinetics.

  20. Apparatus for the production of heavier hydrocarbons from gaseous light hydrocarbons

    SciTech Connect (OSTI)

    Agee, K.L.

    1990-11-27

    This patent describes apparatus for producing heavier hydrocarbons from one or more gaseous light hydrocarbons. It comprises a partial oxidation burner means; a synthesis gas generation vessel; a hydrocarbon synthesis reactor; first conduit means; separating means; second conduit means; catalytic combustion means; third conduit means; carbon dioxide separating means; fourth conduit means; and fifth conduit means.

  1. Century-Long Source Apportionment of PAHs in Athabasca Oil Sands Region Lakes Using Diagnostic Ratios and Compound-Specific

    E-Print Network [OSTI]

    Ratios and Compound-Specific Carbon Isotope Signatures Josue Jautzy, Jason M. E. Ahad,*, Charles Gobeil PAH molecular diagnostic ratios and carbon isotopic signatures (13 C) of individual PAHs were used with 13 C values progressively shifting to the value of unprocessed AOS bitumen. This petrogenic source

  2. Chlorinated Hydrocarbon Levels in Fishes and Shellfishes of the

    E-Print Network [OSTI]

    measurements. /n contrast, correlations were often significant between chlorinated hydrocarbons. such as DDEChlorinated Hydrocarbon Levels in Fishes and Shellfishes of the Northeastern Pacific Ocean Introduction Reports of excessive amounts of chlorinated hydrocarbons in fishery products have threatened

  3. Hydrocarbon-free resonance transition 795 nm rubidium laser

    E-Print Network [OSTI]

    Wu, Sheldon Shao Quan

    2009-01-01

    and R. J. Beach, "Hydrocarbon-free resonance transition 795-a Reliable Diode-Pumped Hydrocarbon-Free 795-nm Rubidiumand R. J. Beach, "Hydrocarbon-free resonance transition 795-

  4. Enhanced metabolism of halogenated hydrocarbons in transgenic plants containing mammalian

    E-Print Network [OSTI]

    Doty, Sharon Lafferty

    Enhanced metabolism of halogenated hydrocarbons in transgenic plants containing mammalian efficient remediation of many sites contaminated with haloge- nated hydrocarbons. Trichloroethylene (TCE hydrocarbon, ethylene dibromide (EDB; dibromoeth- ane), was used as a soil fumigant to kill nematodes

  5. BIOTIGER, A NATURAL MICROBIAL PRODUCT FOR ENHANCED HYDROCARBON RECOVERY FROM OIL SANDS.

    SciTech Connect (OSTI)

    Brigmon, R; Topher Berry, T; Whitney Jones, W; Charles Milliken, C

    2008-05-27

    BioTiger{trademark} is a unique microbial consortia that resulted from over 8 years of extensive microbiology screening and characterization of samples collected from a century-old Polish waste lagoon. BioTiger{trademark} shows rapid and complete degradation of aliphatic and aromatic hydrocarbons, produces novel surfactants, is tolerant of both chemical and metal toxicity and shows good activity at temperature and pH extremes. Although originally developed and used by the U.S. Department of Energy for bioremediation of oil-contaminated soils, recent efforts have proven that BioTiger{trademark} can also be used to increase hydrocarbon recovery from oil sands. This enhanced ex situ oil recovery process utilizes BioTiger{trademark} to optimize bitumen separation. A floatation test protocol with oil sands from Ft. McMurray, Canada was used for the BioTiger{trademark} evaluation. A comparison of hot water extraction/floatation test of the oil sands performed with BioTiger{trademark} demonstrated a 50% improvement in separation as measured by gravimetric analysis in 4 h and a five-fold increase at 25 hr. Since BioTiger{trademark} performs well at high temperatures and process engineering can enhance and sustain metabolic activity, it can be applied to enhance recovery of hydrocarbons from oil sands or other complex recalcitrant matrices.

  6. Conversion of organic solids to hydrocarbons

    DOE Patents [OSTI]

    Greenbaum, E.

    1995-05-23

    A method of converting organic solids to liquid and gaseous hydrocarbons includes impregnating an organic solid with photosensitizing ions and exposing the impregnated solid to light in a non-oxidizing atmosphere for a time sufficient to photocatalytically reduce the solid to at least one of a liquid and a gaseous hydrocarbon. 5 Figs.

  7. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

    Energy Savers [EERE]

    HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Low-Temperature HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Presentation from the...

  8. Advanced Diesel Combustion with Low Hydrocarbon and Carbon Monoxide...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Combustion with Low Hydrocarbon and Carbon Monoxide Emissions Advanced Diesel Combustion with Low Hydrocarbon and Carbon Monoxide Emissions Poster presented at the 16th Directions...

  9. Effective Viscosity of Confined Hydrocarbons

    E-Print Network [OSTI]

    I. M. Sivebaek; V. N. Samoilov; B. N. J. Persson

    2012-01-24

    We present molecular dynamics friction calculations for confined hydrocarbon films with molecular lengths from 20 to 1400 carbon atoms. We find that the logarithm of the effective viscosity \\mu eff for nanometer-thin films depends linearly on the logarithm of the shear rate: log(effective viscosity) = C - n log (shear rate), where n varies from 1 (solidlike friction) at very low temperatures to 0 (Newtonian liquid) at very high temperatures, following an inverse sigmoidal curve. Only the shortest chain molecules melt, whereas the longer ones only show a softening in the studied temperature interval 0 < T < 900 K. The results are important for the frictional properties of very thin (nanometer) films and to estimate their thermal durability.

  10. Coupling of oxidative dehydrogenation and aromatization reactions of butane

    SciTech Connect (OSTI)

    Xu, Wen-Qing; Suib, S.L. )

    1994-01-01

    Coupling of oxidative dehydrogenation and aromatization of butane by using a dual function catalyst has led to a significant enhancement of the yields (from 25 to 40%) and selectivities to aromatics (from 39 to 64%). Butane is converted to aromatics by using either zinc-promoted [Ga]-ZSM-5 or zinc and gallium copromoted [Fe]-ZSM-5 zeolite as a catalyst. However, the formation of aromatics is severely limited by hydrocracking of butane to methane, ethane, and propane due to the hydrogen formed during aromatization reactions. On the other hand, the oxidative dehydrogenation of butane to butene over molybdate catalysts is found to be accompanied by a concurrent undesirable reaction, i.e., total oxidation. When two of these reactions (oxidative dehydrogenation and aromatization of butane) are coupled by using a dual function catalyst they have shown to complement each other. It is believed that the rate-limiting step for aromatization (butane to butene) is increased by adding an oxidative dehydrogenation catalyst (Ga-Zn-Mg-Mo-O). The formation of methane, ethane, and propane was suppressed due to the removal of hydrogen initially formed as water. Studies of ammonia TPD show that the acidities of [Fe]-ZSM-5 are greatly affected by the existence of metal oxides such as Ga[sub 2]O[sub 3], MgO, ZnO, and MoO[sub 3]. 40 refs., 9 figs., 1 tab.

  11. Spatially resolved l-c3h+ emission in the horsehead photodissociation region: Further evidence for a top-down hydrocarbon chemistry

    E-Print Network [OSTI]

    Guzmán, V V; Goicoechea, J R; Gerin, M; Roueff, E; Gratier, P; Oberg, K I

    2015-01-01

    Small hydrocarbons, such as C2H, C3H and C3H2 are more abundant in photo-dissociation regions (PDRs) than expected based on gas-phase chemical models. To explore the hydrocarbon chemistry further, we observed a key intermediate species, the hydrocarbon ion l-C3H+, in the Horsehead PDR with the Plateau de Bure Interferometer at high-angular resolution (6''). We compare with previous observations of C2H and c-C3H2 at similar angular resolution and new gas-phase chemical model predictions to constrain the dominant formation mechanisms of small hydrocarbons in low-UV flux PDRs. We find that, at the peak of the HCO emission (PDR position), the measured l-C3H+, C2H and c-C3H2 abundances are consistent with current gas-phase model predictions. However, in the first PDR layers, at the 7.7 mum PAH band emission peak, which are more exposed to the radiation field and where the density is lower, the C2H and c-C3H2 abundances are underestimated by an order of magnitude. At this position, the l-C3H+ abundance is also unde...

  12. Production of hydrocarbon fractions by hydrocracking

    SciTech Connect (OSTI)

    Degnan, T.F.; Kirker, G.W.; Socha, R.F.; Stapleton, M.R.; Johnson, I.D.

    1991-05-14

    This patent describes a process which comprises hydrocracking a hydrocarbon feedstock having an initial boiling point about 343{degrees} C. in the presence of a catalyst having cracking and hydrogenating activity. It comprises: catalyst comprising a layered silicate containing interspathic polymeric silica, in order to produce a hydrocarbon product having at least 35 percent by weight of hydrocarbons having a boiling point below 343{degrees} c., the catalyst further comprising at least one metal selected from the group consisting of Cr, Mo, W, Fe, Co, and Ni, wherein the hydrocracking occurs at conversions to product having a boiling point of less than 343{degrees} C. of greater than 70 percent volume of charge.

  13. Using supercritical fluids to refine hydrocarbons

    DOE Patents [OSTI]

    Yarbro, Stephen Lee

    2015-06-09

    A system and method for reactively refining hydrocarbons, such as heavy oils with API gravities of less than 20 degrees and bitumen-like hydrocarbons with viscosities greater than 1000 cp at standard temperature and pressure, using a selected fluid at supercritical conditions. A reaction portion of the system and method delivers lightweight, volatile hydrocarbons to an associated contacting unit which operates in mixed subcritical/supercritical or supercritical modes. Using thermal diffusion, multiphase contact, or a momentum generating pressure gradient, the contacting unit separates the reaction products into portions that are viable for use or sale without further conventional refining and hydro-processing techniques.

  14. Solubilization of petroleum hydrocarbons using biosurfactants 

    E-Print Network [OSTI]

    Kanga, Shahrukh

    1995-01-01

    that bioavailability of the crude oil to the microorganisms limited the degradation rates (Mills, 1994). Preliminary experiments at our laboratories have also indicated enhanced solubilities of petroleum hydrocarbons due to the effects of biosurfactants (Kanga et al...

  15. Hydrocarbon zeolite catalyst employed in hydrocracking process

    SciTech Connect (OSTI)

    Ward, J.W.

    1987-05-12

    A hydrocracking process is described which comprises contacting a hydrocarbon feedstock under hydrocracking conditions with hydrogen in the presence of a catalyst comprising at least one hydrogenation component, a crystalline aluminosilicate zeolite having catalytic activity for cracking hydrocarbons, and a dispersion of silica-alumina in a matrix consisting essentially of alumina, wherein the catalyst comprises particles in the shape of a three-leaf clover.

  16. Waste control alternatives for chlorinated hydrocarbons 

    E-Print Network [OSTI]

    Pearce, Terry Allan

    1975-01-01

    WASTE CONTROL ALTERNATIVES FOR CHLORINATED HYDROCARBONS A Thesis by TERRY ALLAN PEARCE Submitted to the Graduate College of Texas A&M University in partial fulfillment of the requirement for the degree of MASTER OF SCIENCE May 1975 Major... Subject: Chemical Engineering WASTE CONTROL ALTERNATIVES FOR CHLORINATED HYDROCARBONS A Thesis by TERRY ALLAN PEARCE Approved as to style and content by: , ~ I ' p Chairman of Committee ead of Departmen em er Member May 1975 ABSTRACT Waste...

  17. Nano-structured noble metal catalysts based on hexametallate architecture for the reforming of hydrocarbon fuels

    DOE Patents [OSTI]

    Gardner, Todd H.

    2015-09-15

    Nano-structured noble metal catalysts based on hexametallate lattices, of a spinel block type, and which are resistant to carbon deposition and metal sulfide formation are provided. The catalysts are designed for the reforming of hydrocarbon fuels to synthesis gas. The hexametallate lattices are doped with noble metals (Au, Pt, Rh, Ru) which are atomically dispersed as isolated sites throughout the lattice and take the place of hexametallate metal ions such as Cr, Ga, In, and/or Nb. Mirror cations in the crystal lattice are selected from alkali metals, alkaline earth metals, and the lanthanide metals, so as to reduce the acidity of the catalyst crystal lattice and enhance the desorption of carbon deposit forming moieties such as aromatics. The catalysts can be used at temperatures as high as 1000.degree. C. and pressures up to 30 atmospheres. A method for producing these catalysts and applications of their use also is provided.

  18. Hydrocarbon habitat of the west Netherlands basin

    SciTech Connect (OSTI)

    De Jager, J. (Nederlandse Aardolie Maatschappij, Assen (Netherlands)); Doyle, M. (Petroleum Development Oman, Muscat (Oman)); Grantham, P. (KSEPL/Shell Research, Rijswijk (Netherlands)); Mabillard, J. (Shell Nigeria, Port Harcourt (Nigeria))

    1993-09-01

    The complex West Netherlands Basin contains oil and gas in Triassic and Upper Jurassic to Cretaceous clastic reservoir sequences. The understanding has always been that the Carboniferous coal measures have generated only gas and the Jurassic marine Posidonia Shale only oil. However, detailed geochemical analyses show that both source rocks have generated oil and gas. Geochemical fingerprinting established a correlation of the hydrocarbons with the main source rocks. The occurrence of these different hydrocarbons is consistent with migration routes. Map-based charge modeling shows that the main phase of hydrocarbon generation occurred prior to the Late Cretaceous inversion of the West Netherlands Basin. However, along the southwest flank of the basin and in lows between the inversion highs, significant charge continued during the Tertiary. Biodegradation of oils in Jurassic and Cretaceous reservoirs occurred during the earliest Tertiary, but only in reservoirs that were at that time at temperatures of less then 70 to 80[degrees]C, where bacteria could survive. This study shows that also in a mature hydrocarbon province an integrated hydrocarbon habitat study with modern analyses and state-of-the-art technology can lead to a much improved understanding of the distribution of oil and gas in the subsurface. The results of this study will allow a better risk assessment for remaining prospects, and an improved prediction of the type of trapped hydrocarbons in terms of gas, oil, and biodegraded oil.

  19. Mass spectral characterization of oxygen-containing aromatics with methanol chemical ionization

    SciTech Connect (OSTI)

    Buchanan, M.V.

    1984-03-01

    Chemical ionization mass spectrometry with methanol and deuterated methanol as ionization reagents is used to differentiate oxygen-containing aromatics, including phenols, aromatic ethers, and aromatic substituted alcohols, as well as compounds containing more than one oxygen atom. The analogous sulfur-containing aromatics may be similarly differentiated. Methanol chemical ionization is used to characterize a neutral aromatic polar subfraction of a coal-derived liquid by combined gas chromatography/mass spectrometry. 16 references, 2 tables, 1 figure.

