Simulation of the Focusing DIRC Optics with Mathematica (open access)

Simulation of the Focusing DIRC Optics with Mathematica

The Focusing DIRC is considered for the Barrel PID at a possible Super-B factory. To reduce sensitivity to background, it would be desirable to reduce a size of the present BaBar photon detector. One way to do it is to replace it with a focusing optics and use smaller photon detector pixels. We have simulated the focusing optics with simulation software based on a 3D calculation performed with the Mathematica program. The software does not use Optica package, instead, it uses its own 3D algorithm. The advantage of the presented method is that it is transparent, fast and that it uses a full backing of the Mathematica graphics, and it does not require expertise to run Geat4 MC software.
Date: February 15, 2010
Creator: Va'vra, J.
Object Type: Article
System: The UNT Digital Library
Measurements of Core and Compressed Shell Temperature and Density Conditions in Thick-Wall Target Implosions at OMEGA (open access)

Measurements of Core and Compressed Shell Temperature and Density Conditions in Thick-Wall Target Implosions at OMEGA

None
Date: September 15, 2010
Creator: Florido, R.; Mancini, R. C.; Nagayama, T.; Tommasini, R.; Delettrez, J. A.; Regan, S. P. et al.
Object Type: Article
System: The UNT Digital Library
A truncated Levenberg-Marquardt algorithm for the calibration of highly parameterized nonlinear models (open access)

A truncated Levenberg-Marquardt algorithm for the calibration of highly parameterized nonlinear models

We propose a modification to the Levenberg-Marquardt minimization algorithm for a more robust and more efficient calibration of highly parameterized, strongly nonlinear models of multiphase flow through porous media. The new method combines the advantages of truncated singular value decomposition with those of the classical Levenberg-Marquardt algorithm, thus enabling a more robust solution of underdetermined inverse problems with complex relations between the parameters to be estimated and the observable state variables used for calibration. The truncation limit separating the solution space from the calibration null space is re-evaluated during the iterative calibration process. In between these re-evaluations, fewer forward simulations are required, compared to the standard approach, to calculate the approximate sensitivity matrix. Truncated singular values are used to calculate the Levenberg-Marquardt parameter updates, ensuring that safe small steps along the steepest-descent direction are taken for highly correlated parameters of low sensitivity, whereas efficient quasi-Gauss-Newton steps are taken for independent parameters with high impact. The performance of the proposed scheme is demonstrated for a synthetic data set representing infiltration into a partially saturated, heterogeneous soil, where hydrogeological, petrophysical, and geostatistical parameters are estimated based on the joint inversion of hydrological and geophysical data.
Date: October 15, 2010
Creator: Finsterle, S. & Kowalsky, M.B.
Object Type: Article
System: The UNT Digital Library
Corrective Action Decision Document/Closure Report for Corrective Action Unit 383: Area E-Tunnel Sites, Nevada Test Site (open access)

Corrective Action Decision Document/Closure Report for Corrective Action Unit 383: Area E-Tunnel Sites, Nevada Test Site

This Corrective Action Decision Document/Closure Report (CADD/CR) was prepared by the Defense Threat Reduction Agency (DTRA) for Corrective Action Unit (CAU) 383, Area 12 E-Tunnel Sites, which is the joint responsibility of DTRA and the U.S. Department of Energy (DOE), National Nuclear Security Administration Nevada Site Office (NNSA/NSO). This CADD/CR is consistent with the requirements of the Federal Facility Agreement and Consent Order (FFACO) agreed to by the State of Nevada, the DOE, and the U.S. Department of Defense. Corrective Action Unit 383 is comprised of three Corrective Action Sites (CASs) and two adjacent areas: • CAS 12-06-06, Muckpile • CAS 12-25-02, Oil Spill • CAS 12-28-02, Radioactive Material • Drainage below the Muckpile • Ponds 1, 2, and 3 The purpose of this CADD/CR is to provide justification and documentation to support the recommendation for closure with no further corrective action, by placing use restrictions at the three CASs and two adjacent areas of CAU 383.
Date: March 15, 2010
Creator: National Security Technologies, LLC
Object Type: Report
System: The UNT Digital Library
Adult Human Pancreatic Islet Beta-Cells Display Limited Turnover and Long Lifespan as Determined by In-Vivo Thymidine Analog Incorporation and Radiocarbon Dating (open access)

