Biodegradation of the High Explosive Hexanitrohexaazaiso-wurtzitane (CL-20

Directory of Open Access Journals (Sweden)

Steve Nicolich

2009-04-01

Full Text Available The aerobic biodegradability of the high explosive CL-20 by activated sludge and the white rot fungus Phanerochaete chrysosporium has been investigated. Although activated sludge is not effective in degrading CL-20 directly, it can mineralize the alkaline hydrolysis products. Phanerochaete chrysosporium degrades CL-20 in the presence of supplementary carbon and nitrogen sources. Biodegradation studies were conducted using various nutrient media under diverse conditions. Variables included the CL-20 concentration; levels of carbon (as glycerol and ammonium sulfate and yeast extract as sources of nitrogen. Cultures that received CL-20 at the time of inoculation transformed CL-20 completely under all nutrient conditions studied. When CL-20 was added to pre-grown cultures, degradation was limited. The extent of mineralization was monitored by the 14CO2 time evolution; up to 51% mineralization was achieved when the fungus was incubated with [14C]-CL-20. The kinetics of CL-20 biodegradation by Phanerochaete chrysosporium follows the logistic kinetic growth model.

New approaches to the CL-20/HMX cocrystal a less sensitive high power explosive

OpenAIRE

Herrmannsdörfer, Dirk; Herrmann, Michael; Heintz, Thomas

2015-01-01

Understanding the kinetic and thermodynamic of the formation of the 2:1 cocrystal of CL-20 and HMX is a key factor to optimize crystallization procedures in regard to time and material efficiency as well as crystal purity. Here we describe the temperature and polymorph dependency of the solvent-mediated cocrystallization of HMX and CL-20 in 2-propanol as well as the solubility curves of CL-20 and HMX in acetone/2-propanol mixtures and acetonitrile/2-propanol mixtures at room temperature. The ...

Nitroreductase catalyzed biotransformation of CL-20

International Nuclear Information System (INIS)

Bhushan, Bharat; Halasz, Annamaria; Hawari, Jalal

2004-01-01

Previously, we reported that a salicylate 1-monooxygenase from Pseudomonas sp. ATCC 29352 biotransformed CL-20 (2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaaza-isowurtzitane) (C 6 H 6 N 12 O 12 ) and produced a key metabolite with mol. wt. 346Da corresponding to an empirical formula of C 6 H 6 N 10 O 8 which spontaneously decomposed in aqueous medium to produce N 2 O, NH4+, and HCOOH [Appl. Environ. Microbiol. (2004)]. In the present study, we found that nitroreductase from Escherichia coli catalyzed a one-electron transfer to CL-20 to form a radical anion (CL-20 - ) which upon initial N-denitration also produced metabolite C 6 H 6 N 10 O 8 . The latter was tentatively identified as 1,4,5,8-tetranitro-1,3a,4,4a,5,7a,8,8a-octahydro-diimidazo[4,5-b:4',5'-e] pyrazine [IUPAC] which decomposed spontaneously in water to produce glyoxal (OHCCHO) and formic acid (HCOOH). The rates of CL-20 biotransformation under anaerobic and aerobic conditions were 3.4+/-0.2 and 0.25+/-0.01nmolmin -1 mg of protein -1 , respectively. The product stoichiometry showed that each reacted CL-20 molecule produced about 1.8 nitrite ions, 3.3 molecules of nitrous oxide, 1.6 molecules of formic acid, 1.0 molecule of glyoxal, and 1.3 ammonium ions. Carbon and nitrogen products gave mass-balances of 60% and 81%, respectively. A comparative study between native-, deflavo-, and reconstituted-nitroreductase showed that FMN-site was possibly involved in the biotransformation of CL-20

Sinteza i fizičko-hemijske karakteristike eksploziva HNIW (CL-20) / Synthesis and physicochemical properties of the HNIW (CL-20) explosive

OpenAIRE

Mirjana Lukić-Anđelković

2009-01-01

Novo jedinjenje CL-20 je ciklični nitramin sa najvećom kristalnom gustinom (iznad 2,0 g/cm3) i najsnažniji nenuklearni eksploziv. Opisana je sinteza HNIW ili CL-20 u tri stepena. CL-20 ima najveću gustinu i brzinu detonacije među poznatim eksplozivima, kao i najveću energiju među energetskim dodacima koji se koriste kao dodaci za eksplozive, barute i kompozitna raketna goriva. Prikazani su neki sastavi na bazi CL-20, energetskih polimera, aluminijuma i amonijumperhlorata, kao i gustine i brzi...

Nano-CL-20/HMX Cocrystal Explosive for Significantly Reduced Mechanical Sensitivity

Directory of Open Access Journals (Sweden)

Chongwei An

2017-01-01

Full Text Available Spray drying method was used to prepare cocrystals of hexanitrohexaazaisowurtzitane (CL-20 and cyclotetramethylene tetranitramine (HMX. Raw materials and cocrystals were characterized using scanning electron microscopy, X-ray diffraction, differential scanning calorimetry, Raman spectroscopy, and Fourier transform infrared spectroscopy. Impact and friction sensitivity of cocrystals were tested and analyzed. Results show that, after preparation by spray drying method, microparticles were spherical in shape and 0.5–5 µm in size. Particles formed aggregates of numerous tiny plate-like cocrystals, whereas CL-20/HMX cocrystals had thicknesses of below 100 nm. Cocrystals were formed by C–H⋯O bonding between –NO2 (CL-20 and –CH2– (HMX. Nanococrystal explosives exhibited drop height of 47.3 cm, and friction demonstrated explosion probability of 64%. Compared with raw HMX, cocrystals displayed significantly reduced mechanical sensitivity.

Modeling Thermal Ignition of Energetic Materials

National Research Council Canada - National Science Library

Gerri, Norman J; Berning, Ellen

2004-01-01

This report documents an attempt to computationally simulate the mechanics and thermal regimes created when a threat perforates an armor envelope and comes in contact with stowed energetic material...

Understanding metastable phase transformation during crystallization of RDX, HMX and CL-20: experimental and DFT studies.