  20. On the origin of the 11.3 micron unidentified infrared emission feature

    E-Print Network [OSTI]

    Sadjadi, SeyedAbdolreza; Kwok, Sun

    2015-01-01

    The 11.3 $\\mu$m emission feature is a prominent member of the family of unidentified infrared emission (UIE) bands and is frequently attributed to out-of-plane bending modes of polycyclic aromatic hydrocarbon (PAH) molecules. We have performed quantum mechanical calculations of 60 neutral PAH molecules and found that it is difficult to reconcile the observed astronomical feature with any or a mix of these PAH molecules. We have further analyzed the fitting of spectra of several astronomical objects by the NASA PAH database program and found that reasonable fittings to the observed spectra are only possible by including significant contributions from oxygen and/or magnesium containing molecules in the mix. A mixed of pure PAH molecules, even including units of different sizes, geometry and charged states, is unable to fit the astronomical spectra. Preliminary theoretical results on the vibrational spectra of simple molecules with mixed aromatic/aliphatic structures show that these structures have consistent bu...

  1. Development of Advanced Membranes Technology Platform for Hydrocarbon Separations

    SciTech Connect (OSTI)

    Kalthod, Dr Dilip

    2010-03-01

    Virtually all natural gas is dehydrated during its production, transmission and storage, mostly by absorption processes. Membranes offer many potential advantages over absorption, including smaller footprints, lighter-weight packages, packaging flexibility, minimal electrical power duty, amenability to expansion due to system modularity, reduced maintenance costs, reduced emissions of heavy hydrocarbons, no liquid waste streams, and amenability to unmanned operation. The latter is particularly valuable because new natural gas sources are generally located in remote onshore and offshore sites. Most commercially-available membranes for natural gas upgrading involve high capital costs, high methane loss and performance degradation from operational upsets – all of which are barriers to their widespread adoption by the industry. The original focus of the project was to develop and demonstrate robust, high-performance membranes for natural gas dehydration. The first task completed was a user needs-and-wants study to 1) clarify the expectations of system fabricators and end users of the new separations equipment, and 2) establish the required technical and commercial targets for the membrane products. Following this, membrane system modeling and membrane development in the lab proceeded in parallel. Membrane module diameter and length, as well as and the fiber outer and inner fiber diameter, were optimized from a mathematical model that accounts for the relevant fluid dynamics and permeation phenomena. Module design was evaluated in the context of overall system design, capital costs and energy consumption, including the process scheme (particularly sweep generation), feed pretreatment, system layout, and process control. This study provided targets for membrane permeation coefficients and membrane geometry in a commercial offering that would be competitive with absorption systems. A commercially-available polymer with good tensile strength and chemical resistance was selected for membrane development. A novel dope composition and spinning process were developed, which provide a new approach to controlling membrane porosity and wall and skin morphology. A hollow-fiber membrane with an external dense “skin” was produced that has a high water vapor permeation coefficient and selectivity, durability when in operation at 1000 psig and 70°C, and the ability to withstand aromatic and aliphatic hydrocarbon vapors for an extended period. The fiber meets the technical requirements for a commercial product offering in gas dehydration. It can be readily manufactured with some changes in process equipment and process conditions, and is an excellent candidate for scale-up to full-size membrane modules.

  2. STUDIES OF WALL FLAME QUENCHING AND HYDROCARBON EMISSIONS IN A MODEL SPARK IGNITION ENGINE

    E-Print Network [OSTI]

    Ishikawa, Nobuhiko

    2011-01-01

    1 'Exhaust Hydrocarbon Measurement for Tuneup Diagnosis?"Methane Measurements Hydrocarbon measurements have been madealso induced. The hydrocarbon measurements reveal a general

  3. Measurement of Hydrocarbon Fluxes due to Natural Seepage in the Northern Santa Barbara Channel

    E-Print Network [OSTI]

    Washburn, Libe; Clark, Jordan F.

    2002-01-01

    of Energy 001 "MEASUREMENT OF HYDROCARBON FLUXES DUE TOauthors directly. Measurement of Hydrocarbon Fluxes due toflux measurements been obtained in the region of hydrocarbon

  4. On the use of hydrocarbons for the determination of tropospheric OH concentrations

    E-Print Network [OSTI]

    Ehhalt, D. H; Rohrer, F.; Wahner, A.; Prather, M. J; Blake, D. R

    1998-01-01

    ET AL. : USING HYDROCARBONS chemical and heterogeneous datade- cay of many reactive hydrocarbons in well-defined urbanseasonality of selected hydrocarbons and halocarbons over

  5. Massively-parallel electrical-conductivity imaging of hydrocarbons using the Blue Gene/L supercomputer

    E-Print Network [OSTI]

    2008-01-01

    CONDUCTIVITY IMAGING OF HYDROCARBONS USING THE BLUE GENE/Lidentification of hydrocarbon filled layers in deepwater,”Remote sensing of hydrocarbon layers by seabed logging (

  6. Variability of gas composition and flux intensity in natural marine hydrocarbon seeps

    E-Print Network [OSTI]

    Clark, Jordan F.; Washburn, Libe; Schwager Emery, Katherine

    2010-01-01

    in natural marine hydrocarbon seeps Jordan F. Clark & Libeenters, and CO 2 and hydrocarbon gases leave the bubbles.Introduction Natural hydrocarbon seeps are important

  7. Isolation, Determination of Absolute Stereochemistry, and Asymmetric Synthesis of Insect Methyl-Branched Hydrocarbons

    E-Print Network [OSTI]

    Bello, Jan Edgar

    2014-01-01

    d’Ettore, P. In Insect Hydrocarbons: Biology, Biochemistry,A.G. In Insect Hydrocarbons: Biology, Biochemistry, ChemicalMillar, J.G. In Insect Hydrocarbons: Biology, Biochemistry,

  8. Syngas Upgrading to Hydrocarbon Fuels Technology Pathway

    SciTech Connect (OSTI)

    Talmadge, M.; Biddy, Mary J.; Dutta, Abhijit; Jones, Susanne B.; Meyer, Pimphan A.

    2013-03-31

    In support of the Bioenergy Technologies Office, the National Renewable Energy Laboratory (NREL) and the Pacific Northwest National Laboratory (PNNL) are undertaking studies of biomass conversion technologies to hydrocarbon fuels to identify barriers and target research toward reducing conversion costs. Process designs and preliminary economic estimates for each of these pathway cases were developed using rigorous modeling tools (Aspen Plus and Chemcad). These analyses incorporated the best information available at the time of development, including data from recent pilot and bench-scale demonstrations, collaborative industrial and academic partners, and published literature and patents. This pathway case investigates the upgrading of biomass derived synthesis gas (‘syngas’) to hydrocarbon biofuels. While this specific discussion focuses on the conversion of syngas via a methanol intermediate to hydrocarbon blendstocks, there are a number of alternative conversion routes for production of hydrocarbons through a wide array of intermediates from syngas. Future work will also consider the variations to this pathway to determine the most economically viable and risk adverse conversion route. Technical barriers and key research needs have been identified that should be pursued for the syngas to hydrocarbon pathway to be competitive with petroleum-derived gasoline, diesel and jet range blendstocks.

  9. Real-time characterization of particle-bound polycyclic aromatic hydrocarbons in ambient aerosols and from motor-vehicle exhaust

    E-Print Network [OSTI]

    Polidori, A.; Hu, S.; Biswas, S.; Delfino, R. J; Sioutas, C.

    2008-01-01

    Onasch, T. B. , Frank, B. P. , Marr, L. C. , Jayne, J. T. ,33(18), 3091–3099, 1999. Marr, L. C. , Grogan, L. A. ,38(9), 2584–2592, 2004. Marr, L. C. , Dzepina, K. , Jimenez,

  10. Laser photoionization time-of-flight mass spectrometry of nitrated polycyclic aromatic hydrocarbons and nitrated heterocyclic compounds. Master's thesis

    SciTech Connect (OSTI)

    Noyes, R.A.

    1993-01-01

    Partial Contents: Laser Desorption-Laser Photoionization Time-of-Flight Mass Spectrometry; Basic Principles of TOFMS; Factors Affecting Flight Time; Source of Broadening; Laser Desorption; Theory of Multiphoton Ionization: Application to Mass Spectrometry; Quantum Theory of MPI; Time-Dependent Perturbation Theory; Time-Dependent Coefficients; Probability of a Two-Photon Process; and Attributes of R2PI.

  11. CHAPTER THREE: ENERGY-RELATED ACTIVITIES Petroleum Exploration, Production, and Transportation

    E-Print Network [OSTI]

    potential oil and gas deposits. Petroleum production includes the drilling and extraction of oil and gas contain dissolved compounds (i.e., polycyclic aromatic hydrocarbons, PAH) and dispersed crude oil (NRC67 CHAPTER THREE: ENERGY-RELATED ACTIVITIES Petroleum Exploration, Production, and Transportation

  12. Water Sci Technol. 2014; 69(6):1282-8. doi: 10.2166/wst.2014.016. Effect of anaerobic digestion at 35, 55 and 60 C on pharmaceuticals and organic

    E-Print Network [OSTI]

    Cooper, Robin L.

    Water Sci Technol. 2014; 69(6):1282-8. doi: 10.2166/wst.2014.016. Effect of anaerobic digestion and polycyclic aromatic hydrocarbons (PAHs) during anaerobic digestion of mixed primary and waste generally not reduced during digestion or pasteurization, but for three substances (indeno[1,2,3-cd

  13. EVALUATION OF LEACHATE QUALITY FROM PENTACHLOROPHENOL, CREOSOTE AND ACA

    E-Print Network [OSTI]

    in a typical treated product storage yard and to determine the potential chemical concentration that may, total organic carbon, ammonia, metals, polynuclear aromatic hydrocarbons (PAH), chlorinated and non. Ammonia releases did not show a trend as values fluctuated through the course of the study. However

  14. Developments in bioremediation of soils and sediments polluted with metals and radionuclides: 2. Field research on bioremediation of metals

    E-Print Network [OSTI]

    Hazen, Terry

    , contain, or transform to be- nign products contaminants present in soils, sedi- ments, water, or air of contaminants to which bioremediation is being applied, including solvents, explosives, poly- cyclic aromatic hydrocarbons (PAHs), and poly- chlorinated biphenyls (PCBs) (McCullough et al. 1999; NABIR 2004). Now

  15. Peer Review Plan Date: 11/1/2012

    E-Print Network [OSTI]

    Peer Review Plan Date: 11/1/2012 Source Center: U.S. Geological Survey (USGS) Texas Water Science a cancer risk assessment associated with incidental ingestion exposure to polycyclic aromatic hydrocarbons cancer risk resulting from lifetime exposures to PAH-contaminated soil and dust via non-dietary ingestion

  16. Formation of the diphenyl molecule in the crossed beam reaction of phenyl radicals with benzene

    E-Print Network [OSTI]

    Kaiser, Ralf I.

    aromatic hydrocarbons4,5 PAHs and carbonaceous nanoparticles in circumstellar envelopes of carbon stars and carbonaceous nanoparticles are also serious water pollut- ants of marine ecosystems10 and bioaccumulate, they have been further linked to soil contamination,12 food poisoning, liver lesions, and tumor growth

  17. Toxicity of density separation media to Escherichia coli and Mycobacterium strain PC01

    E-Print Network [OSTI]

    Rockne, Karl J.

    of the water-column (on a vol- ume basis). In some organic-rich sediments, cell counts can reach s 1010 cells g ecological importance from a contaminant exposure and transport standpoint [2^5]. For example, we found that the vast majority (up to 85%) of polycyclic aromatic hydrocarbons (PAHs) were seques- tered

  18. Degradation, phytoprotection, and phytoremediation of phenanthrene by endophyte Pseudomonas putida, PD1

    E-Print Network [OSTI]

    Doty, Sharon Lafferty

    the environment. Phytoremediation takes advantage of the natural ability of plants to extract chemicals from water, minimizing the amount of contaminated soil that enters the surrounding neighborhoods. A common limitation not cause disease but rather act as symbiotic partners. 4. Polycyclic aromatic hydrocarbons (PAHs

  19. Mon. Not. R. Astron. Soc. 389, 629650 (2008) doi:10.1111/j.1365-2966.2008.13567.x The relations among 8, 24 and 160 m dust emission within nearby

    E-Print Network [OSTI]

    Draine, Bruce T.

    2008-01-01

    among 8, 24 and 160 m dust emission within nearby spiral galaxies G. J. Bendo,1 B. T. Draine,2 C. W the stellar continuum-subtracted 8 m polycyclic aromatic hydrocarbon (PAH 8 m) emission, 24 m hot dust emission and 160 m cold dust emission in 15 nearby face-on spiral galaxies in the Spitzer Infrared Nearby

  20. Environmental Forensics, 7:3344, 2006 Copyright C Taylor & Francis Group, LLC

    E-Print Network [OSTI]

    Reichenbach, Stephen E.

    used successfully to identify and quantify individual compounds and classes of compounds in crude oil of crude oil showed distinct groupings of alkylated polycyclic aromatic hydrocarbons (PAHs), sulfur­5922 print / 1527­5930 online DOI: 10.1080/15275920500506758 Tracking the Weathering of an Oil Spill

  1. Published in Journal de Physique IV, vol 11, pp. Pr3-101 ---Pr3-108 Kinetic modelling of gas-phase decomposition of propane : correlation with pyrocarbon deposition

    E-Print Network [OSTI]

    Boyer, Edmond

    -phase decomposition of propane : correlation with pyrocarbon deposition Cédric Descamps, Gerard L. Vignoles , Olivier : A chemical kinetic model for gas-phase pyrolysis of propane has been set up, partially reduced, and validated the notion of "maturation" from propane to lighter hydrocarbons, then to aromatic compounds and PAHs. The gas

  2. AEGIS: Infrared Spectroscopy of an Infrared-luminous Lyman Break Galaxy at z = 3.01

    E-Print Network [OSTI]

    Huang, J.-S.; Rigopoulou, D.; Papovich, C.; Ashby, M. L. N.; Willner, S. P.; Ivison, R.; Laird, E. S.; Webb, T.; Wilson, Graham Wallace; Barmby, P.; Chapman, S.; Conselice, C. J.; McLeod, B.; Shu, C. G.; Smith, H. A.; Le Floc'h, E.; Egami, E.; Willmer, C. A. N.; Fazio, G. G.

    2007-05-01

    We report the detection of rest-frame 6.2 and 7.7 ?m emission features arising from polycyclic aromatic hydrocarbons (PAHs) in the Spitzer IRS spectrum of an infrared-luminous Lyman break galaxy at z = 3.01. This is currently ...