Adult Human Pancreatic Islet Beta-Cells Display Limited Turnover and Long Lifespan as Determined by In-Vivo Thymidine Analog Incorporation and Radiocarbon Dating

Diabetes mellitus results from an absolute or relative deficiency of insulin producing pancreatic beta-cells. The adult human beta-cell's turnover rate remains unknown. We employed novel techniques to examine adult human islet beta-cell turnover and longevity in vivo. Subjects enrolled in NIH clinical trials received thymidine analogues [iododeoxyuridine (IdU) or bromodeoxyuridine (BrdU)] 8-days to 4-years prior to death. Archival autopsy samples from ten patients (aged 17-74 years) were employed to assess beta-cell turnover by scoring nuclear analog labeling within insulin staining cells. Human adult beta-cell longevity was determined by estimating the cells genomic DNA integration of atmospheric carbon-14 ({sup 14}C). DNA was purified from pancreatic islets isolated from cadaveric donors; whole islet prep DNA was obtained from a 15 year old donor, and purified beta-cell DNA was obtained from two donors (age 48 and 80 years). {sup 14}C levels were then determined using accelerator mass spectrometry (AMS). Cellular 'birth date' was determined by comparing the subject's DNA {sup 14}C content relative to a well-established {sup 14}C atmospheric prevalence curve. In the two subjects less than age 20 years, 1-2% of the beta-cell nuclei co-stained for BrdU/IdU. No beta-cell nuclei co-stained in the eight patients more than 30 years old. Consistent with …
Date: March 15, 2010
Creator: Perl, S.; Kushner, J. A.; Buchholz, B. A.; Meeker, A. K.; Stein, G. M.; Hsieh, M. et al.
Object Type: Article
System: The UNT Digital Library
Evaluation of Glass Density to Support the Estimation of Fissile Mass Loadings from Iron Concentrations in SB6 Glasses (open access)

Evaluation of Glass Density to Support the Estimation of Fissile Mass Loadings from Iron Concentrations in SB6 Glasses

The Department of Energy - Savannah River (DOE-SR) previously provided direction to Savannah River Remediation (SRR) to maintain fissile concentration in glass below 897 g/m{sup 3}. In support of the guidance, the Savannah River National Laboratory (SRNL) provided a technical basis and a supporting Microsoft{reg_sign} Excel{reg_sign} spreadsheet for the evaluation of fissile loading in Sludge Batch 5 glass based on the Fe concentration in glass as determined by the measurements from the Slurry Mix Evaporator (SME) acceptability analysis. SRR has since requested that SRNL provide the necessary information to allow SRR to update the Excel spreadsheet so that it may be used to maintain fissile concentration in glass below 897 g/m{sup 3} during the processing of Sludge Batch 6 (SB6). One of the primary inputs into the fissile loading spreadsheet includes a bounding density for SB6-based glasses. Based on the measured density data of select SB6 variability study glasses, SRNL recommends that SRR utilize the 99/99 Upper Tolerance Limit (UTL) density value at 38% WL (2.823 g/cm{sup 3}) as a bounding density for SB6 glasses to assess the fissile concentration in this glass system. That is, the 2.823 g/cm{sup 3} is recommended as a key (and fixed) input into the …
Date: December 15, 2010
Creator: Edwards, T. & Peeler, D.
Object Type: Report
System: The UNT Digital Library
The Role of Quench-back in the Passive Quench Protection of Uncoupled Solenoids in Series with and without Coil Sub-division (open access)

The Role of Quench-back in the Passive Quench Protection of Uncoupled Solenoids in Series with and without Coil Sub-division