Science.gov (United States)

Ghosh, Mrinal; Banerjee, Shaibal; Shafeeuulla Khan, Md Abdul; Sikder, Nirmala; Sikder, Arun Kanti

2016-09-14

Multiphase growth during crystallization severely affects deliverable output of explosive materials. Appearance and incomplete transformation of metastable phases are a major source of polymorphic impurities. This article presents a methodical and molecular level understanding of the metastable phase transformation mechanism during crystallization of cyclic nitramine explosives, viz. RDX, HMX and CL-20. Instantaneous reverse precipitation yielded metastable γ-HMX and β-CL-20 which undergo solution mediated transformation to the respective thermodynamic forms, β-HMX and ε-CL-20, following 'Ostwald's rule of stages'. However, no metastable phase, anticipated as β-RDX, was evidenced during precipitation of RDX, which rather directly yielded the thermodynamically stable α-phase. The γ→β-HMX and β→ε-CL-20 transformations took 20 and 60 minutes respectively, whereas formation of α-RDX was instantaneous. Density functional calculations were employed to identify the possible transition state conformations and to obtain activation barriers for transformations at wB97XD/6-311++G(d,p)(IEFPCM)//B3LYP/6-311G(d,p) level of theory. The computed activation barriers and lattice energies responsible for transformation of RDX, HMX and CL-20 metastable phases to thermodynamic ones conspicuously supported the experimentally observed order of phase stability. This precise result facilitated an understanding of the occurrence of a relatively more sensitive and less dense β-CL-20 phase in TNT based melt-cast explosive compositions, a persistent and critical problem unanswered in the literature. The crystalline material recovered from such compositions revealed a mixture of β- and ε-CL-20. However, similar compositions of RDX and HMX never showed any metastable phase. The relatively long stability with the highest activation barrier is believed to restrict complete β→ε-CL-20 transformation during processing. Therefore a method is suggested to overcome this issue.

Erosion tests of materials by energetic particle beams

Energy Technology Data Exchange (ETDEWEB)

Schechter, D.E.; Tsai, C.C.; Sluss, F.; Becraft, W.R.; Hoffman, D.J.

1985-01-01

The internal components of magnetic fusion devices must withstand erosion from and high heat flux of energetic plasma particles. The selection of materials for the construction of these components is important to minimize contamination of the plasma. In order to study various materials' comparative resistance to erosion by energetic particles and their ability to withstand high heat flux, water-cooled copper swirl tubes coated or armored with various materials were subjected to bombardment by hydrogen and helium particle beams. Materials tested were graphite, titanium carbide (TiC), chromium, nickel, copper, silver, gold, and aluminum. Details of the experimental arrangement and methods of application or attachment of the materials to the copper swirl tubes are presented. Results including survivability and mass losses are discussed.

Heterogeneous computing with OpenCL 2.0

CERN Document Server

Kaeli, David R; Schaa, Dana; Zhang, Dong Ping

2015-01-01

Heterogeneous Computing with OpenCL 2.0 teaches OpenCL and parallel programming for complex systems that may include a variety of device architectures: multi-core CPUs, GPUs, and fully-integrated Accelerated Processing Units (APUs). This fully-revised edition includes the latest enhancements in OpenCL 2.0 including: Shared virtual memory to increase programming flexibility and reduce data transfers that consume resources Dynamic parallelism which reduces processor load and avoids bottlenecks Improved imaging support and integration with OpenGL  Designed to work on multiple platfor

The viability and performance characterization of nano scale energetic materials on a semiconductor bridge (SCB)

Science.gov (United States)

Strohm, Gianna Sophia

The move from conventional energetic composites to nano scale energetic mixtures (nano energetics) has shown dramatic improvement in energy release rate and sensitivity to ignition. A possible application of nano energetics is on a semiconductor bridge (SCB). An SCB typically requires a tenth of the energy input as compared to a bridge wire design with the same no-fire and is capable of igniting in tens of microseconds. For very low energy applications, SCBs can be manufactured to extremely small sizes and it is necessary to find materials with particle sizes that are even smaller to function. Reactive particles of comparable size to the bridge can lead to problems with ignition reliability for small bridges. Nano-energetic composites and the use of SCBs have been significantly studied individually, however, the process of combining nano energetics with an SCB has not been investigated extensively and is the focus of this work. Goals of this study are to determine if nano energetics can be used with SCBs to further reduce the minimum energy required and improve reliability. The performance of nano-scale aluminum (nAl) and bismuth oxide (Bi2O3) with nitrocellulose (NC), Fluorel(TM) FC 2175 (chemically equivalent to VitonRTM) and Glycidyl Azide Polymer (GAP) as binders where quantified initially using the SenTest(TM) algorithm at three weight fractions (5, 7, and 9%) of binder. The threshold energy was calculated and compared to previous data using conventional materials such as zirconium potassium chlorate (ZPC), mercuric 5-Nitrotetrazol (DXN-1) and titanium sub-hydride potassium per-chlorate (TSPP). It was found that even though there where only slight differences in performance between the binders with nAl/Bi2O 3 at any of the three binder weight fractions, the results show that these nano energetic materials require about half of the threshold energy compared to conventional materials using an SCB with an 84x42 mum bridge. Binder limit testing was conducted to

Hydrostatic Compression of 2,4,6,8,10,12 hexanitrohexaaza isowurtzitane (CL20) Co Crystals

Science.gov (United States)

2016-12-01

ARL-TR-7901 ● DEC 2016 US Army Research Laboratory Hydrostatic Compression of 2,4,6,8,10,12- hexanitrohexaaza-isowurtzitane (CL20... Hydrostatic Compression of 2,4,6,8,10,12- hexanitrohexaaza-isowurtzitane (CL20) Co-Crystals by DeCarlos Taylor Weapons and Materials...Technical Report 3. DATES COVERED (From - To) October 2015–September 2016 4. TITLE AND SUBTITLE Hydrostatic Compression of 2,4,6,8,10,12

Biodegradation of the High Explosive Hexanitrohexaazaiso-wurtzitane (CL-20)

OpenAIRE

Karakaya, Pelin; Christodoulatos, Christos; Koutsospyros, Agamemnon; Balas, Wendy; Nicolich, Steve; Sidhoum, Mohammed

2009-01-01

The aerobic biodegradability of the high explosive CL-20 by activated sludge and the white rot fungus Phanerochaete chrysosporium has been investigated. Although activated sludge is not effective in degrading CL-20 directly, it can mineralize the alkaline hydrolysis products. Phanerochaete chrysosporium degrades CL-20 in the presence of supplementary carbon and nitrogen sources. Biodegradation studies were conducted using various nutrient media under diverse conditions. Variables included the...