  3. Environmental Toxicology and Chemistry, Vol. 26, No. 3, pp. 528534, 2007 Printed in the USA

    E-Print Network [OSTI]

    Newman, Michael C.

    and concentration determine the lethal consequences of polycyclic aromatic hydrocarbons (PAHs) released during oil. Conventional toxicity testing methods produce effect metrics, such as the median lethal concentration (LC50 from oil. Conventional 48-h LC50s also were calculated for the compounds (ethylnaphthalene, 295 g

  4. Ligand binding and activation of the Ah receptor Michael S. Denison a,

    E-Print Network [OSTI]

    Baldwin, Enoch

    receptor; 2,3,7,8-Tetrachlorodibenzo-p-dioxin; TCDD; Dioxin; Homology model; Ligand binding domain; PAH, polycyclic aromatic hydrocarbon; PAS, PerÁ/ArntÁ/Sim; PCDD, polychlorinated dibenzo-p-dioxin; PGG2, prostaglandin G2 PYP, photoactive yellow protein; TCDD, 2,3,7,8-tetrachlorodibenzo-p-dioxin; TRP

  5. Paper # P45 Topic: Soot US Combustion Meeting

    E-Print Network [OSTI]

    Pitsch, Heinz

    . Thermochemical Properties of Polycyclic Aromatic Hydrocarbons (PAH) from G3MP2B3 Calculations G. Blanquart and H (cc-pVDZ). Enthalpies of formation are calculated using the mixed G3MP2//B3 method. Finally a group

  6. Supporting information: ACTIVATED CARBON AND BIOCHAR AMENDMENTS DECREASE POREWATER

    E-Print Network [OSTI]

    Lehmann, Johannes

    OF POLYCYCLIC AROMATIC HYDROCARBONS (PAHs) IN SEWAGE SLUDGES Patryk Oleszczuk1,2* , Sarah Hale1 , Johannes of tables: 2 #12;Calculation of KAC/Kbiochar for sewage sludge with AC/biochar Sorption to AC in an AC [(ng/kg)/(ng/L)n ] values determined on the basis of equation (2) for AC in AC-amended sewage sludge CP

  7. A centennial record of anthropogenic impacts and extreme weather events in southwestern Taiwan: Evidence from sedimentary molecular markers in coastal margin

    SciTech Connect (OSTI)

    Kuo, Li-Jung; Lee, Chon-Lin; Louchouarn, Patrick; Huh, Chih-An; Liu, James T.; Chen, Jian-Cheng; Lee, Kun-Je

    2014-09-15

    A 100-year history of human and natural disturbances in southwestern Taiwan was reconstructed using a suite of molecular markers in four dated sediment cores from the upper slope region off the Gaoping River mouth. Trends in polycyclic aromatic hydrocarbons (PAHs) tracked Taiwan's industrialization/urbanization starting in the 1970s, and the enactment of environmental regulatory policies thereafter.

  8. Methods for dispersing hydrocarbons using autoclaved bacteria

    DOE Patents [OSTI]

    Tyndall, Richard L. (Clinton, TN)

    1996-01-01

    A method of dispersing a hydrocarbon includes the steps: providing a bacterium selected from the following group: ATCC 85527, ATCC 75529, and ATCC 55638, a mutant of any one of these bacteria possessing all the identifying characteristics of any one of these bacteria, and mixtures thereof; autoclaving the bacterium to derive a dispersant solution therefrom; and contacting the dispersant solution with a hydrocarbon to disperse the hydrocarbon. Moreover, a method for preparing a dispersant solution includes the following steps: providing a bacterium selected from the following group: ATCC 75527, ATCC 75529, and ATCC 55638, a mutant of any one of these bacteria possessing all the identifying characteristics of any one of these bacteria, and mixtures thereof; and autoclaving the bacterium to derive a dispersant solution therefrom.

  9. Methods for dispersing hydrocarbons using autoclaved bacteria

    DOE Patents [OSTI]

    Tyndall, R.L.

    1996-11-26

    A method of dispersing a hydrocarbon includes the following steps: providing a bacterium selected from the following group: ATCC 85527, ATCC 75529, and ATCC 55638, a mutant of any one of these bacteria possessing all the identifying characteristics of any one of these bacteria, and mixtures; autoclaving the bacterium to derive a dispersant solution; and contacting the dispersant solution with a hydrocarbon to disperse the hydrocarbon. Moreover, a method for preparing a dispersant solution includes the following steps: providing a bacterium selected from the following group: ATCC 75527, ATCC 75529, and ATCC 55638, a mutant of any one of these bacteria possessing all the identifying characteristics of any one of these bacteria, and mixtures; and autoclaving the bacterium to derive a dispersant solution.

  10. Using supercritical fluids to refine hydrocarbons

    DOE Patents [OSTI]

    Yarbro, Stephen Lee

    2014-11-25

    This is a method to reactively refine hydrocarbons, such as heavy oils with API gravities of less than 20.degree. and bitumen-like hydrocarbons with viscosities greater than 1000 cp at standard temperature and pressure using a selected fluid at supercritical conditions. The reaction portion of the method delivers lighter weight, more volatile hydrocarbons to an attached contacting device that operates in mixed subcritical or supercritical modes. This separates the reaction products into portions that are viable for use or sale without further conventional refining and hydro-processing techniques. This method produces valuable products with fewer processing steps, lower costs, increased worker safety due to less processing and handling, allow greater opportunity for new oil field development and subsequent positive economic impact, reduce related carbon dioxide, and wastes typical with conventional refineries.

  11. Fundamental and semi-global kinetic mechanisms for hydrocarbon combustion. Final report, March 1977-October 1980

    SciTech Connect (OSTI)

    Dryer, F L; Glassman, I; Brezinsky, K

    1981-03-01

    Over the past three and one half years, substantial research efforts of the Princeton Fuels Research Group have been directed towards the development of simplified mechanisms which would accurately describe the oxidation of hydrocarbons fuels. The objectives of this combustion research included the study of semi-empirical modeling (that is an overall description) of the chemical kinetic mechanisms of simple hydrocarbon fuels. Such fuels include the alkanes: ethane, propane, butane, hexane and octane as well as the critically important alkenes: ethene, propene and butene. As an extension to this work, the study of the detailed radical species characteristics of combustion systems was initiated as another major aspect of the program, with emphasis on the role of the OH and HO/sub 2/ radicals. Finally, the studies of important alternative fuel problems linked the program to longer range approaches to the energy supply question. Studies of alternative fuels composed the major elements of this area of the program. The efforts on methanol research were completed, and while the aromatics aspects of the DOE work have been a direct extension of efforts supported by the Air Force Office of Scientific Research, they represented a significant part of the overall research effort. The emphasis in the proposed program is to provide further fundamental understanding of the oxidation of hydrocarbon fuels which will be useful in guiding engineering approaches. Although the scope of program ranges from the fundamentals of chemical kinetics to that of alternative fuel combustion, the objective in mind is to provide insight and guidance to the understanding of practical combustion environments. The key to our approach has been our understanding of the fundamental combustion chemistry and its relation to the important practical combustion problems which exist in implementing energy efficient, alternate fuels technologies.

  12. Hydrocarbon biomarkers, thermal maturity, and depositional setting of tasmanite oil shales from Tasmania, Australia

    SciTech Connect (OSTI)

    Revill, A.T.; Volkman, J.K.; O'Leary, T. (CSIRO Division of Oceanography, Tasmania (Australia)); Summons, R.E.; Boreham, C.J. (Australian Geological Survey Organisation, Canberra (Australia)); Banks, M.R.; Denwer, K. (Univ. of Tasmania (Australia))

    1994-09-01

    This study represents the first geological and organic geochemical investigation of samples of tasmanite oil shale representing different thermal maturities from three separate locations in Tasmania, Australia. The most abundant aliphatic hydrocarbon in the immature oil shale from Latrobe is a C[sub 19] tricyclic alkane, whereas in the more mature samples from Oonah and Douglas River low molecular weight n-alkanes dominate the extractable hydrocarbon distribution. The aromatic hydrocarbons are predominantly derivatives of tricyclic compounds, with 1,2,8-trimethylphenanthrene increasing in relative abundance with increasing maturity. Geological and geochemical evidence suggests that the sediments were deposited in a marine environment of high latitude with associated cold waters and seasonal sea-ice. It is proposed that the organism contributing the bulk of the kerogen, Tasmanites, occupied an environmental niche similar to that of modern sea-ice diatoms and that bloom conditions coupled with physical isolation from atmospheric CO[sub 2] led to the distinctive [open quotes]isotopically heavy[close quotes] [delta][sup 13]C values for the kerogen. [delta][sup 13]C data from modern sea-ice diatoms supports this hypothesis. Isotopic analysis of n-alkanes in the bitumen suggests a multiple source from bacteria and algae. On the other hand, the n-alkanes generated from closed-system pyrolysis of the kerogen are mainly derived from the preserved Tasmanites biopolymer algaenan. The tricyclic compounds (mean -8[per thousand]) both in the bitumen and pyrolysate, have a common precursor. They are consistently enriched in [sup 13]C compared with the kerogen and probably have a different source from the n-alkanes. The identification of a location where the maturity of the tasmanite oil shale approaches the [open quotes]oil window[close quotes] raises the possibility that it may be a viable petroleum source rock.

  13. Catalysts for synthesizing various short chain hydrocarbons

    DOE Patents [OSTI]

    Colmenares, Carlos (Alamo, CA)

    1991-01-01

    Method and apparatus (10), including novel photocatalysts, are disclosed for the synthesis of various short chain hydrocarbons. Light-transparent SiO.sub.2 aerogels doped with photochemically active uranyl ions (18) are fluidized in a fluidized-bed reactor (12) having a transparent window (16), by hydrogen and CO, C.sub.2 H.sub.4 or C.sub.2 H.sub.6 gas mixtures (20), and exposed to radiation (34) from a light source (32) external to the reactor (12), to produce the short chain hydrocarbons (36).

  14. Sustainable treatment of hydrocarbon-contaminated industrial land 

    E-Print Network [OSTI]

    Cunningham, Colin John

    2012-06-25

    Land contamination by petroleum hydrocarbons is a widespread and global environmental pollution issue from recovery and refining of crude oil and the ubiquitous use of hydrocarbons in industrial processes and applications. ...

  15. Conversion of methane and acetylene into gasoline range hydrocarbons 

    E-Print Network [OSTI]

    Alkhawaldeh, Ammar

    2000-01-01

    Conversion of methane and acetylene to higher molecular weight hydrocarbons over zeolite catalyst (HZSM-5) was studied The reaction between methane and acetylene successfully produced high molecular weight hydrocarbons, such as naphthalene, benzene...

  16. A Parametric Study of the Effect of Temperature and Hydrocarbon...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    of Temperature and Hydrocarbon Species on the Product Distribution from a Non-Thermal Plasma Reactor A Parametric Study of the Effect of Temperature and Hydrocarbon Species on the...

  17. Seismic Analysis Using Wavelet Transform for Hydrocarbon Detection 

    E-Print Network [OSTI]

    Cai, Rui

    2012-02-14

    result in successful hydrocarbon finds because abnormal seismic amplitude variations can sometimes be caused by other factors, such as alternative lithology and residual hydrocarbons in certain depositional environments. Furthermore, not all gas fields...

  18. Calculating the hyper--Wiener index of benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Calculating the hyper--Wiener index of benzenoid hydrocarbons Petra Ÿ Zigert 1 , Sandi KlavŸ zar 1. (1) is not easy, especially in the case of large polycyclic molecules, such as benzenoid hydrocarbons

  19. Calculating the hyperWiener index of benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Calculating the hyper­Wiener index of benzenoid hydrocarbons Petra Zigert1 , Sandi Klavzar1) is not easy, especially in the case of large polycyclic molecules, such as benzenoid hydrocarbons. Some time

  20. Algal Lipid Extraction and Upgrading to Hydrocarbons Technology...

    Office of Scientific and Technical Information (OSTI)

    MICROALGAE; ALGAL BIOMASS; HYDROCARBON BIOFUELS; BIOMASS TECHNOLOGIES OFFICE; NATIONAL RENEWABLE ENERGY LABORATORY; PACIFIC NORTHWEST NATIONAL LABORATORY; Bioenergy BIOMASS...

  1. Method and apparatus for low temperature destruction of halogenated hydrocarbons

    DOE Patents [OSTI]

    Reagen, William Kevin (Stillwater, MN); Janikowski, Stuart Kevin (Idaho Falls, ID)

    1999-01-01

    A method and apparatus for decomposing halogenated hydrocarbons are provided. The halogenated hydrocarbon is mixed with solvating agents and maintained in a predetermined atmosphere and at a predetermined temperature. The mixture is contacted with recyclable reactive material for chemically reacting with the recyclable material to create dehalogenated hydrocarbons and halogenated inorganic compounds. A feature of the invention is that the process enables low temperature destruction of halogenated hydrocarbons.

  2. The Production of Non-Methane Hydrocarbons by Marine Plankton

    E-Print Network [OSTI]

    The Production of Non-Methane Hydrocarbons by Marine Plankton Stephanie Lyn Shaw Center for Global://web.mit.edu/cgcs/ Printed on recycled paper #12;1 The Production of Non-Methane Hydrocarbons by Marine Plankton by Stephanie of Non-Methane Hydrocarbons by Marine Plankton by Stephanie Lyn Shaw Submitted to the Department of Earth

  3. 2004-01-2299 Elevated Carbon Dioxide Alters Hydrocarbon

    E-Print Network [OSTI]

    Paré, Paul W.

    2004-01-2299 Elevated Carbon Dioxide Alters Hydrocarbon Emissions and Flavor in Onion P. W. Paré, R of low-molecular-weight hydrocarbons and sulfur derivatives. Odd-chain ketones are emitted from onion-through chambers, volatile hydrocarbons from undamaged plants can be collected under different environmental

  4. Production of hydrocarbons from hydrates. [DOE patent application

    DOE Patents [OSTI]

    McGuire, P.L.

    1981-09-08

    An economical and safe method of producing hydrocarbons (or natural gas) from in situ hydrocarbon-containing hydrates is given. Once started, the method will be self-driven and will continue producing hydrocarbons over an extended period of time (i.e., many days).

  5. Method for removing chlorine compounds from hydrocarbon mixtures

    DOE Patents [OSTI]

    Janoski, E.J.; Hollstein, E.J.

    1984-09-29

    A process for removing halide ions from a hydrocarbon feedstream containing halogenated hydrocarbons wherein the contaminated feedstock is contacted with a solution of a suitable oxidizing acid containing a lanthanide oxide, the acid being present in a concentration of at least about 50 weight percent for a time sufficient to remove substantially all of the halide ion from the hydrocarbon feedstock.