This paper is the final paper in a series of papers that discusses passive quench protection for high inductance solenoid magnets. This report describes how passive quench protection system may be applied to superconducting magnets that are connected in series but not inductively coupled. Previous papers have discussed the role of magnet sub-division and quench back from a conductive mandrel in reducing the hot-spot temperature and the peak coil voltages to ground. When magnets are connected in series, quench-back from a conductive mandrel can cause other magnets in a string to quench even without inductive coupling between magnets. The magnet mandrels must be well coupled to the magnet circuit that is being quenched. When magnet circuit sub-division is employed to reduce the voltages-to-ground within magnets, the resistance across the subdivision becomes the most important factor in the successful quenching of the magnet string.
Date: October 15, 2010
Creator: Guo, Xing Long; Green, Michael A; Wang, Li; Wu, Hong & Pan, Heng
Object Type: Article
System: The UNT Digital Library
Modeling of fate and transport of co-injection of H2S with CO2 in deep saline formations (open access)

Modeling of fate and transport of co-injection of H2S with CO2 in deep saline formations

The geological storage of CO{sub 2} in deep saline formations is increasing seen as a viable strategy to reduce the release of greenhouse gases into the atmosphere. However, costs of capture and compression of CO{sub 2} from industrial waste streams containing small quantities of sulfur and nitrogen compounds such as SO{sub 2}, H{sub 2}S and N{sub 2} are very expensive. Therefore, studies on the co-injection of CO{sub 2} containing other acid gases from industrial emissions are very important. In this paper, numerical simulations were performed to study the co-injection of H{sub 2}S with CO{sub 2} in sandstone and carbonate formations. Results indicate that the preferential dissolution of H{sub 2}S gas (compared with CO{sub 2} gas) into formation water results in the delayed breakthrough of H{sub 2}S gas. Co-injection of H{sub 2}S results in the precipitation of pyrite through interactions between the dissolved H{sub 2}S and Fe{sup 2+} from the dissolution of Fe-bearing minerals. Additional injection of H{sub 2}S reduces the capabilities for solubility and mineral trappings of CO{sub 2} compared to the CO{sub 2} only case. In comparison to the sandstone (siliciclastic) formation, the carbonate formation is less favorable to the mineral sequestration of CO{sub 2}. Different from CO{sub 2} …
Date: December 15, 2010
Creator: Zhang, W.; Xu, T. & Li, Y.
Object Type: Article
System: The UNT Digital Library
Transport and deposition of functionalized CdTe nanoparticles in saturated porous media (open access)

Transport and deposition of functionalized CdTe nanoparticles in saturated porous media

Comprehensive understanding of the transport and deposition of engineered nanoparticles (NPs) in subsurface is required to assess their potential negative impact on the environment. We studied the deposition behavior of functionalized quantum dot (QD) NPs (CdTe) in different types of sands (Accusand, ultrapure quartz, and iron-coated sand) at various solution ionic strengths (IS). The observed transport behavior in ultrapure quartz and iron-coated sand was consistent with conventional colloid deposition theories. However, our results from the Accusand column showed that deposition was minimal at the lowest IS (1 mM) and increased significantly as the IS increased. The effluent breakthrough occurred with a delay, followed by a rapid rise to the maximum normalized concentration of unity. Negligible deposition in the column packed with ultrapure quartz sand (100 mM) and Accusand (1 mM) rules out the effect of straining and suggests the importance of surface charge heterogeneity in QD deposition in Accusand at higher IS. Data analyses further show that only a small fraction of sand surface area contributed in QD deposition even at the highest IS (100 mM) tested. The observed delay in breakthrough curves of QDs was attributed to the fast diffusive mass transfer rate of QDs from bulk solution to …
Date: October 15, 2010
Creator: Torkzaban, S.; Wan, J.; Kim, Y.; Mulvihill, M. & Tokunaga, T. K.
Object Type: Article
System: The UNT Digital Library
SLAC Cosmic Ray Telescope Facility (open access)