Energetic materials standards – Chemical compatibility

NARCIS (Netherlands)

Tuukkanen, I.M.; Bouma, R.H.B.

2014-01-01

Subgroup A Energetic Materials Team, SG/A (EMT), develops and maintains standards that are relevant to all life-cycle phases of ammunition/weapon systems. STANAG 4147 is the standard regarding chemical compatibility of explosives with munition components, and is a document of prime importance.

Virtual screening of cocrystal formers for CL-20

Science.gov (United States)

Zhou, Jun-Hong; Chen, Min-Bo; Chen, Wei-Ming; Shi, Liang-Wei; Zhang, Chao-Yang; Li, Hong-Zhen

2014-08-01

According to the structure characteristics of 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane (CL-20) and the kinetic mechanism of the cocrystal formation, the method of virtual screening CL-20 cocrystal formers by the criterion of the strongest intermolecular site pairing energy (ISPE) was proposed. In this method the strongest ISPE was thought to determine the first step of the cocrystal formation. The prediction results for four sets of common drug molecule cocrystals by this method were compared with those by the total ISPE method from the reference (Musumeci et al., 2011), and the experimental results. This method was then applied to virtually screen the CL-20 cocrystal formers, and the prediction results were compared with the experimental results.

Sinteza i fizičko-hemijske karakteristike eksploziva hniw (cl-20)

OpenAIRE

Mirjana Anđelković-Lukić

2009-01-01

Novo jedinjenje CL-20 je ciklični nitramin sa najvećom kristalnom gustinom (iznad 2,0 g/cm3) i najsnažniji nenuklearni eksploziv. Opisana je sinteza HNIW ili CL-20 u tri stepena. CL-20 ima najveću gustinu i brzinu detonacije među poznatim eksplozivima, kao i najveću energiju među energetskim dodacima koji se koriste kao dodaci za eksplozive, barute i kompozitna raketna goriva. Prikazani su neki sastavi na bazi CL-20, energetskih polimera, aluminijuma i amonijumperhlorata, ka...

Ultrafast Vibrational Spectrometer for Engineered Nanometric Energetic Materials

National Research Council Canada - National Science Library

Dlott, Dana

2002-01-01

The proposer requested funding for laser equipment that would be used to study engineered nanometric energetic materials consisting of nanometer metal particles, passivation layers and oxidizing binders...

Nano-CL-20/HMX Cocrystal Explosive for Significantly Reduced Mechanical Sensitivity

OpenAIRE

An, Chongwei; Li, Hequn; Ye, Baoyun; Wang, Jingyu

2017-01-01

Spray drying method was used to prepare cocrystals of hexanitrohexaazaisowurtzitane (CL-20) and cyclotetramethylene tetranitramine (HMX). Raw materials and cocrystals were characterized using scanning electron microscopy, X-ray diffraction, differential scanning calorimetry, Raman spectroscopy, and Fourier transform infrared spectroscopy. Impact and friction sensitivity of cocrystals were tested and analyzed. Results show that, after preparation by spray drying method, microparticles were sph...

Chemical rocket propulsion a comprehensive survey of energetic materials

CERN Document Server

Shimada, Toru; Sinditskii, Valery; Calabro, Max

2017-01-01

Developed and expanded from the work presented at the New Energetic Materials and Propulsion Techniques for Space Exploration workshop in June 2014, this book contains new scientific results, up-to-date reviews, and inspiring perspectives in a number of areas related to the energetic aspects of chemical rocket propulsion. This collection covers the entire life of energetic materials from their conceptual formulation to practical manufacturing; it includes coverage of theoretical and experimental ballistics, performance properties, as well as laboratory-scale and full system-scale, handling, hazards, environment, ageing, and disposal. Chemical Rocket Propulsion is a unique work, where a selection of accomplished experts from the pioneering era of space propulsion and current technologists from the most advanced international laboratories discuss the future of chemical rocket propulsion for access to, and exploration of, space. It will be of interest to both postgraduate and final-year undergraduate students in...

Stabilized super-thermite colloids: A new generation of advanced highly energetic materials

Science.gov (United States)

Elbasuney, Sherif; Gaber Zaky, M.; Radwan, Mostafa; Mostafa, Sherif F.

2017-10-01

One of the great impetus of nanotechnology on energetic materials is the achievement of nanothermites (metal-oxide/metal) which are characterized by massive heat output. Yet, full exploitation of super-thermites in highly energetic systems has not been achieved. This manuscript reports on the sustainable fabrication of colloidal Fe2O3 and CuO nanoparticles for thermite applications. TEM micrographs demonstrated mono-dispersed Fe2O3 and CuO with an average particle size of 3 and 15 nm respectively. XRD diffractograms demonstrated highly crystalline materials. SEM micrographs demonstrated a great tendency of the developed oxides to aggregate over drying process. The effective integration and dispersion of mono-dispersed colloidal thermite particles into energetic systems are vital for enhanced performance. Aluminum is of interest as highly energetic metal fuel. In this paper, synthesized Fe2O3 and CuO nanoparticles were re-dispersed in isopropyl alcohol (IPA) with aluminum nanoparticles using ultrasonic prope homogenizer. The colloidal thermite peraticles can be intgegrated into highly energetic system for subsequent nanocomposite development. Thanks to stabilization of colloidal CuO nanoparticles in IPA which could offer intimate mixing between oxidizer and metal fuel. The stabilization mechanism of CuO in IPA was correlated to steric stabilization with solvent molecules. This approach eliminated nanoparticle drying and the re-dispersion of dry aggregates into energetic materials. This manuscript shaded the light on the real development of colloidal thermite mixtures and their integration into highly energetic systems.