  6. Binary coding of Kekule structures of catacondensed benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Binary coding of Kekulâ??e structures of catacondensed benzenoid hydrocarbons Sandi KlavŸzar, aâ??e structures of benzenoids Key words: benzenoid hydrocarbons, benzenoid graph, resonance graph, Kekul easily be recovered from its binary code. Key words: benzenoid hydrocarbons, benzenoid graph, resonance

  7. Hydrocarbon Formation in Metallic Iron/Water Systems

    E-Print Network [OSTI]

    Deng, Baolin

    Hydrocarbon Formation in Metallic Iron/Water Systems B A O L I N D E N G , , § T I M O T H Y J . C-labeled hydrocarbons are produced. In the absence of chlorinated ethenes, however, lower con- centrations of many of the same hydrocarbons (methane and C2-C6 alkanes and alkenes) are also produced. Hardy and Gillham (1996

  8. Binary coding of Kekule structures of catacondensed benzenoid hydrocarbons

    E-Print Network [OSTI]

    Klavzar, Sandi

    Binary coding of Kekul´e structures of catacondensed benzenoid hydrocarbons Sandi Klavzar of benzenoids Key words: benzenoid hydrocarbons, benzenoid graph, resonance graph, Kekul´e structure, algorithm easily be recovered from its binary code. Key words: benzenoid hydrocarbons, benzenoid graph, resonance

  9. Wiener Numbers of Pericondensed Benzenoid Hydrocarbons Sandi Klav zar

    E-Print Network [OSTI]

    Klavzar, Sandi

    Wiener Numbers of Pericondensed Benzenoid Hydrocarbons Sandi Klav#20;zar Department of Mathematics expressions for W for several homologous series of pericondensed benzenoid hydrocarbons. An elementary proof polycyclic systems studied were catacondensed benzenoid hydrocarbons. 11{14 Few years ago the situation

  10. Atomic displacements due to spinspin repulsion in conjugated alternant hydrocarbons

    E-Print Network [OSTI]

    Benzi, Michele

    Atomic displacements due to spin­spin repulsion in conjugated alternant hydrocarbons Ernesto-induced atomic displacements in conjugated alt- ernant hydrocarbons. It appears to be responsible alternant hydrocarbons (CAHs) have played a fun- damental role in the development of theoretical chemistry

  11. Substantially self-powered method and apparatus for recovering hydrocarbons from hydrocarbon-containing solid hydrates

    DOE Patents [OSTI]

    Elliott, G.R.B.; Barraclough, B.L.; Vanderborgh, N.E.

    1981-02-19

    A method and apparatus are provided for producing gaseous hydrocarbons from formations comprising solid hydrocarbon hydrates located under either a body of land or a body of water. The vast natural resources of such hydrocarbon hydrates can thus now be economically mined. Relatively warm brine or water is brought down from an elevation above that of the hydrates through a portion of the apparatus, and passes in contact with the hydrates, thus melting them. The liquid then continues up another portion of the apparatus carrying entrained hydrocarbon vapors in the form of bubbles, which can easily be separated from the liquid. After a short startup procedure, the process and apparatus are substantially self-powered.

  12. Method of dispersing a hydrocarbon using bacteria

    DOE Patents [OSTI]

    Tyndall, Richard L. (Clinton, TN)

    1996-01-01

    New protozoan derived microbial consortia and method for their isolation are provided. Consortia and bacteria isolated therefrom are useful for treating wastes such as trichloroethylene and trinitrotoluene. Consortia, bacteria isolated therefrom, and dispersants isolated therefrom are useful for dispersing hydrocarbons such as oil, creosote, wax, and grease.

  13. Method of dispersing a hydrocarbon using bacteria

    DOE Patents [OSTI]

    Tyndall, R.L.

    1996-09-24

    A new protozoan derived microbial consortia and method for their isolation are provided. The isolated consortia and bacteria are useful for treating wastes such as trichloroethylene and trinitrotoluene. The isolated consortia, bacteria, and dispersants are useful for dispersing hydrocarbons such as oil, creosote, wax, and grease.

  14. Reduction of Hydrocarbon Losses to Flare Systems 

    E-Print Network [OSTI]

    Page, J.

    1979-01-01

    action to minimize hydrocarbon releases, 2) install flare gas recovery systems, and 3) recover or reduce process streams which have to be continuous1y vented to the flare system. This report discusses alternate designs for flare gas monitoring and flare...

  15. MECHANISM OF OXYGEN ACTIVATION AND HYDROXYLATION BY THE AROMATIC AMINO ACID HYDROXYLASES 

    E-Print Network [OSTI]

    Pavon, Jorge A.

    2010-07-14

    The aromatic amino acid hydroxylases phenylalanine hydroxylase (PheH), tyrosine hydroxylase (TyrH) and tryptophan hydroxylase (TrpH) utilize tetrahydropterin and molecular oxygen to catalyze aromatic hydroxylation. All three enzymes have similar...

  16. No-carrier-added (NCA) aryl (18E) fluorides via the nucleophilic aromatic substitution of electron rich aromatic rings

    DOE Patents [OSTI]

    Ding, Yu-Shin (Central Islip, NY); Fowler, Joanna S. (Bellport, NY); Wolf, Alfred P. (Setauket, NY)

    1993-01-01

    A method for synthesizing no-carrier-added (NCA) aryl [.sup.18 F] fluoride substituted aromatic aldehyde compositions bearing an electron donating group is described. The method of the present invention includes the step of reacting aromatic nitro aldehydes having a suitably protected hydroxyl substitutent on an electron rich ring. The reaction is The U.S. Government has rights in this invention pursuant to Contract Number DE-AC02-76CH00016, between the U.S. Department of Energy and Associated Universities Inc.

  17. No-carrier-added (NCA) aryl ([sup 18]F) fluorides via the nucleophilic aromatic substitution of electron rich aromatic rings

    DOE Patents [OSTI]

    Yushin Ding; Fowler, J.S.; Wolf, A.P.

    1993-10-19

    A method for synthesizing no-carrier-added (NCA) aryl [.sup.18 F] fluoride substituted aromatic aldehyde compositions bearing an electron donating group is described. The method of the present invention includes the step of reacting aromatic nitro aldehydes having a suitably protected hydroxyl substitutent on an electron rich ring. The reaction is The U.S. Government has rights in this invention pursuant to Contract Number DE-AC02-76CH00016, between the U.S. Department of Energy and Associated Universities Inc.

  18. Development of genetically engineered bacteria for production of selected aromatic compounds

    DOE Patents [OSTI]

    Ward, Thomas E. (Idaho Falls, ID); Watkins, Carolyn S. (Idaho Falls, ID); Bulmer, Deborah K. (Henderson, NV); Johnson, Bruce F. (Scotia, NY); Amaratunga, Mohan (Clifton Park, NY)

    2001-01-01

    The cloning and expression of genes in the common aromatic pathway of E. coli are described. A compound for which chorismate, the final product of the common aromatic pathway, is an anabolic intermediate can be produced by cloning and expressing selected genes of the common aromatic pathway and the genes coding for enzymes necessary to convert chorismate to the selected compound. Plasmids carrying selected genes of the common aromatic pathway are also described.

  19. Catalytic hydrogenation of an aromatic sulfonyl chloride into thiophenol 

    E-Print Network [OSTI]

    Rouckout, Nicolas Julien

    2009-05-15

    are blocked and an amorphous layer was formed on the surface of the palladium catalyst. Semi-Batch mode experimental data were obtained at 110 °C after 8 hours of reaction time for several aromatic sulfonyl chlorides. A kinetic model has been developed, which...

  20. Plasma-assisted conversion of solid hydrocarbon to diamond

    DOE Patents [OSTI]

    Valone, Steven M. (Santa Fe, NM); Pattillo, Stevan G. (Los Alamos, NM); Trkula, Mitchell (Los Alamos, NM); Coates, Don M. (Santa Fe, NM); Shah, S. Ismat (Wilmington, DE)

    1996-01-01

    A process of preparing diamond, e.g., diamond fiber, by subjecting a hydrocarbon material, e.g., a hydrocarbon fiber, to a plasma treatment in a gaseous feedstream for a sufficient period of time to form diamond, e.g., a diamond fiber is disclosed. The method generally further involves pretreating the hydrocarbon material prior to treatment with the plasma by heating within an oxygen-containing atmosphere at temperatures sufficient to increase crosslinking within said hydrocarbon material, but at temperatures insufficient to melt or decompose said hydrocarbon material, followed by heating at temperatures sufficient to promote outgassing of said crosslinked hydrocarbon material, but at temperatures insufficient to convert said hydrocarbon material to carbon.

  1. Method and apparatus for synthesizing hydrocarbons

    DOE Patents [OSTI]

    Colmenares, C.A.; Somorjai, G.A.; Maj, J.J.

    1983-06-21

    A method and apparatus for synthesizing a mixture of hydrocarbons having five carbons or less is disclosed. An equal molar ratio of CO and H/sub 2/ gases is caused to pass through a ThO/sub 2/ catalyst having a surface area of about 80 to 125 m/sup 2//g. The catalyst further includes Na present as a substitutional cation in an amount of about 5 to 10 atom %. At a temperature of about 340 to 360/sup 0/C, and at pressures of about 20 to 50 atm, CH/sub 3/OH is produced in an amount of about 90 wt % of the total hydrocarbon mixture, and comprised 1 mole % of the effluent gas.

  2. Conversion method for gas streams containing hydrocarbons

    DOE Patents [OSTI]

    Mallinson, Richard G. (Norman, OK); Lobban, Lance (Norman, OK); Liu, Chang-jun (Tianjin, CN)

    2000-01-01

    An apparatus and a method of using the apparatus are provided for converting a gas stream containing hydrocarbons to a reaction product containing effluent molecules having at least one carbon atom, having at least one interior surface and at least one exterior surface, a first electrode and a second electrode with the first and second electrodes being selectively movable in relation to each other and positioned within the housing so as to be spatially disposed a predetermined distance from each other, a plasma discharge generator between the first and second electrodes, gas stream introducer and a collector for collecting the reaction product effluent produced by the reaction of the gas stream containing hydrocarbons with the plasma discharge between the first and second electrodes.

  3. Process for mild hydrocracking of hydrocarbon feeds

    SciTech Connect (OSTI)

    Nevitt, T.D.; Hopkins, P.D.; Tait, A.M.

    1984-02-14

    A process for mild hydrocracking of hydrocarbon feeds comprising contacting the feed with hydrogen under mild hydrocracking conditions in the presence of a catalytic composition comprising an active metallic component comprising at least one metal having hydrogenation activity and at least one oxygenated phosphorus component, and a support component comprising at least one non-zeolitic, porous refractory inorganic oxide matrix component and at least one shape selective crystalline molecular sieve zeolite component.

  4. Characterization and quantitative analyses of polychlorinated hydrocarbons 

    E-Print Network [OSTI]

    Richardson, Robert Leary

    1974-01-01

    and quantitativ' analyses of certain poly- chlorinated hydrocarbons (PCB, !iDT and its metabolites in marine biota) were investigated. The occurence ot these compounds were expected at such low concentrations the use of the elec, tron capt gas... of contamination improved the sensitivity of detection of these chlorinated hydro- carbons to the parts per bi'!lion range. A variety of samples from the Gulf of Nexi co and Northern Caribbean were analyzed. The analytical procedure consisted of macerating...

  5. Oxidative dehydrogenation of alkanes to unsaturated hydrocarbons

    DOE Patents [OSTI]

    Kung, H.H.; Chaar, M.A.

    1988-10-11

    Oxidative dehydrogenation of alkanes to unsaturated hydrocarbons is carried out over metal vanadate catalysts under oxidizing conditions. The vanadate catalysts are represented by the formulas M[sub 3](VO[sub 4])[sub 2] and MV[sub 2]O[sub 6], M representing Mg, Zn, Ca, Pb, or Cd. The reaction is carried out in the presence of oxygen, but the formation of oxygenate by-products is suppressed.

  6. Getter pump for hydrogen and hydrocarbon gases

    DOE Patents [OSTI]

    Hsu, Wen Ling

    1987-10-14

    A gettering device for hydrogen isotopes and gaseous hydrocarbons based on the interaction of a plasma and graphite used as cathodic material. The plasma is maintained at a current density within the range of about 1 to about 1000 mA/cm/sup 2/. The graphite may be heated to a temperature greater than 1000/degree/C. The new device offers high capacity, low noise, and gas species selectivity. 2 figs.

  7. Hydrocarbon Fouling of SCR during PCCI combustion

    SciTech Connect (OSTI)

    Prikhodko, Vitaly Y [ORNL; Pihl, Josh A [ORNL; Lewis Sr, Samuel Arthur [ORNL; Parks, II, James E [ORNL

    2012-01-01

    The combination of advanced combustion with advanced selective catalytic reduction (SCR) catalyst formulations was studied in the work presented here to determine the impact of the unique hydrocarbon (HC) emissions from premixed charge compression ignition (PCCI) combustion on SCR performance. Catalyst core samples cut from full size commercial Fe- and Cu-zeolite SCR catalysts were exposed to a slipstream of raw engine exhaust from a 1.9-liter 4-cylinder diesel engine operating in conventional and PCCI combustion modes. The zeolites which form the basis of these catalysts are different with the Cu-based catalyst made on a chabazite zeolite which las smaller pore structures relative to the Fe-based catalyst. Subsequent to exposure, bench flow reactor characterization of performance and hydrocarbon release and oxidation enabled evaluation of overall impacts from the engine exhaust. The Fe-zeolite NOX conversion efficiency was significantly degraded, especially at low temperatures (<250 C), after the catalyst was exposed to the raw engine exhaust. The degradation of the Fe-zeolite performance was similar for both combustion modes. The Cu-zeolite showed better tolerance to HC fouling at low temperatures compared to the Fe-zeolite but PCCI exhaust had a more significant impact than the exhaust from conventional combustion on the NOX conversion efficiency. Furthermore, chemical analysis of the hydrocarbons trapped on the SCR cores was conducted to better determine chemistry specific effects.

  8. Effect of Unsaturated Bond on NOx and PAH Formation in nHeptane and 1Heptene Triple Flames

    E-Print Network [OSTI]

    Aggarwal, Suresh K.

    Effect of Unsaturated Bond on NOx and PAH Formation in nHeptane and 1Heptene Triple Flames X. Han of Illinois at Chicago, Chicago, Illinois 60607, United States ABSTRACT: Various engine and shock tube studies flames. NOx formation in the rich premixed zone is primarily due to the prompt NO

  9. Redox shuttles having an aromatic ring fused to a 1,1,4,4-tetrasubstituted cyclohexane ring

    DOE Patents [OSTI]

    Weng, Wei; Zhang, Zhengcheng; Amine, Khalil

    2015-12-01

    An electrolyte includes an alkali metal salt; an aprotic solvent; and a redox shuttle additive including an aromatic compound having at least one aromatic ring fused with at least one non-aromatic ring, the aromatic ring having two or more oxygen or phosphorus-containing substituents.