SLAC Cosmic Ray Telescope Facility

SLAC does not have a test beam for the HEP detector development at present. We have therefore created a cosmic ray telescope (CRT) facility, which is presently being used to test the FDIRC prototype. We have used it in the past to debug this prototype with the original SLAC electronics before going to the ESA test beam. Presently, it is used to test a new waveform digitizing electronics developed by the University of Hawaii, and we are also planning to incorporate the new Orsay TDC/ADC electronics. As a next step, we plan to put in a full size DIRC bar box with a new focusing optics, and test it together with a final SuberB electronics. The CRT is located in building 121 at SLAC. We anticipate more users to join in the future. This purpose of this note is to provide an introductory manual for newcomers.
Date: February 15, 2010
Creator: Va'vra, J.
Object Type: Report
System: The UNT Digital Library
Analysis of biostimulated microbial communities from two field experiments reveals temporal and spatial differences in proteome profiles (open access)

Analysis of biostimulated microbial communities from two field experiments reveals temporal and spatial differences in proteome profiles

Stimulated by an acetate-amendment field experiment conducted in 2007, anaerobic microbial populations in the aquifer at the Rifle Integrated Field Research Challenge site in Colorado reduced mobile U(VI) to insoluble U(IV). During this experiment, planktonic biomass was sampled at various time points to quantitatively evaluate proteomes. In 2008, an acetate-amended field experiment was again conducted in a similar manner to the 2007 experiment. As there was no comprehensive metagenome sequence available for use in proteomics analysis, we systematically evaluated 12 different organism genome sequences to generate sets of aggregate genomes, or “pseudo-metagenomes”, for supplying relative quantitative peptide and protein identifications. Proteomics results support previous observations of the dominance of Geobacteraceae during biostimulation using acetate as sole electron donor, and revealed a shift from an early stage of iron reduction to a late stage of iron reduction. Additionally, a shift from iron reduction to sulfate reduction was indicated by changes in the contribution of proteome information contributed by different organism genome sequences within the aggregate set. In addition, the comparison of proteome measurements made between the 2007 field experiment and 2008 field experiment revealed differences in proteome profiles. These differences may be the result of alterations in abundance and population structure …
Date: July 15, 2010
Creator: Callister, S. J.; Wilkins, M. J.; Nicora, C. D.; Williams, K. H.; Banfield, J. F.; VerBerkmoes, N. C. et al.
Object Type: Article
System: The UNT Digital Library
Dynamics of microbial community composition and function during in-situ bioremediation of a uranium-contaminated aquifer (open access)

Dynamics of microbial community composition and function during in-situ bioremediation of a uranium-contaminated aquifer

A pilot-scale system was established to examine the feasibility of in situ U(VI) immobilization at a highly contaminated aquifer (U.S. DOE Integrated Field Research Challenge site, Oak Ridge, TN). Ethanol was injected intermittently as an electron donor to stimulate microbial U(VI) reduction, and U(VI) concentrations fell to below the Environmental Protection Agency drinking water standard (0.03 mg liter{sup -1}). Microbial communities from three monitoring wells were examined during active U(VI) reduction and maintenance phases with GeoChip, a high-density, comprehensive functional gene array. The overall microbial community structure exhibited a considerable shift over the remediation phases examined. GeoChip-based analysis revealed that Fe(III)-reducing bacterial (FeRB), nitrate-reducing bacterial (NRB), and sulfate-reducing bacterial (SRB) functional populations reached their highest levels during the active U(VI) reduction phase (days 137 to 370), in which denitrification and Fe(III) and sulfate reduction occurred sequentially. A gradual decrease in these functional populations occurred when reduction reactions stabilized, suggesting that these functional populations could play an important role in both active U(VI) reduction and maintenance of the stability of reduced U(IV). These results suggest that addition of electron donors stimulated the microbial community to create biogeochemical conditions favorable to U(VI) reduction and prevent the reduced U(IV) from reoxidation and that …
Date: August 15, 2010
Creator: Van Nostrand, J. D.; Wu, L.; Wu, W. M.; Huang, A.; Gentry, T. J.; Deng, Y. et al.
Object Type: Article
System: The UNT Digital Library
Preliminary Screening Analysis for the Environmental Risk Evaluation System: Task 2.1.1: Evaluating Effects of Stressors – Fiscal Year 2010 Progress Report: Environmental Effects of Marine and Hydrokinetic Energy (open access)