Report for MaRIE Drivers Workshop on needs for energetic material's studies.

Energy Technology Data Exchange (ETDEWEB)

Specht, Paul Elliott [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

2018-01-01

Energetic materials (i.e. explosives, propellants, and pyrotechnics) have complex mesoscale features that influence their dynamic response. Direct measurement of the complex mechanical, thermal, and chemical response of energetic materials is critical for improving computational models and enabling predictive capabilities. Many of the physical phenomena of interest in energetic materials cover time and length scales spanning several orders of magnitude. Examples include chemical interactions in the reaction zone, the distribution and evolution of temperature fields, mesoscale deformation in heterogeneous systems, and phase transitions. This is particularly true for spontaneous phenomena, like thermal cook-off. The ability for MaRIE to capture multiple length scales and stochastic phenomena can significantly advance our understanding of energetic materials and yield more realistic, predictive models.

Preparation of CL-20 Explosive Nanoparticles and Their Thermal Decomposition Property

Directory of Open Access Journals (Sweden)

Dunju Wang

2016-01-01

Full Text Available Herein, we develop a novel method for preparing nanohexanitrohexaazaisowurtzitane (nano-CL-20 via ultrasonic spray-assisted electrostatic adsorption (USEA technology. Various experimental conditions which influence safety factors and the crystallization process were studied. Meanwhile, the prepared nano-CL-20 particles were characterized by field emission scanning electron microscopy (FE-SEM, X-ray diffraction (XRD, and Fourier transform infrared (FT-IR spectroscopy. The results show that the obtained nano-CL-20 showed a wide size distribution in the range from 150 to 600 nm with an average of 270 nm. Moreover, their thermal properties were also investigated by differential scanning calorimetry (DSC and thermogravimetry (TG. For nano-CL-20, the exothermal peak is 232.9°C increased by 12°C compared with conventionally manufactured (CM CL-20, and they exhibit fast energy release efficiency as well as more energy release. The simple and continuous approach presented here is expected to be an attractive potential for fabricating other organic nanoparticles.

Flexible energetic materials and related methods

Energy Technology Data Exchange (ETDEWEB)

Heaps, Ronald J.

2018-03-06

Energetic compositions and methods of forming components from the compositions are provided. In one embodiment, a composition includes aluminum, molybdenum trioxide, potassium perchlorate, and a binder. In one embodiment, the binder may include a silicone material. The materials may be mixed with a solvent, such as xylene, de-aired, shaped and cured to provide a self-supporting structure. In one embodiment, one or more reinforcement members may be added to provide additional strength to the structure. For example, a weave or mat of carbon fiber material may be added to the mixture prior to curing. In one embodiment, blade casting techniques may be used to form a structure. In another embodiment, a structure may be formed using 3-dimensional printing techniques.

Uptake of hexanitrohexaazaisowurtzitane (CL-20) by the earthworm Eisenia fetida through dermal contact

International Nuclear Information System (INIS)

Gong Ping; Escalon, B. Lynn; Hayes, Charolett A.; Perkins, Edward J.

2008-01-01

The explosive compound hexanitrohexaazaisowurtzitane (CL-20) has been shown to cause both lethal and sublethal (reproductive and neurotoxic) effects in exposed oligochaetes. However, whether worms take up CL-20 and how much CL-20 enters worm bodies leading to toxicity (e.g., lethality) remain to be determined. In the present study, we used high performance liquid chromatography (HPLC) and radiolabeled tracer methods to investigate the CL-20 uptake in the whole worm body after contact exposures. Worms (Eisenia fetida) were exposed to filter paper spiked with non-radioactive or [U- 14 C]-labeled CL-20 for 1-3 d. The radiolabeled tracer method allowed us to detect the parent compound and transformation products in worms exposed to as low as 0.04 μg CL-20 cm -2 of filter paper. The HPLC method without radiolabeled tracer was far less sensitive with a detection limit of 2.17 μg CL-20 cm -2 . Using the radiolabeled tracer, we were able to demonstrate that the worm body concentration linearly correlated to the filter paper concentration ≤ 0.34 μg cm -2 (r = 0.94) if no breakdown products are assumed. At higher concentrations, the body concentration increased slowly and saturated at around 11 μg g -1 dry mass resulting in an estimated lethal critical body burden of 10-15 μg CL-20 g -1 dry mass. These findings demonstrate that CL-20 or potential transformation products are taken into the earthworm body through dermal contact. This information should prove valuable in assessing the bioaccumulation potential and ecological risks of CL-20

Uptake of hexanitrohexaazaisowurtzitane (CL-20) by the earthworm Eisenia fetida through dermal contact

Energy Technology Data Exchange (ETDEWEB)

Gong Ping [SpecPro, 3909 Halls Ferry Road, Vicksburg, MS 39180 (United States)], E-mail: ping.gong@erdc.usace.army.mil; Escalon, B. Lynn; Hayes, Charolett A. [SpecPro, 3909 Halls Ferry Road, Vicksburg, MS 39180 (United States); Perkins, Edward J. [Environmental Laboratory, US Army Engineer Research and Development Center, 3909 Halls Ferry Road, Vicksburg, MS 39180 (United States)