  10. Amination of electrophilic aromatic compounds by vicarious nucleophilic substitution

    DOE Patents [OSTI]

    Mitchell, Alexander R. (Livermore, CA); Pagoria, Philip F. (Livermore, CA); Schmidt, Robert D. (Livermore, CA)

    2000-01-01

    The present invention relates to a process to aminate electrophilic aromatic compounds by vicarious nucleophilic substitution of hydrogen using quaternary hydrazinium salts. The use of trialkylhydrazinium halide, e.g., trimethylhydrazinium iodide, as well as hydroxylamine, alkoxylamines, and 4-amino-1,2,4-triazole to produce aminated aromatic structures, such as 1,3-diamino-2,4,6-trinitrobenzene (DATB), 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) and 3,5-diamino-2,4,6-trinitrotoluene (DATNT), is described. DATB and TATB are useful insensitive high explosives. TATB is also used for the preparation of benzenehexamine, a starting material for the synthesis of novel materials (optical imaging devices, liquid crystals, ferromagnetic compounds).

  11. Syngas Conversion to Gasoline-Range Hydrocarbons over Pd/ZnO/Al2O3 and ZSM-5 Composite Catalyst System

    SciTech Connect (OSTI)

    Dagle, Robert A.; Lizarazo Adarme, Jair A.; Lebarbier, Vanessa MC; Gray, Michel J.; White, James F.; King, David L.; Palo, Daniel R.

    2014-07-01

    A composite Pd/ZnO/Al2O3-HZSM-5 (Si/Al=40) catalytic system was evaluated for the synthesis of gasoline-range hydrocarbons directly from synthesis gas. Bifunctional catalyst comprising PdZn metal and acid sites present the required catalytically active sites necessary for the methanol synthesis, methanol dehydration, and methanol-to-gasoline reactions. This system provides a unique catalytic pathway for the production of liquid hydrocarbons directly from syngas. However, selectivity control is difficult and poses many challenges. The composite catalytic system was evaluated under various process conditions. Investigated were the effects of temperature (310-375oC), pressure (300-1000 psig), time-on-stream (50 hrs), and gas-hour space velocity (740-2970 hr-1), using a H2/CO molar syngas ratio of 2.0. By operating at the lower end of the temperature range investigated, liquid hydrocarbon formation was favored, as was decreased amounts of undesirable light hydrocarbons. However, lower operating temperatures also facilitated undesirable CO2 formation via the water-gas shift reaction. Higher operating pressures slightly favored liquid synthesis. Operating at relatively low pressures (e.g. 300 psig) was made possible, whereas for methanol synthesis alone higher pressure are usually required to achieve similar conversion levels (e.g. 1000 psig). Thermodynamic constraints on methanol synthesis are eased by pushing the equilibrium through hydrocarbon formation. Catalytic performance was also evaluated by altering Pd and Zn composition of the Pd/ZnO/Al2O3 catalyst. Of the catalysts and conditions tested, selectivity toward liquid hydrocarbon was highest when using a 5% Pd metal loading and Pd/Zn molar ratio of 0.25 and mixed with HZMS-5, operating at 310oC and 300 psig, CO conversion was 43 % and selectivity (carbon weight basis) to hydrocarbons was 49 wt. %. Of the hydrocarbon fraction, 44wt. % was in the C5-C12 liquid product range and consisted primarily of aromatic polymethylbenzenes. However, as syngas conversion increases with increasing temperature, selectivity to liquid product diminished. This is attributed, in large part, to increased saturation of the olefinic intermediates over PdZn metal sites. Under all the conditions and catalysts evaluated in this study, generating liquid product in high yield was challenging (<10 wt. % C5+ yield).

  12. Method for producing hydrocarbon and alcohol mixtures. [Patent application

    DOE Patents [OSTI]

    Compere, A.L.; Googin, J.M.; Griffith, W.L.

    1980-12-01

    It is an object of this invention to provide an efficient process for extracting alcohols and ketones from an aqueous solution containing the same into hydrocarbon fuel mixtures, such as gasoline, diesel fuel and fuel oil. Another object of the invention is to provide a mixture consisting of hydrocarbon, alcohols or ketones, polyoxyalkylene polymer and water which can be directly added to fuels or further purified. The above stated objects are achieved in accordance with a preferred embodiment of the invention by contacting an aqueous fermentation liquor with a hydrocarbon or hydrocarbon mixture containing carbon compounds having 5 to 18 carbon atoms, which may include gasoline, diesel fuel or fuel oil. The hydrocarbon-aqueous alcohol solution is mixed in the presence or one or more of a group of polyoxyalkylene polymers described in detail hereinafter; the fermentation alcohol being extracted into the hydrocarbon fuel-polyoxyalkylene polymer mixture.

  13. Applications of contaminant fate and bioaccumulation models in assessing ecological risks of chemicals: A case study for gasoline hydrocarbons

    E-Print Network [OSTI]

    MacLeod, Matthew; McKone, Thomas E.; Foster, Karen L.; Maddalena, Randy L.; Parkerton, Thomas F.; Mackay, Don

    2004-01-01

    A Case Study for Gasoline Hydrocarbons Matthew MacLeod 1 ,since the component hydrocarbons comprising this complexthat the component hydrocarbons comprising this complex

  14. Process for removing carbonyl-sulfide from liquid hydrocarbon feedstocks

    SciTech Connect (OSTI)

    Debras, G.L.G.; DeClippeleir, G.E.M.J.; Cahen, R.M.

    1986-09-23

    A process is described for removing carbonyl sulfide from a liquid olefinic hydrocarbon feedstock comprising: (a) passing the hydrocarbon feedstock over an absorbent material comprising zinc oxide and a promoter selected from the group consisting of alumina, silico-aluminas and any combination thereof wherein the promoter is present in amounts from about 3 to about 15 percent by weight of the absorbent material; and (b) recovering a liquid olefinic hydrocarbon stream having a substantially reduced carbonyl sulfide content.

  15. Hydrocarbon analysis of shrimp from oil polluted waters 

    E-Print Network [OSTI]

    DeWitt, Bernard John

    1982-01-01

    but ubiquitous compounds in the marine environment (Clark and Finley, 1973). They occur in marine organisms, in sediments and in seawater according to Clark and Blumer (1967). To determine oil pollution, a means of differentiating petroleum hydrocarbons from... in the marine environment for long periods. They enter the environment from fossil fuels and decaying marine organisms (Clark and Blumer, 1967). Therefore pollution and biogenic hydrocarbons contain the same hydrocarbons, although from different sources...

  16. Systems and methods for producing hydrocarbons from tar sands formations

    DOE Patents [OSTI]

    Li, Ruijian (Katy, TX); Karanikas, John Michael (Houston, TX)

    2009-07-21

    A system for treating a tar sands formation is disclosed. A plurality of heaters are located in the formation. The heaters include at least partially horizontal heating sections at least partially in a hydrocarbon layer of the formation. The heating sections are at least partially arranged in a pattern in the hydrocarbon layer. The heaters are configured to provide heat to the hydrocarbon layer. The provided heat creates a plurality of drainage paths for mobilized fluids. At least two of the drainage paths converge. A production well is located to collect and produce mobilized fluids from at least one of the converged drainage paths in the hydrocarbon layer.

  17. Ethanol-to-Hydrocarbon Technology Moves Closer to Commercialization...

    Energy Savers [EERE]

    and enable production of drop-in hydrocarbon fuels more quickly, in addition to expanding production of jet fuel, diesel, and renewable commodity chemicals. In addition, Oak...

  18. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    of Energy Low-Temperature HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Ken Rapp, Liyu Li, Jonathan Male, Dave King Pacific Northwest National...

  19. Carbonaceous adsorbent regeneration and halocarbon displacement by hydrocarbon gases

    DOE Patents [OSTI]

    Senum, G.I.; Dietz, R.N.

    1994-04-05

    This invention describes a process for regeneration of halocarbon bearing carbonaceous adsorbents through which a carbonaceous adsorbent is contacted with hydrocarbon gases, preferably propane, butane and pentane at near room temperatures and at atmospheric pressure. As the hydrocarbon gases come in contact with the adsorbent, the hydrocarbons displace the halocarbons by physical adsorption. As a result of using this process, the halocarbon concentration and the hydrocarbon eluant is increased thereby allowing for an easier recovery of pure halocarbons. By using the process of this invention, carbonaceous adsorbents can be regenerated by an inexpensive process which also allows for subsequent re-use of the recovered halocarbons. 8 figures.

  20. Carbonaceous adsorbent regeneration and halocarbon displacement by hydrocarbon gases

    DOE Patents [OSTI]

    Senum, Gunnar I. (Patchogue, NY); Dietz, Russell N. (Patchogue, NY)

    1994-01-01

    This invention describes a process for regeneration of halocarbon bearing carbonaceous adsorbents through which a carbonaceous adsorbent is contacted with hydrocarbon gases, preferably propane, butane and pentane at near room temperatures and at atmospheric pressure. As the hydrocarbon gases come in contact with the adsorbent, the hydrocarbons displace the halocarbons by physical adsorption. As a result of using this process, the halocarbon concentration and the hydrocarbon eluant is increased thereby allowing for an easier recovery of pure halocarbons. By using the process of this invention, carbonaceous adsorbents can be regenerated by an inexpensive process which also allows for subsequent re-use of the recovered halocarbons.

  1. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    (OFCVT). deer07rappe.pdf More Documents & Publications Low-Temperature HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Selectlive Catalytic Reducution of...

  2. ILENR/RE-AQ-ON-ROAD CARBON MONOXIDE AND HYDROCARBON

    E-Print Network [OSTI]

    Denver, University of

    #12;ILENR/RE-AQ- Printed: Contract: Project: ON-ROAD CARBON MONOXIDE AND HYDROCARBON REMOTE SENSING. Repeat Measurements of the Same Vehicle. . . . . . . . . . . . . . . . . . . . . . . . . . . . . 22 F

  3. Mechanisms of Hydrocarbon Poisoning of A Urea SCR Catalyst

    Broader source: Energy.gov [DOE]

    Understanding what reactions and which catalytic functions are affected by hydrocarbons can lead to improved tolerances for selective catalytic reduction performance

  4. Methods for natural gas and heavy hydrocarbon co-conversion

    DOE Patents [OSTI]

    Kong, Peter C. (Idaho Falls, ID); Nelson, Lee O. (Idaho Falls, ID); Detering, Brent A. (Idaho Falls, ID)

    2009-02-24

    A reactor for reactive co-conversion of heavy hydrocarbons and hydrocarbon gases and includes a dielectric barrier discharge plasma cell having a pair of electrodes separated by a dielectric material and passageway therebetween. An inlet is provided for feeding heavy hydrocarbons and other reactive materials to the passageway of the discharge plasma cell, and an outlet is provided for discharging reaction products from the reactor. A packed bed catalyst may optionally be used in the reactor to increase efficiency of conversion. The reactor can be modified to allow use of a variety of light sources for providing ultraviolet light within the discharge plasma cell. Methods for upgrading heavy hydrocarbons are also disclosed.

  5. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Catalysis in Support of HCCI Emission Control Low-Temperature HydrocarbonCO Oxidation Catalysis in Support of HCCI Emission Control Lean NOx Catalysis Research and Development...

  6. Enhanced Anaerobic Digestion and Hydrocarbon Precursor Production from Sewage Sludge

    Office of Energy Efficiency and Renewable Energy (EERE)

    Breakout Session 2-C: Biogas and Beyond: Challenges and Opportunities for Advanced Biofuels from Wet-Waste FeedstocksEnhanced Anaerobic Digestion and Hydrocarbon Precursor Production from Sewage...

  7. Performance of a Thermally Stable Polyaromatic Hydrocarbon in...

    Office of Scientific and Technical Information (OSTI)

    Performance of a Thermally Stable Polyaromatic Hydrocarbon in a Simulated Concentrating Solar Power Loop Citation Details In-Document Search Title: Performance of a Thermally...

  8. Ozone production and hydrocarbon reactivity in Hong Kong, Southern China

    E-Print Network [OSTI]

    2007-01-01

    Middleton, P. , and Wang, T. : Ozone precursor relationshipsJ. Zhang et al. : Ozone production and hydrocarbonKiang, C. S. : Ground- level ozone pollution in Hong Kong,

  9. Fuel Cell Technologies Office Overview: 2015 Hydrogen, Hydrocarbons...

    Broader source: Energy.gov (indexed) [DOE]

    Introductory presentation by Sunita Satyapal, U.S. Department of Energy Fuel Cell Technologies Office Director, at the Hydrogen, Hydrocarbons, and Bioproduct Precursors from...

  10. Sandia Energy - ECIS-Automotive Fuel Cell Corporation: Hydrocarbon...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    ECIS-Automotive Fuel Cell Corporation: Hydrocarbon Membrane Fuels the Success of Future Generation Vehicles Home Energy Transportation Energy CRF Partnership Energy Efficiency...

  11. Process for making unsaturated hydrocarbons using microchannel process technology

    DOE Patents [OSTI]

    Tonkovich, Anna Lee (Dublin, OH); Yuschak, Thomas (Lewis Center, OH); LaPlante, Timothy J. (Columbus, OH); Rankin, Scott (Columbus, OH); Perry, Steven T. (Galloway, OH); Fitzgerald, Sean Patrick (Columbus, OH); Simmons, Wayne W. (Dublin, OH); Mazanec, Terry (Solon, OH) Daymo, Eric (Dublin, OH)

    2011-04-12

    The disclosed invention relates to a process for converting a feed composition comprising one or more hydrocarbons to a product comprising one or more unsaturated hydrocarbons, the process comprising: flowing the feed composition and steam in contact with each other in a microchannel reactor at a temperature in the range from about 200.degree. C. to about 1200.degree. C. to convert the feed composition to the product, the process being characterized by the absence of catalyst for converting the one or more hydrocarbons to one or more unsaturated hydrocarbons. Hydrogen and/or oxygen may be combined with the feed composition and steam.

  12. Hydrocarbon Inhibition and HC Storage Modeling in Fe-Zeolite...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    to simultaneously reduce NOx and PM. Ex: HC poisoninginhibition on zeolites1, catalyst aging, etc. deer09devarakonda.pdf More Documents & Publications The Effects of Hydrocarbons...

  13. Syngas Upgrading to Hydrocarbon Fuels Technology Pathway | Department...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Pathway This technology pathway case investigates the upgrading of woody biomass derived synthesis gas (syngas) to hydrocarbon biofuels. While this specific discussion...

  14. Algal Lipid Extraction and Upgrading to Hydrocarbons Technology...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    for the algal lipid extraction and upgrading pathway to be competitive with petroleum-derived gasoline-, diesel-, and jet-range hydrocarbon blendstocks. Algal Lipid Extraction and...

  15. Catalytic Upgrading of Sugars to Hydrocarbons Technology Pathway...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    for the catalytic conversion of sugars pathway to be competitive with petroleum-derived gasoline-, diesel-, and jet-range hydrocarbon blendstocks have been identified....

  16. Biological Conversion of Sugars to Hydrocarbons Technology Pathway...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Pathway This technology pathway case investigates the biological conversion of biomass-derived sugars to hydrocarbon biofuels, utilizing data from recent literature references and...