Preliminary Screening Analysis for the Environmental Risk Evaluation System: Task 2.1.1: Evaluating Effects of Stressors – Fiscal Year 2010 Progress Report: Environmental Effects of Marine and Hydrokinetic Energy

Possible environmental effects of marine and hydrokinetic (MHK) energy development are not well understood, and yet regulatory agencies are required to make decisions in spite of substantial uncertainty about environmental impacts and their long-term effects. An understanding of risk associated with likely interactions between MHK installations and aquatic receptors, including animals, habitats, and ecosystems, can help reduce the level of uncertainty and focus regulatory actions and scientific studies on interactions of most concern. As a first step in developing the Pacific Northwest National Laboratory (PNNL) Environmental Risk Evaluation System (ERES), PNNL scientists conducted a preliminary risk screening analysis on three initial MHK cases - a tidal project in Puget Sound using Open Hydro turbines, a wave project off the coast of Oregon using Ocean Power Technologies point attenuator buoys, and a riverine current project in the Mississippi River using Free Flow turbines. Through an iterative process, the screening analysis revealed that top-tier stressors in all three cases were the effects of the dynamic physical presence of the device (e.g., strike), accidents, and effects of the static physical presence of the device (e.g., habitat alteration). Receptor interactions with these stressors at the four highest tiers of risk were dominated by marine …
Date: November 15, 2010
Creator: Anderson, Richard M.; Copping, Andrea E. & Van Cleve, Frances B.
Object Type: Report
System: The UNT Digital Library
Reducing the losses of optical metamaterials (open access)

Reducing the losses of optical metamaterials

The field of metamaterials is driven by fascinating and far-reaching theoretical visions, such as perfect lenses, invisibility cloaking, and enhanced optical nonlinearities. However, losses have become the major obstacle towards real world applications in the optical regime. Reducing the losses of optical metamaterials becomes necessary and extremely important. In this thesis, two approaches are taken to reduce the losses. One is to construct an indefinite medium. Indefinite media are materials where not all the principal components of the permittivity and permeability tensors have the same sign. They do not need the resonances to achieve negative permittivity, {var_epsilon}. So, the losses can be comparatively small. To obtain indefinite media, three-dimensional (3D) optical metallic nanowire media with different structures are designed. They are numerically demonstrated that they are homogeneous effective indefinite anisotropic media by showing that their dispersion relations are hyperbolic. Negative group refraction and pseudo focusing are observed. Another approach is to incorporate gain into metamaterial nanostructures. The nonlinearity of gain is included by a generic four-level atomic model. A computational scheme is presented, which allows for a self-consistent treatment of a dispersive metallic photonic metamaterial coupled to a gain material incorporated into the nanostructure using the finite-difference time-domain (FDTD) method. …
Date: December 15, 2010
Creator: Fang, Anan
Object Type: Thesis or Dissertation
System: The UNT Digital Library
Seedless Polyol Synthesis and CO Oxidation Activity of Monodisperse (111) and (100)-Oriented Rhodium Nanocrystals in Sub-10 nm Sizes (open access)

Seedless Polyol Synthesis and CO Oxidation Activity of Monodisperse (111) and (100)-Oriented Rhodium Nanocrystals in Sub-10 nm Sizes