2008-02-01

The explosive compound hexanitrohexaazaisowurtzitane (CL-20) has been shown to cause both lethal and sublethal (reproductive and neurotoxic) effects in exposed oligochaetes. However, whether worms take up CL-20 and how much CL-20 enters worm bodies leading to toxicity (e.g., lethality) remain to be determined. In the present study, we used high performance liquid chromatography (HPLC) and radiolabeled tracer methods to investigate the CL-20 uptake in the whole worm body after contact exposures. Worms (Eisenia fetida) were exposed to filter paper spiked with non-radioactive or [U-{sup 14}C]-labeled CL-20 for 1-3 d. The radiolabeled tracer method allowed us to detect the parent compound and transformation products in worms exposed to as low as 0.04 {mu}g CL-20 cm{sup -2} of filter paper. The HPLC method without radiolabeled tracer was far less sensitive with a detection limit of 2.17 {mu}g CL-20 cm{sup -2}. Using the radiolabeled tracer, we were able to demonstrate that the worm body concentration linearly correlated to the filter paper concentration {<=} 0.34 {mu}g cm{sup -2} (r = 0.94) if no breakdown products are assumed. At higher concentrations, the body concentration increased slowly and saturated at around 11 {mu}g g{sup -1} dry mass resulting in an estimated lethal critical body burden of 10-15 {mu}g CL-20 g{sup -1} dry mass. These findings demonstrate that CL-20 or potential transformation products are taken into the earthworm body through dermal contact. This information should prove valuable in assessing the bioaccumulation potential and ecological risks of CL-20.

Energetic contaminants inhibit plant litter decomposition in soil.

Science.gov (United States)

Kuperman, Roman G; Checkai, Ronald T; Simini, Michael; Sunahara, Geoffrey I; Hawari, Jalal

2018-05-30

Individual effects of nitrogen-based energetic materials (EMs) 2,4-dinitrotoluene (2,4-DNT), 2-amino-4,6-dinitrotoluene (2-ADNT), 4-amino-2,6-dinitrotoluene (4-ADNT), nitroglycerin (NG), and 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane (CL-20) on litter decomposition, an essential biologically-mediated soil process, were assessed using Orchard grass (Dactylis glomerata) straw in Sassafras sandy loam (SSL) soil, which has physicochemical characteristics that support "very high" qualitative relative bioavailability for organic chemicals. Batches of SSL soil were separately amended with individual EMs or acetone carrier control. To quantify the decomposition rates, one straw cluster was harvested from a set of randomly selected replicate containers from within each treatment, after 1, 2, 3, 4, 6, and 8 months of exposure. Results showed that soil amended with 2,4-DNT or NG inhibited litter decomposition rates based on the median effective concentration (EC50) values of 1122 mg/kg and 860 mg/kg, respectively. Exposure to 2-ADNT, 4-ADNT or CL-20 amended soil did not significantly affect litter decomposition in SSL soil at ≥ 10,000 mg/kg. These ecotoxicological data will be helpful in identifying concentrations of EMs in soil that present an acceptable ecological risk for biologically-mediated soil processes. Published by Elsevier Inc.

Utilizing NaCl to increase the porosity of electrospun materials

International Nuclear Information System (INIS)

Wright, L.D.; Andric, T.; Freeman, J.W.

2011-01-01

Electrospinning has emerged as a popular method for creating scaffolding materials used in tissue engineering applications to repair or replace damaged tissues. To become a viable scaffold material, however, pore sizes in electrospun materials must be increased to improve cell infiltration. Deposition of NaCl crystals during electrospinning was utilized to help overcome this obstacle. The NaCl crystals are released above the rotating collection mandrel and become incorporated into the poly(L-lactide) electrospun material. The NaCl then leaches out of the electrospun material creating larger pores: average pore diameter of 48.7 μm for PLLA-NaCl electrospinning versus 5.5 μm for PLLA alone electrospinning. Electrospun PLLA scaffolds with NaCl pores have a lower elastic modulus (8.05 MPa) and yield stress (349 kPa) and a higher yield strain (0.04) compared to their traditional counterparts (40.36 MPa, 676 kPa, and 0.0188). Decreased elastic modulus and yield stress would be beneficial to tissue engineering of elastic tissues including skin. The presence of NaCl pores did not significantly affect the cellular proliferation of MC3T3 cells but did allow for cell infiltration into the electrospun material. Therefore, the creation of large pores through NaCl leaching can significantly improve the performance of electrospun materials for tissue engineering applications by improving cellular infiltration.

Exergetic and energetic comparison of LiCl-H_2O and LiBr-H_2O working pairs in a solar absorption cooling system

International Nuclear Information System (INIS)

Bellos, Evangelos; Tzivanidis, Christos; Antonopoulos, Kimon A.

2016-01-01

Highlights: • Two working pairs (LiCl-H_2O and LiBr-H_2O) are examined in a solar absorption chiller. • The examined single effect absorption chiller is driven by flat plate collectors. • The system is analyzed energetically and energetically for 3 ambient temperatures. • LiCl-H_2O performs better than LiBr-H_2O in all the examined cases. • The optimum operating temperature is lower for the case of pair LiCl-H_2O. - Abstract: The objective of this study is to investigate the use of an alternative working pair in a solar absorption cooling system. LiCl-H_2O is the new examined pair and it is compared energetically and exegetically with the conventional pair LiBr-H_2O, which is the most usual in air-conditioning applications. The simplest solar cooling system is analyzed in order to focus in the comparison between these working fluids. Specifically, flat plate collectors, coupled with a storage tank, feed the single effect absorption chiller which produces 250 kW cooling at 10 °C. The two pairs are examined parametrically for various heat source temperature levels and for three ambient temperature levels (25 °C, 30 °C and 35 °C). The minimization of the collecting area, which means maximum exergetic efficiency, is the optimization goal in every case. The final results show that LiCl-H_2O pair performs better in all cases by giving greater exergetic efficiency. More specifically, about 8% lower collecting area is required to cover the demanded cooling load with this working pair. Another interesting result is that the optimum heat source temperature for the LiCl-H_2O is roughly lower than the respective for the LiBr-H_2O. The system is analyzed in steady state with the commercial software Engineering Equator Solver (EES).