  17. Soot precursor measurements in benzene and hexane diffusion flames

    SciTech Connect (OSTI)

    Kobayashi, Y.; Furuhata, T.; Amagai, K.; Arai, M.

    2008-08-15

    To clarify the mechanism of soot formation in diffusion flames of liquid fuels, measurements of soot and its precursors were carried out. Sooting diffusion flames formed by a small pool combustion equipment system were used for this purpose. Benzene and hexane were used as typical aromatic and paraffin fuels. A laser-induced fluorescence (LIF) method was used to obtain spatial distributions of polycyclic aromatic hydrocarbons (PAHs), which are considered as soot particles. Spatial distributions of soot in test flames were measured by a laser-induced incandescence (LII) method. Soot diameter was estimated from the temporal change of LII intensity. A region of transition from PAHs to soot was defined from the results of LIF and LII. Flame temperatures, PAH species, and soot diameters in this transition region were investigated for both benzene and hexane flames. The results show that though the flame structures of benzene and hexane were different, the temperature in the PAHs-soot transition region of the benzene flame was similar to that of the hexane flame. Furthermore, the relationship between the PAH concentrations measured by gas chromatography in both flames and the PAH distributions obtained from LIF are discussed. It was found that PAHs with smaller molecular mass, such as benzene and toluene, remained in both the PAHs-soot transition and sooting regions, and it is thought that molecules heavier than pyrene are the leading candidates for soot precursor formation. (author)

  18. Anal. Chem. 1993, 65, 3571-3575 3571 Ultrasensitive Fluorescence Detection of Polycyclic Aromatic

    E-Print Network [OSTI]

    Zare, Richard N.

    Hydrocarbons in Capillary Electrophoresis ShumingNie, Rajeev Dadoo, and Richard N. 2are* Department hydrocarbons, including anthracene, phenan- threne, benz[alanthracene, methylanthracene, pyrene, fluoranthene hydrophobic, is difficult by conventional CE or micellar e

  19. Fundamental measure theory of hydrated hydrocarbons

    E-Print Network [OSTI]

    Victor F. Sokolov; Gennady N. Chuev

    2006-04-13

    To calculate the solvation of hydrophobic solutes we have developed the method based on the fundamental measure treatment of the density functional theory. This method allows us to carry out calculations of density profiles and the solvation energy for various hydrophobic molecules with a high accuracy. We have applied the method to the hydration of various hydrocarbons (linear, branched and cyclic). The calculations of the entropic and the enthalpic parts are also carried out. We have examined a question about temperature dependence of the entropy convergence. Finally, we have calculated the mean force potential between two large hydrophobic nanoparticles immersed in water.

  20. Hydrocarbon synthesis catalyst and method of preparation

    DOE Patents [OSTI]

    Sapienza, Richard S. (Shoreham, NY); Sansone, Michael J. (Summit, NJ); Slegeir, William A. R. (Hampton Bays, NY)

    1983-08-02

    A catalyst for the synthesis of hydrocarbons from carbon monoxide and hydrogen composed of palladium or platinum and cobalt supported on a solid phase is disclosed. The catalyst is prepared by heating a heterogeneous component of the palladium or platinum deposited on the solid support in a solution of cobalt carbonyl or precursors thereof. The catalyst exhibits excellent activity, stability in air, and produces highly desirable product fractions even with dilute gaseous reactants. The catalyst is preferably used in dilute slurry form, which is desirable from a heat transfer standpoint.

  1. Hydrocarbon synthesis catalyst and method of preparation

    DOE Patents [OSTI]

    Sapienza, R.S.; Sansone, M.J.; Slegeir, W.A.R.

    1983-08-02

    A catalyst for the synthesis of hydrocarbons from carbon monoxide and hydrogen composed of palladium or platinum and cobalt supported on a solid phase is disclosed. The catalyst is prepared by heating a heterogeneous component of the palladium or platinum deposited on the solid support in a solution of cobalt carbonyl or precursors thereof. The catalyst exhibits excellent activity, stability in air, and produces highly desirable product fractions even with dilute gaseous reactants. The catalyst is preferably used in dilute slurry form, which is desirable from a heat transfer standpoint. 9 figs.

  2. Plasma-Hydrocarbon conversion - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Homesum_a_epg0_fpd_mmcf_m.xls" ,"Available from WebQuantityBonneville Power Administration wouldMass mapSpeeding access| DepartmentPeerFederal FleetUpSmallHydrocarbon conversion Idaho

  3. Gulf Hydrocarbon Inc | Open Energy Information

    Open Energy Info (EERE)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels Data Center Home Page on QA:QA J-E-1 SECTION J APPENDIXsource History View NewGuam: Energy Resources Jump to: navigation,LowGuinea:Hydrocarbon

  4. Preliminary Geospatial Analysis of Arctic Ocean Hydrocarbon Resources

    SciTech Connect (OSTI)

    Long, Philip E.; Wurstner, Signe K.; Sullivan, E. C.; Schaef, Herbert T.; Bradley, Donald J.

    2008-10-01

    Ice coverage of the Arctic Ocean is predicted to become thinner and to cover less area with time. The combination of more ice-free waters for exploration and navigation, along with increasing demand for hydrocarbons and improvements in technologies for the discovery and exploitation of new hydrocarbon resources have focused attention on the hydrocarbon potential of the Arctic Basin and its margins. The purpose of this document is to 1) summarize results of a review of published hydrocarbon resources in the Arctic, including both conventional oil and gas and methane hydrates and 2) develop a set of digital maps of the hydrocarbon potential of the Arctic Ocean. These maps can be combined with predictions of ice-free areas to enable estimates of the likely regions and sequence of hydrocarbon production development in the Arctic. In this report, conventional oil and gas resources are explicitly linked with potential gas hydrate resources. This has not been attempted previously and is particularly powerful as the likelihood of gas production from marine gas hydrates increases. Available or planned infrastructure, such as pipelines, combined with the geospatial distribution of hydrocarbons is a very strong determinant of the temporal-spatial development of Arctic hydrocarbon resources. Significant unknowns decrease the certainty of predictions for development of hydrocarbon resources. These include: 1) Areas in the Russian Arctic that are poorly mapped, 2) Disputed ownership: primarily the Lomonosov Ridge, 3) Lack of detailed information on gas hydrate distribution, and 4) Technical risk associated with the ability to extract methane gas from gas hydrates. Logistics may control areas of exploration more than hydrocarbon potential. Accessibility, established ownership, and leasing of exploration blocks may trump quality of source rock, reservoir, and size of target. With this in mind, the main areas that are likely to be explored first are the Bering Strait and Chukchi Sea, in spite of the fact that these areas do not have highest potential for future hydrocarbon reserves. Opportunities for improving the mapping and assessment of Arctic hydrocarbon resources include: 1) Refining hydrocarbon potential on a basin-by-basin basis, 2) Developing more realistic and detailed distribution of gas hydrate, and 3) Assessing the likely future scenarios for development of infrastructure and their interaction with hydrocarbon potential. It would also be useful to develop a more sophisticated approach to merging conventional and gas hydrate resource potential that considers the technical uncertainty associated with exploitation of gas hydrate resources. Taken together, additional work in these areas could significantly improve our understanding of the exploitation of Arctic hydrocarbons as ice-free areas increase in the future.

  5. Effects of chemical additives on hydrocarbon disappearance and biodegradation in freshwater marsh microcosms

    E-Print Network [OSTI]

    Nyman, John

    determined the concentration of four total petroleum hydrocarbon (TPH) measures and 43 target hydro- carbonsEffects of chemical additives on hydrocarbon disappearance and biodegradation in freshwater marsh 2006 Hydrocarbon disappearance and biodegradation were insensitive to common commercial additives

  6. Field metabolomics and laboratory assessments of anaerobic intrinsic bioremediation of hydrocarbons

    E-Print Network [OSTI]

    Alvarez, Pedro J.

    Field metabolomics and laboratory assessments of anaerobic intrinsic bioremediation of hydrocarbons the in situ anaerobic attenuation of hydrocarbons in a contaminated aquifer underly- ing a former refinery. Metabolite profiles associated with anaerobic hydrocarbon decay revealed the microbial utilization

  7. Lasius niger ants discriminate aphids based on their cuticular hydrocarbons Corsin Langa,1

    E-Print Network [OSTI]

    Richner, Heinz

    Lasius niger ants discriminate aphids based on their cuticular hydrocarbons Corsin Langa,1 chemical communication cuticular hydrocarbon interspecific communication Lasius niger mutualism species covered with aphid cuticular hydrocarbons. Neutral control objects were antennated, but the ants quickly

  8. HYDROCARBON LIQUID FLOW CALIBRATION SERVICE NIST Special Publication 250-1039

    E-Print Network [OSTI]

    Magee, Joseph W.

    HYDROCARBON LIQUID FLOW CALIBRATION SERVICE NIST Special Publication 250-1039 T. T. Yeh, Jesús and Technology Laboratory National Institute of Standards and Technology Gaithersburg, MD 20899 #12;Hydrocarbon......................................... 3 4.0 Description of the Hydrocarbon Liquid Flow Standard

  9. HYDROCARBONS OF BIOLOGICAL ORIGIN FROM A ONE-BILLION YEAR OLD SEDIMENT

    E-Print Network [OSTI]

    Eglinton, Geoffrey.; Scott, P.M.; Belsky, Ted.; Burlingame, A.L.; Calvin, Melvin.; Cloud Jr., Preston E.

    1964-01-01

    Contract No. W-7405-eng-48 HYDROCARBONS OF BIOLOGICAL ORIGINAbstract The isoprenoid hydrocarbons, phytane (C 20H4Z) andThe identification of these hydrocarbons augurs well for the

  10. Heterogeneous OH Oxidation of Motor Oil Particles Causes Selective Depletion of Branched and Less Cyclic Hydrocarbons

    E-Print Network [OSTI]

    Goldstein, Allen

    Cyclic Hydrocarbons Gabriel Isaacman,, * Arthur W. H. Chan, Theodora Nah, David R. Worton,,§ Chris R of hydrocarbon mixtures typical of anthropogenic atmospheric particulate matter, but its complexity often reaction rates of observed hydrocarbon classes: alkanes, cycloalkanes, bicycloalkanes, tricycloalkanes

  11. The Hydrophobic Effect Drives the Recognition of Hydrocarbons by an Anionic Metal-Ligand Cluster

    E-Print Network [OSTI]

    Biros, Shannon

    2009-01-01

    Drives the Recognition of Hydrocarbons by an Anionic Metal-Drives the Recognition of Hydrocarbons by an Anionic Metal-including saturated hydrocarbons, 11,12 in aqueous solution,

  12. Cyclic Versus Linear Isomers Produced by Reaction of the Methylidyne Radical (CH) with Small Unsaturated Hydrocarbons

    E-Print Network [OSTI]

    Goulay, Fabien

    2010-01-01

    with Small Unsaturated Hydrocarbons Fabien Goulay, 1, †,‡react with the selected hydrocarbon in a helium gas flow.Small cyclic unsaturated hydrocarbons such as c-C 3 H, c-C 3

  13. Adsorption of unsaturated hydrocarbons on zeolites: the eects of the zeolite framework on adsorption

    E-Print Network [OSTI]

    Truong, Thanh N.

    Adsorption of unsaturated hydrocarbons on zeolites: the eects of the zeolite framework industrially important reactions, namely the polymerization and hydrocarbon cracking processes [9 as a starting point for a more comprehensive study on hydrocarbon cracking and ethylene epoxidation reactions

  14. Process for the production of liquid hydrocarbons

    DOE Patents [OSTI]

    Bhatt, Bharat Lajjaram; Engel, Dirk Coenraad; Heydorn, Edward Clyde; Senden, Matthijis Maria Gerardus

    2006-06-27

    The present invention concerns a process for the preparation of liquid hydrocarbons which process comprises contacting synthesis gas with a slurry of solid catalyst particles and a liquid in a reactor vessel by introducing the synthesis gas at a low level into the slurry at conditions suitable for conversion of the synthesis gas into liquid hydrocarbons, the solid catalyst particles comprising a catalytic active metal selected from cobalt or iron on a porous refractory oxide carrier, preferably selected from silica, alumina, titania, zirconia or mixtures thereof, the catalyst being present in an amount between 10 and 40 vol. percent based on total slurry volume liquids and solids, and separating liquid material from the solid catalyst particles by using a filtration system comprising an asymmetric filtration medium (the selective side at the slurry side), in which filtration system the average pressure differential over the filtration medium is at least 0.1 bar, in which process the particle size distribution is such that at least a certain amount of the catalyst particles is smaller than the average pore size of the selective layer of the filtration medium. The invention also comprises an apparatus to carry out the process described above.

  15. Nanoparticles in Flow Assurance in Hydrocarbon Energy Production Abbas Firoozabadi

    E-Print Network [OSTI]

    Firoozabadi, Abbas

    friendly alternative We have discovered that the addition of small amounts of methanol improves practice is using aromatic solvents such as xylene to prevent aspahltene precipitation Our work shows great

  16. ADHESION FORCES BETWEEN MICA SURFACES IN UNDERSATURATED VAPORS OF HYDROCARBONS

    E-Print Network [OSTI]

    Matsuoka, Hiroshige

    ADHESION FORCES BETWEEN MICA SURFACES IN UNDERSATURATED VAPORS OF HYDROCARBONS H. MATSUOKA1 , T] or meniscus force [3], which have been neglected in the conventional and relatively large mechani- cal systems forces between mica surfaces in under- saturated vapors of several kind of hydrocarbon liquids are mea

  17. Scroll compressor modelling for heat pumps using hydrocarbons as refrigerants

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1 Scroll compressor modelling for heat pumps using hydrocarbons as refrigerants Paul BYRNE and to install heat pumps in unoccupied spaces. Nevertheless manufacturers keep working on components for hydrocarbons. In the frame of a research project on heat pumps for simultaneous heating and cooling, an R407C

  18. Bimetallic cleavage of aromatic C-H bonds by rare-earth-metal complexes

    E-Print Network [OSTI]

    Huang, W; Huang, W; Dulong, F; Khan, SI; Cantat, T; Diaconescu, PL

    2014-01-01

    of Aromatic C-H Bonds by Rare Earth Metal Complexes Wenliangone week prior to use. Rare earth metal oxides (scandium,

  19. The Impact of Low Octane Hydrocarbon Blending Streams on "E85...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    The Impact of Low Octane Hydrocarbon Blending Streams on "E85" Engine Optimization The Impact of Low Octane Hydrocarbon Blending Streams on "E85" Engine Optimization...