Monodisperse sub-10 nm (6.5 nm) sized Rh nanocrystals with (111) and (100) surface structures were synthesized by a seedless polyol reduction in ethylene glycol, with poly(vinylpyrrolidone) as a capping ligand. When using [Rh(Ac){sub 2}]{sub 2} as the metal precursor, (111)-oriented Rh nanopolyhedra containing 76% (111)-twined hexagons (in 2D projection) were obtained; whereas, when employing RhCl{sub 3} as the metal precursor in the presence of alkylammonium bromide, such as tetramethylammonium bromide and trimethyl(tetradecyl)ammonium bromide, (100)-oriented Rh nanocubes were obtained with 85% selectivity. The {l_brace}100{r_brace} faces of the Rh nanocrystals are stabilized by chemically adsorbed Br{sup -} ions from alkylammonium bromides, which led to (100)-oriented nanocubes. Monolayer films of the (111)-oriented Rh nanopolyhedra and (100)-oriented Rh nanocubes were deposited on silicon wafers in a Langmuir-Blodgett trough to make model 2D nanoarray catalysts. These nanocatalysts were active for CO oxidation by O{sub 2}, and the turnover frequency was independent of nanoparticle shape, consistent with that previously observed for Rh(111) and Rh(100) single crystals.
Date: March 15, 2010
Creator: Zhang, Yawen; Grass, Michael E.; Huang, Wenyu & Somorjai, Gabor A.
Object Type: Article
System: The UNT Digital Library
Developing new optical imaging techniques for single particle and molecule tracking in live cells (open access)

Developing new optical imaging techniques for single particle and molecule tracking in live cells

Differential interference contrast (DIC) microscopy is a far-field as well as wide-field optical imaging technique. Since it is non-invasive and requires no sample staining, DIC microscopy is suitable for tracking the motion of target molecules in live cells without interfering their functions. In addition, high numerical aperture objectives and condensers can be used in DIC microscopy. The depth of focus of DIC is shallow, which gives DIC much better optical sectioning ability than those of phase contrast and dark field microscopies. In this work, DIC was utilized to study dynamic biological processes including endocytosis and intracellular transport in live cells. The suitability of DIC microscopy for single particle tracking in live cells was first demonstrated by using DIC to monitor the entire endocytosis process of one mesoporous silica nanoparticle (MSN) into a live mammalian cell. By taking advantage of the optical sectioning ability of DIC, we recorded the depth profile of the MSN during the endocytosis process. The shape change around the nanoparticle due to the formation of a vesicle was also captured. DIC microscopy was further modified that the sample can be illuminated and imaged at two wavelengths simultaneously. By using the new technique, noble metal nanoparticles with different …
Date: December 15, 2010
Creator: Sun, Wei
Object Type: Thesis or Dissertation
System: The UNT Digital Library
2009 Pantex Plant Annual Illness and Injury Surveillance (open access)

2009 Pantex Plant Annual Illness and Injury Surveillance

The U.S. Department of Energy’s (DOE) commitment to assuring the health and safety of its workers includes the conduct of epidemiologic surveillance activities that provide an early warning system for health problems among workers. The Illness and Injury Surveillance Program monitors illnesses and health conditions that result in an absence of workdays, occupational injuries and illnesses, and disabilities and deaths among current workers.
Date: December 15, 2010
Creator: United States. Department of Energy. Office of Illness and Injury Prevention Programs.
Object Type: Report
System: The UNT Digital Library
Pore-fluid effects on seismic waves in vertically fractured earth with orthotropic symmetry (open access)

Pore-fluid effects on seismic waves in vertically fractured earth with orthotropic symmetry