Computational Chemistry Toolkit for Energetic Materials Design

Science.gov (United States)

2006-11-01

industry are aggressively engaged in efforts to develop multiscale modeling and simulation methodologies to model and analyze complex phenomena across...energetic materials design. It is hoped that this toolkit will evolve into a collection of well-integrated multiscale modeling methodologies...Experimenta Theoreticala This Work 1-5-Diamino-4- methyl- tetrazolium nitrate 8.4 41.7 47.5 1-5-Diamino-4- methyl- tetrazolium azide 138.1 161.6

Probing the Dynamics of Ultra-Fast Condensed State Reactions in Energetic Materials

Science.gov (United States)

Piekiel, Nicholas William

2012-01-01

Energetic materials (EMs) are substances with a high amount of stored energy and the ability to release that energy at a rapid rate. Nanothermites and green organic energetics are two classes of EMs which have gained significant interest as they each have desirable properties over traditional explosives. These systems also possess downfalls, which…

Ultrafast Vibrational Spectrometer for Engineered Nanometric Energetic Materials

National Research Council Canada - National Science Library

Dlott, Dana

2002-01-01

.... The needed equipment was ordered and installed, and assembled into a working SFG set up that has been tested on a model system consisting of a self assembled monolayer of alkane on gold. The next step will be to finish integrating the carbon dioxide laser system and to begin looking at aluminum based energetic materials.

New fluidized bed reactor for coating of energetic materials

NARCIS (Netherlands)

Abadjieva, E.; Huijser, T.; Creyghton, Y.L.M.; Heijden, A.E.D.M. van der

2009-01-01

The process of altering and changing the properties of the energetic materials by coating has been studied extensively by several scientific groups. According to the desired application different coating techniques have been developed and applied to achieve satisfactory results. Among the already

Study of thermal sensitivity and thermal explosion violence of energetic materials in the LLNL ODTX system

International Nuclear Information System (INIS)

Hsu, P C; Hust, G; Zhang, M X; Lorenz, T K; Reynolds, J G; Fried, L; Springer, H K; Maienschein, J L

2014-01-01

Incidents caused by fire and combat operations can heat energetic materials that may lead to thermal explosion and result in structural damage and casualty. Some explosives may thermally explode at fairly low temperatures (< 100 °C) and the violence from thermal explosion may cause significant damage. Thus it is important to understand the response of energetic materials to thermal insults. The One Dimensional Time to Explosion (ODTX) system at the Lawrence Livermore National Laboratory has been used for decades to measure times to explosion, threshold thermal explosion temperature, and determine kinetic parameters of energetic materials. Samples of different configurations (pressed part, powder, paste, and liquid) can be tested in the system. The ODTX testing can also provide useful data for assessing the thermal explosion violence of energetic materials. Recent ODTX experimental data are reported in the paper.

Use of energetic ion beams in materials synthesis and processing

International Nuclear Information System (INIS)

Appleton, B.R.

1992-01-01

A brief review of the use energetic ion beams and related techniques for the synthesis, processing, and characterization of materials is presented. Selected opportunity areas are emphasized with examples, and references are provided for more extensive coverage. (author)

Enhancing Reactivity in Structural Energetic Materials

Science.gov (United States)

Glumac, Nick

2017-06-01

In many structural energetic materials, only a small fraction of the metal oxidizes, and yet this provides a significant boost in the overall energy release of the system. Different methodologies to enhance this reactivity include alloying and geometric modifications of microstructure of the reactive material (RM). In this presentation, we present the results of several years of systematic study of both chemical (alloy) and mechanical (geometry) effects on reactivity for systems with typical charge to case mass ratios. Alloys of aluminum with magnesium and lithium are considered, as these are common alloys in aerospace applications. In terms of geometric modifications, we consider surface texturing, inclusion of dense additives, and inclusion of voids. In all modifications, a measurable influence on output is observed, and this influence is related to the fragment size distribution measured from the observed residue. Support from DTRA is gratefully acknowledged.

Preparation of CL-20 Explosive Nanoparticles and Their Thermal Decomposition Property

OpenAIRE

Wang, Dunju; Gao, Bing; Yang, Guangcheng; Nie, Fude; Huang, Hui

2016-01-01

Herein, we develop a novel method for preparing nanohexanitrohexaazaisowurtzitane (nano-CL-20) via ultrasonic spray-assisted electrostatic adsorption (USEA) technology. Various experimental conditions which influence safety factors and the crystallization process were studied. Meanwhile, the prepared nano-CL-20 particles were characterized by field emission scanning electron microscopy (FE-SEM), X-ray diffraction (XRD), and Fourier transform infrared (FT-IR) spectroscopy. The results show tha...

Factors Effecting the Fate and Transport of CL-20 in the Vadose Zone and Groundwater: Final Report 2002 - 2004 SERDP Project CP-1255

Energy Technology Data Exchange (ETDEWEB)

Szecsody, James E.; Riley, Robert G.; Devary, Brooks J.; Girvin, Donald C.; Resch, Charles T.; Campbell, James A.; Fredrickson, Herbert L.; Thompson, Karen T.; Crocker, Fiona H.; Qasim, Mohammad M.; Gamerdinger, Amy P.; Lemond, Luke A.

2005-06-01

This SERDP-funded project was initiated to investigate the fate of CL-20 in the subsurface environment, with a focus on identification and quantification of geochemical and microbial reactions of CL-20. CL-20 can be released to the surface and subsurface terrestrial environment by: a) manufacturing processes, b) munition storage, and c) use with low order detonation or unexploded ordnance. The risk of far-field subsurface migration was assessed through labora-tory experiments with a variety of sediments and subsurface materials to quantify processes that control CL-20 sorption-limited migration and degradation. Results of this study show that CL-20 will exhibit differing behavior in the subsurface terrestrial environment: 1. CL-20 on the sediment surface will photodegrade and interact with plants/animals (described in other SERDP projects CU 1254, 1256). CL-20 will exhibit greater sorption in humid sediments to organic matter. Transport will be solubility limited (i.e., low CL-20 aqueous solubility). 2. CL-20 infiltration into soils (<2 m) from spills will be subject to sorption to soil organic matter (if present), and low to high biodegradation rates (weeks to years) depending on the microbial population (greater in humid environment). 3. CL-20 in the vadose zone (>2 m) will be, in most cases, subject to low sorption and low degradation rates, so would persist in the subsurface environment and be at risk for deep migration. Low water content in arid regions will result in a decrease in both sorption and the degradation rate. Measured degradation rates in unsaturated sediments of years would result in significant subsurface migration distances. 4. CL-20 in groundwater will be subject to some sorption but likely very slow degradation rates. CL-20 sorption will be greater than RDX. Most CL-20 degradation will be abiotic (ferrous iron and other transition metals), because most deep subsurface systems have extremely low natural microbial populations. Degradation rates