  20. Heating hydrocarbon containing formations in a line drive staged process

    DOE Patents [OSTI]

    Miller, David Scott (Katy, TX)

    2009-07-21

    Method for treating a hydrocarbon containing formation are described herein. Methods may include providing heat to a first section of the formation with one or more first heaters in the first section. First hydrocarbons may be heated in the first section such that at least some of the first hydrocarbons are mobilized. At least some of the mobilized first hydrocarbons may be produced through a production well located in a second section of the formation. The second section may be located substantially adjacent to the first section. A portion of the second section may be provided some heat from the mobilized first hydrocarbons, but is not conductively heated by heat from the first heaters. Heat may be provided to the second section with one or more second heaters in the second section to further heat the second section.

  1. Cogeneration systems and processes for treating hydrocarbon containing formations

    DOE Patents [OSTI]

    Vinegar, Harold J. (Bellaire, TX); Fowler, Thomas David (Houston, TX); Karanikas, John Michael (Houston, TX)

    2009-12-29

    A system for treating a hydrocarbon containing formation includes a steam and electricity cogeneration facility. At least one injection well is located in a first portion of the formation. The injection well provides steam from the steam and electricity cogeneration facility to the first portion of the formation. At least one production well is located in the first portion of the formation. The production well in the first portion produces first hydrocarbons. At least one electrical heater is located in a second portion of the formation. At least one of the electrical heaters is powered by electricity from the steam and electricity cogeneration facility. At least one production well is located in the second portion of the formation. The production well in the second portion produces second hydrocarbons. The steam and electricity cogeneration facility uses the first hydrocarbons and/or the second hydrocarbons to generate electricity.

  2. Application of Metagenomics for Identification of Novel Petroleum Hydrocarbon Degrading Enzymes in Natural Asphalts from the Rancho La Brea Tar Pits

    E-Print Network [OSTI]

    Baquiran, Jean-Paul Mendoza

    2010-01-01

    of petroleum hydrocarbon-contaminated ground water: Theof petroleum hydrocarbon-contaminated ground water: The

  3. Hydrocarbon Contamination Evaluation of River Sediment from the Lower Fox River, Wisconsin 

    E-Print Network [OSTI]

    Brewster, Chase Samuel

    2015-08-10

    sediment samples nearest to the DePere dam contained the highest PAHs levels at 63,600 ng/g and 56,700 ng/g, respectively. Cross-plots of PAHs were used to compare diagnostic source ratios of: benzo[a]pyrene (BaA), chrysene (Chy), fluoranthene (Fl), pyrene...

  4. Preliminary assessment of alkane and PAH data for sediment cores from six lakes in the Fraser River basin

    E-Print Network [OSTI]

    basin DOE FRAP 1998-18 Prepared for: Environment Canada Environmental Conservation Branch Aquatic pattern of hydrocarbons both in terms of history and compound distribution. All lake sediments contain

  5. Microbial hydrocarbons: back to the future

    SciTech Connect (OSTI)

    Work, Victoria H.; Beliaev, Alex S.; Konopka, Allan; Posewitz, Matthew C.

    2012-03-01

    The defining challenge of energy research in the 21st century is the development and deployment of technologies for large-scale reconfiguration of global energy infrastructure. Modern society is built upon a concentrated yet finite reservoir of diverse hydrocarbons formed through the photosynthetic transformation of several hundred million years of solar energy. In human history, the fossil energy era will be short lived and never repeated. Although the timing of peak oil is extensively debated, it is an eventuality. It is, therefore, imperative that projections for both when it will occur and the degree to which supply will fall short of demand be taken into serious consideration, especially in the sectors of energy technology development, political and economic decision making, and societal energy usage. The requirement for renewable energy systems is no longer a point for discussion, and swift advances on many fronts are vital to counteract current and impending crises in both energy and the environment.

  6. Method and apparatus for synthesizing hydrocarbons

    DOE Patents [OSTI]

    Colmenares, C.A.; Somorjai, G.A.; Maj, J.J.

    1985-04-16

    A method and apparatus for synthesizing a mixture of aliphatic alcohols having five carbons or less is disclosed. An equal molar ratio of CO and H/sub 2/ gases is caused to pass through a ThO/sub 2/ catalyst having a surface area of about 80 to 125 m/sup 2//g. The catalyst further optionally includes Na ions present as substitutional cations in an amount of about 5 to 10 atom %. At a temperature of about 570 to 630/sup 0/K, and at pressures of about 20 to 50 atm, methanol and isobutanol are the predominant products and are produced in amounts of about 90 wt % of the total hydrocarbon mixture. 6 figs.

  7. System and process for upgrading hydrocarbons

    SciTech Connect (OSTI)

    Bingham, Dennis N.; Klingler, Kerry M.; Smith, Joseph D.; Turner, Terry D.; Wilding, Bruce M.

    2015-08-25

    In one embodiment, a system for upgrading a hydrocarbon material may include a black wax upgrade subsystem and a molten salt gasification (MSG) subsystem. The black wax upgrade subsystem and the MSG subsystem may be located within a common pressure boundary, such as within a pressure vessel. Gaseous materials produced by the MSG subsystem may be used in the process carried out within the black wax upgrade subsystem. For example, hydrogen may pass through a gaseous transfer interface to interact with black wax feed material to hydrogenate such material during a cracking process. In one embodiment, the gaseous transfer interface may include one or more openings in a tube or conduit which is carrying the black wax material. A pressure differential may control the flow of hydrogen within the tube or conduit. Related methods are also disclosed.

  8. Pyrochlore catalysts for hydrocarbon fuel reforming

    DOE Patents [OSTI]

    Berry, David A.; Shekhawat, Dushyant; Haynes, Daniel; Smith, Mark; Spivey, James J.

    2012-08-14

    A method of catalytically reforming a reactant gas mixture using a pyrochlore catalyst material comprised of one or more pyrochlores having the composition A2B2-y-zB'yB"zO7-.DELTA., where y>0 and z.gtoreq.0. Distribution of catalytically active metals throughout the structure at the B site creates an active and well dispersed metal locked into place in the crystal structure. This greatly reduces the metal sintering that typically occurs on supported catalysts used in reforming reactions, and reduces deactivation by sulfur and carbon. Further, oxygen mobility may also be enhanced by elemental exchange of promoters at sites in the pyrochlore. The pyrochlore catalyst material may be utilized in catalytic reforming reactions for the conversion of hydrocarbon fuels into synthesis gas (H2+CO) for fuel cells, among other uses.

  9. Hydrocarbon characterization experiments in fully turbulent fires.

    SciTech Connect (OSTI)

    Ricks, Allen; Blanchat, Thomas K.

    2007-05-01

    As the capabilities of numerical simulations increase, decision makers are increasingly relying upon simulations rather than experiments to assess risks across a wide variety of accident scenarios including fires. There are still, however, many aspects of fires that are either not well understood or are difficult to treat from first principles due to the computational expense. For a simulation to be truly predictive and to provide decision makers with information which can be reliably used for risk assessment the remaining physical processes must be studied and suitable models developed for the effects of the physics. The model for the fuel evaporation rate in a liquid fuel pool fire is significant because in well-ventilated fires the evaporation rate largely controls the total heat release rate from the fire. A set of experiments are outlined in this report which will provide data for the development and validation of models for the fuel regression rates in liquid hydrocarbon fuel fires. The experiments will be performed on fires in the fully turbulent scale range (> 1 m diameter) and with a number of hydrocarbon fuels ranging from lightly sooting to heavily sooting. The importance of spectral absorption in the liquid fuels and the vapor dome above the pool will be investigated and the total heat flux to the pool surface will be measured. The importance of convection within the liquid fuel will be assessed by restricting large scale liquid motion in some tests. These data sets will provide a sound, experimentally proven basis for assessing how much of the liquid fuel needs to be modeled to enable a predictive simulation of a fuel fire given the couplings between evaporation of fuel from the pool and the heat release from the fire which drives the evaporation.

  10. Method for making hydrogen rich gas from hydrocarbon fuel

    DOE Patents [OSTI]

    Krumpelt, Michael (Naperville, IL); Ahmed, Shabbir (Bolingbrook, IL); Kumar, Romesh (Naperville, IL); Doshi, Rajiv (Downers Grove, IL)

    1999-01-01

    A method of forming a hydrogen rich gas from a source of hydrocarbon fuel in which the hydrocarbon fuel contacts a two-part catalyst comprising a dehydrogenation portion and an oxide-ion conducting portion at a temperature not less than about 400.degree. C. for a time sufficient to generate the hydrogen rich gas while maintaining CO content less than about 5 volume percent. There is also disclosed a method of forming partially oxidized hydrocarbons from ethanes in which ethane gas contacts a two-part catalyst comprising a dehydrogenation portion and an oxide-ion conducting portion for a time and at a temperature sufficient to form an oxide.

  11. Method for making hydrogen rich gas from hydrocarbon fuel

    DOE Patents [OSTI]

    Krumpelt, M.; Ahmed, S.; Kumar, R.; Doshi, R.

    1999-07-27

    A method of forming a hydrogen rich gas from a source of hydrocarbon fuel in which the hydrocarbon fuel contacts a two-part catalyst comprising a dehydrogenation portion and an oxide-ion conducting portion at a temperature not less than about 400 C for a time sufficient to generate the hydrogen rich gas while maintaining CO content less than about 5 volume percent. There is also disclosed a method of forming partially oxidized hydrocarbons from ethanes in which ethane gas contacts a two-part catalyst comprising a dehydrogenation portion and an oxide-ion conducting portion for a time and at a temperature sufficient to form an oxide. 4 figs.

  12. Non-Sticking of Helium Buffer Gas to Hydrocarbons

    E-Print Network [OSTI]

    Croft, James F E

    2014-01-01

    Lifetimes of complexes formed during helium-hydrocarbon collisions at low temperature are estimated for symmetric top hydrocarbons. The lifetimes are obtained using a density-of-states approach. In general the lifetimes are less than 10-100 ns, and are found to decrease with increasing hydrocarbon size. This suggests that clustering will not limit precision spectroscopy in helium buffer gas experiments. Lifetimes are computed for noble-gas benzene collisions and are found to be in reasonable agreement with lifetimes obtained from classical trajectories as reported by Cui {\\it et al}.

  13. Iraq`s significant hydrocarbon potential remains relatively undeveloped

    SciTech Connect (OSTI)

    AL-Gailani, M. [GeoDesign Ltd., Kingston-upon-Thames (United Kingdom)

    1996-07-29

    Iraq is probably one of the least explored countries in the Middle East, despite the fact that it possesses one of the richest hydrocarbon basins in the world almost on a par to Saudi Arabia`s potential, if not more. The aim of this article is to state the facts about Iraq and focus on the huge but untapped and undeveloped hydrocarbon resources to the international oil community. Perhaps it is best to start by describing briefly the sedimentary and tectonic elements responsible for accumulating such large hydrocarbon resources. The paper describes the basin, tectonic elements, structural anomalies, deep drilling, source rocks, reservoir rocks, characteristics, and new reserves.

  14. Energy loss characteristics of heavy ions in nitrogen, carbon dioxide, argon, hydrocarbon gases and tradescantia tissue

    E-Print Network [OSTI]

    Dennis, J A

    1971-01-01

    Energy loss characteristics of heavy ions in nitrogen, carbon dioxide, argon, hydrocarbon gases and tradescantia tissue

  15. Hydrocarbons on Harvester Ant (Pogonomyrmex barbatus) Middens Guide Foragers to the Nest

    E-Print Network [OSTI]

    Gordon, Deborah

    Hydrocarbons on Harvester Ant (Pogonomyrmex barbatus) Middens Guide Foragers to the Nest Shelby J hydrocarbons are used by social insects in nestmate recognition. Here, we showed that hydrocarbons found-specific hydrocarbons, which ants use to distinguish nestmates from non-nestmates, are found on the midden pebbles

  16. Separation of toxic metal ions, hydrophilic hydrocarbons, hydrophobic fuel and halogenated hydrocarbons and recovery of ethanol from a process stream

    DOE Patents [OSTI]

    Kansa, E.J.; Anderson, B.L.; Wijesinghe, A.M.; Viani, B.E.

    1999-05-25

    This invention provides a process to tremendously reduce the bulk volume of contaminants obtained from an effluent stream produced subsurface remediation. The chemicals used for the subsurface remediation are reclaimed for recycling to the remediation process. Additional reductions in contaminant bulk volume are achieved by the ultra-violet light destruction of halogenated hydrocarbons, and the complete oxidation of hydrophobic fuel hydrocarbons and hydrophilic hydrocarbons. The contaminated bulk volume will arise primarily from the disposal of the toxic metal ions. The entire process is modular, so if there are any technological breakthroughs in one or more of the component process modules, such modules can be readily replaced. 3 figs.

  17. Separation of toxic metal ions, hydrophilic hydrocarbons, hydrophobic fuel and halogenated hydrocarbons and recovery of ethanol from a process stream

    DOE Patents [OSTI]

    Kansa, Edward J. (Livermore, CA); Anderson, Brian L. (Lodi, CA); Wijesinghe, Ananda M. (Tracy, CA); Viani, Brian E. (Oakland, CA)

    1999-01-01

    This invention provides a process to tremendously reduce the bulk volume of contaminants obtained from an effluent stream produced subsurface remediation. The chemicals used for the subsurface remediation are reclaimed for recycling to the remediation process. Additional reductions in contaminant bulk volume are achieved by the ultra-violet light destruction of halogenated hydrocarbons, and the complete oxidation of hydrophobic fuel hydrocarbons and hydrophilic hydrocarbons. The contaminated bulk volume will arise primarily from the disposal of the toxic metal ions. The entire process is modular, so if there are any technological breakthroughs in one or more of the component process modules, such modules can be readily replaced.

  18. Low-Temperature Hydrocarbon/CO Oxidation Catalysis in Support...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Annual Merit Review and Peer Evaluation Meeting, May 18-22, 2009 -- Washington D.C. acep03rappe.pdf More Documents & Publications Low-Temperature HydrocarbonCO Oxidation...

  19. Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop

    Broader source: Energy.gov [DOE]

    The Hydrogen, Hydrocarbons, and Bioproduct Precursors from Wastewaters Workshop was held March 18–19, 2015, hosted at the U.S. Department of Energy's (DOE's) National Renewable Energy Laboratory's Washington D.C. offices.

  20. Subcontinuum mass transport of condensed hydrocarbons in nanoporous media

    E-Print Network [OSTI]

    Falk, Kerstin

    Although hydrocarbon production from unconventional reservoirs, the so-called shale gas, has exploded recently, reliable predictions of resource availability and extraction are missing because conventional tools fail to ...

  1. Vertimass licenses ORNL biofuel-to-hydrocarbon conversion technology...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    McCorkle Communications and Media Relations 865.574.7308 Vertimass licenses ORNL biofuel-to-hydrocarbon conversion technology Vertimass LLC, a California-based start-up...

  2. Determination of Total Petroleum Hydrocarbons (TPH) Using Total Carbon Analysis

    SciTech Connect (OSTI)

    Ekechukwu, A.A.