For elastically noninteracting vertical-fracture sets at arbitrary orientation angles to each other, a detailed model is presented in which the resulting anisotropic fractured medium generally has orthorhombic symmetry overall. Some of the analysis methods and ideas of Schoenberg are emphasized, together with their connections to other similarly motivated and conceptually related methods by Sayers and Kachanov, among others. Examples show how parallel vertical-fracture sets having HTI (horizontal transversely isotropic) symmetry transform into orthotropic fractured media if some subsets of the vertical fractures are misaligned with the others, and then the fractured system can have VTI (vertical transversely isotropic) symmetry if all of the fractures are aligned randomly or half parallel and half perpendicular to a given vertical plane. An orthotropic example having vertical fractures in an otherwise VTI earth system (studied previously by Schoenberg and Helbig) is compared with the other examples treated and it is finally shown how fluids in the fractures affect the orthotropic poroelastic system response to seismic waves. The key result is that fracture-influence parameters are multiplied by a factor of (1-B), where 0 {le} B < 1 is Skempton's second coefficient for poroelastic media. Skempton's B coefficient is itself a measurable characteristic of fluid-saturated porous …
Date: May 15, 2010
Creator: Berryman, J.G.
Object Type: Article
System: The UNT Digital Library
Laser-Mechanical Drilling for Geothermal Energy: Low-Contact Drilling Technology to Enable Economical EGS Wells (open access)

Laser-Mechanical Drilling for Geothermal Energy: Low-Contact Drilling Technology to Enable Economical EGS Wells

Broad Funding Opportunity Announcement Project: Foro Energy is developing a unique capability and hardware system to transmit high power lasers over long distances via fiber optic cables. This laser power is integrated with a mechanical drilling bit to enable rapid and sustained penetration of hard rock formations too costly to drill with mechanical drilling bits alone. The laser energy that is directed at the rock basically softens the rock, allowing the mechanical bit to more easily remove it. Foro Energy’s laser-assisted drill bits have the potential to be up to 10 times more economical than conventional hard-rock drilling technologies, making them an effective way to access the U.S. energy resources currently locked under hard rock formations.
Date: January 15, 2010
Creator: unknown
Object Type: Text
System: The UNT Digital Library
Chemical Kinetic Models for HCCI and Diesel Combustion (open access)

Chemical Kinetic Models for HCCI and Diesel Combustion

Predictive engine simulation models are needed to make rapid progress towards DOE's goals of increasing combustion engine efficiency and reducing pollutant emissions. These engine simulation models require chemical kinetic submodels to allow the prediction of the effect of fuel composition on engine performance and emissions. Chemical kinetic models for conventional and next-generation transportation fuels need to be developed so that engine simulation tools can predict fuel effects. The objectives are to: (1) Develop detailed chemical kinetic models for fuel components used in surrogate fuels for diesel and HCCI engines; (2) Develop surrogate fuel models to represent real fuels and model low temperature combustion strategies in HCCI and diesel engines that lead to low emissions and high efficiency; and (3) Characterize the role of fuel composition on low temperature combustion modes of advanced combustion engines.
Date: November 15, 2010
Creator: Pitz, W J; Westbrook, C K; Mehl, M & Sarathy, S M
Object Type: Report
System: The UNT Digital Library
Bottom-up Representation of Industrial Energy Efficiency Technologies in Integrated Assessment Models for the Cement Sector (open access)

Bottom-up Representation of Industrial Energy Efficiency Technologies in Integrated Assessment Models for the Cement Sector

Adoption of efficient end-use technologies is one of the key measures for reducing greenhouse gas (GHG) emissions. How to effectively analyze and manage the costs associated with GHG reductions becomes extremely important for the industry and policy makers around the world. Energy-climate (EC) models are often used for analyzing the costs of reducing GHG emissions for various emission-reduction measures, because an accurate estimation of these costs is critical for identifying and choosing optimal emission reduction measures, and for developing related policy options to accelerate market adoption and technology implementation. However, accuracies of assessing of GHG-emission reduction costs by taking into account the adoption of energy efficiency technologies will depend on how well these end-use technologies are represented in integrated assessment models (IAM) and other energy-climate models.
Date: August 15, 2010
Creator: Sathaye, J.; Xu, T. & Galitsky, C.
Object Type: Report
System: The UNT Digital Library
Enforcing Building Energy Codes in China: Progress and Comparative Lessons (open access)