Laser-shocked energetic materials with metal additives: evaluation of detonation performance

Science.gov (United States)

Gottfried, Jennifer; Bukowski, Eric

A focused, nanosecond-pulsed laser with sufficient energy to exceed the breakdown threshold of a material generates a laser-induced plasma with high peak temperatures, pressures, and shock velocities. Depending on the laser parameters and material properties, nanograms to micrograms of material is ablated, atomized, ionized and excited in the laser-induced plasma. The subsequent shock wave expansion into the air above the sample has been monitored using high-speed schlieren imaging in a recently developed technique, laser-induced air shock from energetic materials (LASEM). The estimated detonation velocities using LASEM agree well with published experimental values. A comparison of the measured shock velocities for various energetic materials including RDX, DNTF, and LLM-172 doped with Al or B to the detonation velocities predicted by CHEETAH for inert or active metal participation demonstrates that LASEM has potential for predicting the early time participation of metal additives in detonation events. The LASEM results show that reducing the amount of hydrogen present in B formulations increases the resulting detonation velocities

2007 Insensitive Munitions and Energetic Materials Technology Symposium

Science.gov (United States)

2007-10-18

Assessment – EIPT chair rotates each calendar year between NAVAIR and NAVSEA Page 9 Networks for collaboration Technology Oriented: Energetic Materials...Analysis IM Explosive Fill for 120mm and/or 155mm Arena Test & Qualificationr t lifi ti Must Show Improvement Review of Filter 1 Data for 3...Arena Test & Qualificationr t lifi ti Must Show Improvement PM-CAS Common Low-cost IM Explosives Program “Funnel” framework to progressively screen

Sensitivity Characterization of Pressed Energetic Materials using Flyer Plate Mesoscale Simulations

Science.gov (United States)

Rai, Nirmal; Udaykumar, H. S.

Heterogeneous energetic materials like pressed explosives have complicated microstructure and contain various forms of heterogeneities such as pores, micro-cracks, energetic crystals etc. It is widely accepted that the presence of these heterogeneities can affect the sensitivity of these materials under shock load. The interaction of shock load with the microstructural heterogeneities may leads to the formation of local heated regions known as ``hot spots''. Chemical reaction may trigger at the hot spot regions depending on the hot spot temperature and the duration over which the temperature can be maintained before phenomenon like heat conduction, rarefaction waves withdraws energy from it. There are different mechanisms which can lead to the formation of hot spots including void collapse. The current work is focused towards the sensitivity characterization of two HMX based pressed energetic materials using flyer plate mesoscale simulations. The aim of the current work is to develop mesoscale numerical framework which can perform simulations by replicating the laboratory based flyer plate experiments. The current numerical framework uses an image processing approach to represent the microstructural heterogeneities incorporated in a massively parallel Eulerian code SCIMITAR3D. The chemical decomposition of HMX is modeled using Henson-Smilowitz reaction mechanism. The sensitivity characterization is aimed towards obtaining James initiation threshold curve and comparing it with the experimental results.

Structure and energetics correlations in some chlorohydroxypyridines

International Nuclear Information System (INIS)

Miranda, Margarida S.; Matos, Maria Agostinha R.; Morais, Victor M.F.

2013-01-01

Highlights: • Study of the structure and energetics of some chlorohydroxypyridines. • Enthalpies of formation and sublimation were determined by calorimetric techniques. • Structure and energy correlations were established. • Quantum chemical calculations allowed estimation of enthalpies of formation. -- Abstract: We have performed a study of the structure and energetics of some chlorohydroxypyridines based on experimental calorimetry techniques and high level ab initio computational calculations. The standard (p° = 0.1 MPa) molar enthalpies of formation of 2-chloro-3-hydroxypyridine (2-Cl-3-OHPy), 2-chloro-6-hydroxypyridine (2-Cl-6-OHPy) and 3-chloro-5-hydroxypyridine (3-Cl-5-OHPy) in the crystalline phase, at T = 298.15 K, were derived from the respective standard massic energies of combustion measured by rotating-bomb combustion calorimetry, in oxygen, at T = 298.15 K. The standard molar enthalpies of sublimation, at T = 298.15 K, were measured by Calvet microcalorimetry. From these experimentally determined enthalpic parameters we have derived the standard molar enthalpies of formation of the three compounds in the gaseous phase, at T = 298.15 K: 2-Cl–3-OHPy, −(76.8 ± 2.0) kJ · mol −1 ; 2-Cl-6-OHPy, −(105.0 ± 1.7) kJ · mol −1 , 3-Cl-5-OHPy −(61.2 ± 2.4) kJ · mol −1 . These values were compared with estimates obtained from very accurate computational calculations using the G3(MP2)//B3LYP composite method and appropriately chosen reactions. These calculations have also been extended to the remaining chlorohydroxypyridine isomers that were not studied experimentally. Based on B3LYP/6-31G ∗ optimized geometries and calculated G3(MP2)//B3LYP absolute enthalpies some structure–energy correlations were discussed

Theoretical Studies of Small-System Thermodynamics in Energetic Materials

Science.gov (United States)

2016-01-06

SECURITY CLASSIFICATION OF: This is a comprehensive theoretical research program to investigate the fundamental principles of small-system thermodynamics ...a.k.a. nanothermodynamics). The proposed work is motivated by our desire to better understand the fundamental dynamics and thermodynamics of...for Public Release; Distribution Unlimited Final Report: Theoretical Studies of Small-System Thermodynamics in Energetic Materials The views, opinions

Effects of void anisotropy on the ignition and growth rates of energetic materials

Science.gov (United States)

Rai, Nirmal Kumar; Sen, Oishik; Udaykumar, H. S.