    2002-05-10

    Several methods have been proposed to replace the Freon(TM)-extraction method to determine total petroleum hydrocarbon (TPH) content. For reasons of cost, sensitivity, precision, or simplicity, none of the replacement methods are feasible for analysis of radioactive samples at our facility. We have developed a method to measure total petroleum hydrocarbon content in aqueous sample matrixes using total organic carbon (total carbon) determination. The total carbon content (TC1) of the sample is measured using a total organic carbon analyzer. The sample is then contacted with a small volume of non-pokar solvent to extract the total petroleum hydrocarbons. The total carbon content of the resultant aqueous phase of the extracted sample (TC2) is measured. Total petroleum hydrocarbon content is calculated (TPH = TC1-TC2). The resultant data are consistent with results obtained using Freon(TM) extraction followed by infrared absorbance.

  3. Mathematical modeling of solid oxide fuel cells using hydrocarbon fuels

    E-Print Network [OSTI]

    Lee, Won Yong, Ph. D. Massachusetts Institute of Technology

    2012-01-01

    Solid oxide fuel cells (SOFCs) are high efficiency conversion devices that use hydrogen or light hydrocarbon (HC) fuels in stationary applications to produce quiet and clean power. While successful, HC-fueled SOFCs face ...

  4. Extremely strong tubular stacking of aromatic oligoamide macrocycles

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Kline, Mark A.; Wei, Xiaoxi; Horner, Ian J.; Liu, Rui; Chen, Shuang; Chen, Si; Yung, Ka Yi; Yamato, Kazuhiro; Cai, Zhonghou; Bright, Frank V.; et al

    2015-01-01

    As the third-generation rigid macrocycles evolved from progenitor 1, cyclic aromatic oligoamides 3, with a backbone of reduced constraint, exhibit extremely strong stacking with an astoundingly high affinity (estimated lower limit of Kdimer > 1013 M-1 in CHCl3), which leads to dispersed tubular stacks that undergo further assembly in solution. Computational study reveals a very large binding energy (-49.77 kcal mol-1) and indicates highly cooperative local dipole interactions that account for the observed strength and directionality for the stacking of 3. In the solid-state, X-ray diffraction (XRD) confirms that the aggregation of 3 results in well-aligned tubular stacks. The persistentmore »tubular assemblies of 3, with their non-deformable sub-nm pore, are expected to possess many interesting functions. One such function, transmembrane ion transport, is observed for 3.« less

  5. Extremely strong tubular stacking of aromatic oligoamide macrocycles

    SciTech Connect (OSTI)

    Kline, Mark A.; Wei, Xiaoxi; Horner, Ian J.; Liu, Rui; Chen, Shuang; Chen, Si; Yung, Ka Yi; Yamato, Kazuhiro; Cai, Zhonghou; Bright, Frank V.; Zeng, Xiao Cheng; Gong, Bing

    2015-01-01

    As the third-generation rigid macrocycles evolved from progenitor 1, cyclic aromatic oligoamides 3, with a backbone of reduced constraint, exhibit extremely strong stacking with an astoundingly high affinity (estimated lower limit of Kdimer > 1013 M-1 in CHCl3), which leads to dispersed tubular stacks that undergo further assembly in solution. Computational study reveals a very large binding energy (-49.77 kcal mol-1) and indicates highly cooperative local dipole interactions that account for the observed strength and directionality for the stacking of 3. In the solid-state, X-ray diffraction (XRD) confirms that the aggregation of 3 results in well-aligned tubular stacks. The persistent tubular assemblies of 3, with their non-deformable sub-nm pore, are expected to possess many interesting functions. One such function, transmembrane ion transport, is observed for 3.

  6. Hydrocarbon-enhanced particulate filter regeneration via microwave ignition

    DOE Patents [OSTI]

    Gonze, Eugene V. (Pinckney, MI); Brown, David B. (Brighton, MI)

    2010-02-02

    A regeneration method for a particulate filter includes estimating a quantity of particulate matter trapped within the particulate filter, comparing the quantity of particulate matter to a predetermined quantity, heating at least a portion of the particulate filter to a combustion temperature of the particulate matter, and introducing hydrocarbon fuel to the particulate filter. The hydrocarbon fuel facilitates combustion of the particulate matter to regenerate the particulate filter.

  7. Petroleum hydrocarbon-degrading bacteria in the Galveston Bay system 

    E-Print Network [OSTI]

    Schropp, Steven James

    1979-01-01

    activities and shipping may all release petroleum hydrocarbons into the marine environment (83), which are potentially detrimental to the estuarine system. Estuaries have been found to be one of the most active types of water in terms of microbial... bacteria to oil inpiit might be used as an indicator or petroleuin pollution (6, 43, 44). To evaluate the effects of ) vllutant hydrocarbons ozi the bacterial populations of estuarine systems, information on the distribution and abundance...

  8. Integrated hydrocarbon reforming system and controls

    DOE Patents [OSTI]

    Clawson, Lawrence G.; Dorson, Matthew H.; Mitchell, William L.; Nowicki, Brian J.; Thijssen, Johannes; Davis, Robert; Papile, Christopher; Rumsey, Jennifer W.; Longo, Nathan; Cross, III, James C.; Rizzo, Vincent; Kleeburg, Gunther; Rindone, Michael; Block, Stephen G.; Sun, Maria; Morriseau, Brian D.; Hagan, Mark R.; Bowers, Brian

    2003-11-04

    A hydrocarbon reformer system including a first reactor configured to generate hydrogen-rich reformate by carrying out at least one of a non-catalytic thermal partial oxidation, a catalytic partial oxidation, a steam reforming, and any combinations thereof, a second reactor in fluid communication with the first reactor to receive the hydrogen-rich reformate, and having a catalyst for promoting a water gas shift reaction in the hydrogen-rich reformate, and a heat exchanger having a first mass of two-phase water therein and configured to exchange heat between the two-phase water and the hydrogen-rich reformate in the second reactor, the heat exchanger being in fluid communication with the first reactor so as to supply steam to the first reactor as a reactant is disclosed. The disclosed reformer includes an auxiliary reactor configured to generate heated water/steam and being in fluid communication with the heat exchanger of the second reactor to supply the heated water/steam to the heat exchanger.

  9. ORGANIC GEOCHEMICAL STUDIES. II. THE DISTRIBUTION OF ALIPHATIC HYDROCARBONS IN ALGAE, BACTERIA, AND IN A RECENT LAKE SEDIMENT: A PRELIMINARY REPORT

    E-Print Network [OSTI]

    Han, Jerry; McCarthy, E.D.; Van Hoeven Jr., William; Calvin, Melvin; Bradley, W. H.

    2008-01-01

    significantly to the hydrocarbons of higher molecular weightDISTRIBUTION OF ALIPHATIC HYDROCARBONS IN ALGAE, BACTERIA,T E DISTRIBUTION O ALIPHATIC HYDROCARBONS H F A PRELIMINARY

  10. Hydrocarbon Seeps of the Mesozoic Great Valley Group Forearc Strata and Franciscan Complex, Northern and Central California, U.S.A.

    E-Print Network [OSTI]

    Keenan, Kristin Euphrat

    2010-01-01

    and Cretaceous Gastropods from Hydrocarbon Seeps in ForearcPeregrinella-Dominated Hydrocarbon-Seep Deposit on the1999. Signatures of Hydrocarbon Venting in a Middle Devonian

  11. Molecular and isotopic partitioning of low-molecular-weight hydrocarbons during migration and gas hydrate precipitation in deposits of a high-flux seepage site

    E-Print Network [OSTI]

    2010-01-01

    Bohrmann, G. , 2007. In situ hydrocarbon concentrations fromM. , Bohrmann, G. , 2003. Hydrocarbon gases in deposits fromMethane and other hydrocarbon gases in marine sediment.

  12. Photoinduced Hydrogen Abstraction from Phenols by Aromatic Ketones. A New Mechanism for Hydrogen Abstraction by

    E-Print Network [OSTI]

    Leigh, William J.

    Photoinduced Hydrogen Abstraction from Phenols by Aromatic Ketones. A New Mechanism for Hydrogen carried out of the kinetics of inter- and intramolecular phenolic hydrogen abstraction phenolic hydrogen, which yields the corresponding phenoxyl-hemipinacol biradical. The biradicals have also

  13. The Surface Organometallic Chemistry of Pd Electrodes: Studies with Aromatic Compounds 

    E-Print Network [OSTI]

    Cruz, Juan

    2012-10-19

    adsorbed-molecule orientations; in a few cases, verification was obtained via surface vibrational (high-resolution electron-energy loss) spectroscopy. Eleven aromatic compounds were studied: [hydroquinone (1), benzoquinone (2), methylhydroquinone (3), 2...

  14. Chemisorption of Aromatic Compounds on Well-Defined Palladium Surfaces: Studies by Electron Spectroscopy and Electrochemistry 

    E-Print Network [OSTI]

    Li, Ding

    2010-10-12

    The chemisorption of aromatic compounds, derivatized with different functional groups, on well-defined Pd(111) surfaces was studied by a combination of Auger electron spectroscopy (AES), low energy electron diffraction (LEED), high resolution...

  15. NEAR-AND MID-INFRARED LABORATORY SPECTRA OF PAH CATIONS IN SOLID H2O M. P. Bernstein, S. A. Sandford, A. L. Mattioda, and L. J. Allamandola

    E-Print Network [OSTI]

    O at 15 K to low doses of UV radiation, we have observed both the vibrational absorptions of PAH. Sandford, A. L. Mattioda, and L. J. Allamandola NASA-Ames Research Center, Mail Stop 245-6, Moffett Field protostars. In such cold space environments PAHs should condense into H2O-rich ice mantles at low temperature

  16. Methane-derived hydrocarbons produced under upper-mantle conditions

    SciTech Connect (OSTI)

    Kolesnikov, Anton; Kutcherov, Vladimir G.; Goncharov, Alexander F.

    2009-08-13

    There is widespread evidence that petroleum originates from biological processes. Whether hydrocarbons can also be produced from abiogenic precursor molecules under the high-pressure, high-temperature conditions characteristic of the upper mantle remains an open question. It has been proposed that hydrocarbons generated in the upper mantle could be transported through deep faults to shallower regions in the Earth's crust, and contribute to petroleum reserves. Here we use in situ Raman spectroscopy in laser-heated diamond anvil cells to monitor the chemical reactivity of methane and ethane under upper-mantle conditions. We show that when methane is exposed to pressures higher than 2 GPa, and to temperatures in the range of 1,000-1,500 K, it partially reacts to form saturated hydrocarbons containing 2-4 carbons (ethane, propane and butane) and molecular hydrogen and graphite. Conversely, exposure of ethane to similar conditions results in the production of methane, suggesting that the synthesis of saturated hydrocarbons is reversible. Our results support the suggestion that hydrocarbons heavier than methane can be produced by abiogenic processes in the upper mantle.

  17. Thermal hydrocracking of heavy hydrocarbon oils with heavy oil recycle

    SciTech Connect (OSTI)

    Denis, J.D.; Khulbe, C.P.; Pruden, B.B.

    1981-02-24

    An improved process is described for the hydrocracking of heavy hydrocarbon oils, such as oils extracted from tar sands. The heavy hydrocarbon oil feedstock in the presence of an excess of hydrogen is passed through a confined hydrocracking zone under upflow liquid conditions, and the effluent emerging from the top of the hydrocracking zone is passed into a hot separator where it is separated into a gaseous stream containing hydrogen and vaporous hydrocarbons and a liquid stream containing heavy hydrocarbons. The hot separator is maintained near the temperature of the hydrocracking zone and the effluent from the hydrocracking zone enters the separator in a lower region below the liquid level in the separator. The gaseous stream containing hydrogen and vaporous hydrocarbons is withdrawn from the top of the separator while a portion of the liquid phase in the separator is recycled to the hydrocracking zone without further treatment and in quantities sufficient to increase the superficial liquid flow velocity in the hydrocracking zone such that deposition of coke in the hydrocracking zone is substantially eliminated.

  18. Selective aromatization of C[sub 3]- and C[sub 4]-paraffins over modified encilite catalysts: 2. Kinetics of n-butane aromatization

    SciTech Connect (OSTI)

    Jana, A.K.; Rao, M.S. . Dept. of Chemical Engineering)

    1993-11-01

    The kinetics of the aromatization of n-butane over Zn-encilite catalyst was studied in a fixed bed reactor under steady-state conditions at atmospheric pressure and in the temperature range of 480--540 C. The experimental data were analyzed, and a dual-site mechanism was proposed. Six rate equations of the Langmuir-Hinshelwood type were tested. The unknown parameters in the rate equations were estimated by a nonlinear regression method. A kinetic equation for n-butane aromatization is proposed.

  19. Coulomb pairing resonances in multiple-ring aromatic molecules

    E-Print Network [OSTI]

    Huber, D L

    2015-01-01

    We present an analysis of the Coulomb pairing resonances observed in photo-double-ionization studies of CnHm aromatic molecules with multiple benzene-like rings. It is applied to naphthalene, anthracene, phenanthrene, pyrene and coronene, all of which have six-member rings, and azulene which is comprised of a five-member and a seven-member ring. There is a high energy resonance at ~ 40 eV that is found in all of the molecules cited and is associated with paired electrons localized on carbon sites on the perimeter of the molecule, each of which having two carbon sites as nearest neighbors. The low energy resonance at 10 eV, which is found only in pyrene and coronene, is attributed to the formation of paired electrons localized on arrays of interior carbon atoms that have the point symmetry of the molecule with each carbon atom having three nearest neighbors. The origin of the anomalous increase in the doubly charged to singly charged parent-ion ratio that is found above the 40 eV resonance in all of the cited ...

  20. Environmental diagnostic analysis of ground water bacteria and their involvement in utilization of aromatic compounds

    SciTech Connect (OSTI)

    Wear, J.E. Jr.

    1993-05-01

    The objective of this study was to examine the hypothesis that select functional groups of bacteria from pristine sites have an innate ability to degrade synthetic aromatics that often contaminate groundwater environments,due to exposure to naturally occurring recalcitrant aromatics in their environment. This study demonstrates that subsurface microbial communities are capable of utilizing lignin and humic acid breakdown products. Utilizers of these compounds were found to be present in most all the wells tested. Even the deepest aquifer tested had utilizers present for all six of the aromatics tested. Highest counts for the aromatics tested were observed with the naturally occurring breakdown products of either lignin or humic acid. Carboxylic acids were found to be an important sole carbon source for groundwater bacteria possibly explained by the fact that they are produced by the oxidative cleavage of aromatic ring structures. The carbohydrate sole carbon sources that demonstrated the greatest densities were ones commonly associated with humics. This study indicates that utilization of naturally occurring aromatic compounds in the subsurface is an important nutritional source for groundwater bacteria. In addition, it suggests that adaptation to naturally occurring recalcitrant substrates is the origin of degradative pathways for xenobiotic compounds with analogous structure. This work has important implications for in situ bioremediation as a method of environmental cleanup.