Enforcing Building Energy Codes in China: Progress and Comparative Lessons

From 1995 to 2005, building energy use in China increased more rapidly than the world average. China has been adding 0.4 to 1.6 billion square meters of floor space annually , making it the world’s largest market for new construction. In fact, by 2020, China is expected to comprise half of all new construction. In response to this, China has begun to make important steps towards achieving building energy efficiency, including the implementation of building energy standards that requires new buildings to be 65% more efficient than buildings from the early 1980s. Making progress on reducing building energy use requires both a comprehensive code and a robust enforcement system. The latter – the enforcement system – is a particularly critical component for assuring that a building code has an effect. China has dramatically enhanced its enforcement system in the past two years, with more detailed requirements for ensuring enforcement and new penalties for non-compliance. We believe that the U.S. and other developed countries could benefit from learning about the multiple checks and the documentation required in China. Similarly, some of the more user-friendly enforcement approaches developed in the U.S. and elsewhere may be useful for China as it strives to …
Date: August 15, 2010
Creator: Evans, Meredydd; Shui, Bin; Halverson, Mark A. & Delgado, Alison
Object Type: Report
System: The UNT Digital Library
Surface complexation of Pb(II) by hexagonal birnessite nanoparticles (open access)

Surface complexation of Pb(II) by hexagonal birnessite nanoparticles

Natural hexagonal birnessite is a poorly-crystalline layer type Mn(IV) oxide precipitated by bacteria and fungi which has a particularly high adsorption affinity for Pb(II). X-ray spectroscopic studies have shown that Pb(II) forms strong inner-sphere surface complexes mainly at two sites on hexagonal birnessite nanoparticles: triple corner-sharing (TCS) complexes on Mn(IV) vacancies in the interlayers and double edge-sharing (DES) complexes on lateral edge surfaces. Although the TCS surface complex has been well characterized by spectroscopy, some important questions remain about the structure and stability of the complexes occurring on the edge surfaces. First-principles simulation techniques such as density functional theory (DFT) offer a useful way to address these questions by providing complementary information that is difficult to obtain by spectroscopy. Following this computational approach, we used spin-polarized DFT to perform total-energy-minimization geometry optimizations of several possible Pb(II) surface complexes on model birnessite nanoparticles similar to those that have been studied experimentally. We first validated our DFT calculations by geometry optimizations of (1) the Pb-Mn oxyhydroxide mineral, quenselite (PbMnO{sub 2}OH), and (2) the TCS surface complex, finding good agreement with experimental structural data while uncovering new information about bonding and stability. Our geometry optimizations of several protonated variants of the DES surface …
Date: October 15, 2010
Creator: Kwon, K.; Refson, K. & Sposito, G.
Object Type: Article
System: The UNT Digital Library
Urban Form Energy Use and Emissions in China: Preliminary Findings and Model Proof of Concept (open access)

Urban Form Energy Use and Emissions in China: Preliminary Findings and Model Proof of Concept

Urbanization is reshaping China's economy, society, and energy system. Between 1990 and 2008 China added more than 300 million new urban residents, bringing the total urbanization rate to 46%. The ongoing population shift is spurring energy demand for new construction, as well as additional residential use with the replacement of rural biomass by urban commercial energy services. This project developed a modeling tool to quantify the full energy consequences of a particular form of urban residential development in order to identify energy- and carbon-efficient modes of neighborhood-level development and help mitigate resource and environmental implications of swelling cities. LBNL developed an integrated modeling tool that combines process-based lifecycle assessment with agent-based building operational energy use, personal transport, and consumption modeling. The lifecycle assessment approach was used to quantify energy and carbon emissions embodied in building materials production, construction, maintenance, and demolition. To provide more comprehensive analysis, LBNL developed an agent-based model as described below. The model was applied to LuJing, a residential development in Jinan, Shandong Province, to provide a case study and model proof of concept. This study produced results data that are unique by virtue of their scale, scope and type. Whereas most existing literature focuses on building-, …
Date: December 15, 2010
Creator: Aden, Nathaniel; Qin, Yining & Fridley, David
Object Type: Report
System: The UNT Digital Library