2017-06-01

Initiation of heterogeneous energetic materials is thought to occur at hot spots; reaction fronts propagate from sites of such hot spots into the surrounding material resulting in complete consumption of the material. Heterogeneous materials, such as plastic bonded explosives (PBXs) and pressed materials contain numerous voids, defects and interfaces at which hot spots can occur. Amongst the various mechanisms of hot spot formation, void collapse is considered to be the predominant one in the high strain rate loading conditions. It is established in the past the shape of the voids has a significant effect on the initiation behavior of energetic materials. In particular, void aspect ratio and orientations play an important role in this regard. This work aims to quantify the effects of void aspect ratio and orientation on the ignition and growth rates of chemical reaction from the hot spot. A wide range of aspect ratio and orientations is considered to establish a correlation between the ignition and growth rates and the void morphology. The ignition and growth rates are obtained from high fidelity reactive meso-scale simulations. The energetic material considered in this work is HMX and Tarver McGuire HMX decomposition model is considered to capture the reaction mechanism of HMX. The meso-scale simulations are performed using a Cartesian grid based Eulerian solver SCIMITAR3D. The void morphology is shown to have a significant effect on the ignition and growth rates of HMX.

Effects of Aluminum Powder on Ignition Performance of RDX, HMX, and CL-20 Explosives

Directory of Open Access Journals (Sweden)

Xiaoxiang Mao

2018-01-01

Full Text Available As a kind of high explosives, aluminized explosive cannot release the energy maximumly, which is a key problem. Using DTA-TG equipment, the ignition performance of three kinds of aluminized explosives (RDX, HMX, and CL-20 with different mass percentages of aluminum powder (0%, 10 wt.%, 20 wt.%, and 30 wt.% was investigated. The results showed that the energy release of the HMX/Al composite explosive with 10 wt.%, 20 wt.%, and 30 wt.% aluminum powder was only equivalent to 80%, 65%, and 36% of pure HMX, respectively. It was similar to RDX/Al and CL-20/Al composite explosives, except the CL-20/Al mixture with 10% aluminum powder. Rather than participating in the ignition and combustion, the aluminum powder does effect the complete reaction of RDX, HMX, and CL-20 in the initial stage of ignition or in the lower temperature area of the boundary.

Synthesis and characterization of PVA blended LiClO4 as electrolyte material for battery Li-ion

Science.gov (United States)

Gunawan, I.; Deswita; Sugeng, B.; Sudaryanto

2017-07-01

It have been synthesized the materials for Li ion battery electrolytes, namely PVA with the addition of LiClO4 salt were varied 0, 5, 10, 15 and 20% by weight respectively. The objective of this study is to control the ionic conductivity in traditional polymer electrolytes, to improve ionic conductivity with the addition of lithium perchlorat (LiClO4). These electrolyte materials prepared by PVA powder was dissolved into distilled water and added LiClO4 salt were varied. After drying the solution, PVA sheet blended LiClO4 salt as electrolyte material for Li ion battery obtained. PVA blended LiClO4 salt crystallite form was confirmed using X-Ray Difraction (XRD) equipment. Observation of the morphology done by using Scanning Electron Microscope (SEM). While the electrical conductivity of the material is measured using LCR meter. The results of XRD pattern of LiClO4 shows intense peaks at angles 2θ = 23.2, 32.99, and 36.58°, which represent the crystalline nature of the salt. Particles morphology of the sample revealed by scanning electron microscopy are irregular in shape and agglomerated, with mean size 200-300 nm. It can be concluded that polycrystalline particles are composed of large number of crystallites. The study of conductivity by using LCR meter shows that all the graphs represent the DC and AC conductivity phenomena.

The quest for greater chemical energy storage in energetic materials: Grounding expectations

Science.gov (United States)

Lindsay, C. Michael; Fajardo, Mario E.

2017-01-01

It is well known that the performance of modern energetic materials based on organic chemistry has plateaued, with only ˜ 40% improvements realized over the past half century. This fact has stimulated research on alternative chemical energy storage schemes in various U.S. government funded "High Energy Density Materials" (HEDM) programs since the 1950's. These efforts have examined a wide range of phenomena such as free radical stabilization, metallic hydrogen, metastable helium, polynitrogens, extended molecular solids, nanothermites, and others. In spite of the substantial research investments, significant improvements in energetic material performance have not been forthcoming. This paper discusses the lessons learned in the various HEDM programs, the different degrees of freedom in which to store energy in materials, and the fundamental limitations and orders of magnitude of the energies involved. The discussion focuses almost exclusively on the topic of energy density and only mentions in passing other equally important properties of explosives and propellants such as gas generation and reaction rate.

Shock interactions with heterogeneous energetic materials

Science.gov (United States)

Yarrington, Cole D.; Wixom, Ryan R.; Damm, David L.

2018-03-01

The complex physical phenomenon of shock wave interaction with material heterogeneities has significant importance and nevertheless remains little understood. In many materials, the observed macroscale response to shock loading is governed by characteristics of the microstructure. Yet, the majority of computational studies aimed at predicting phenomena affected by these processes, such as the initiation and propagation of detonation waves in explosives or shock propagation in geological materials, employ continuum material and reactive burn model treatment. In an effort to highlight the grain-scale processes that underlie the observable effects in an energetic system, a grain-scale model for hexanitrostilbene (HNS) has been developed. The measured microstructures were used to produce synthetic computational representations of the pore structure, and a density functional theory molecular dynamics derived equation of state (EOS) was used for the fully dense HNS matrix. The explicit inclusion of the microstructure along with a fully dense EOS resulted in close agreement with historical shock compression experiments. More recent experiments on the dynamic reaction threshold were also reproduced by inclusion of a global kinetics model. The complete model was shown to reproduce accurately the expected response of this heterogeneous material to shock loading. Mesoscale simulations were shown to provide a clear insight into the nature of threshold behavior and are a way to understand complex physical phenomena.

Fate of CL-20 in sandy soils: Degradation products as potential markers of natural attenuation

International Nuclear Information System (INIS)

Monteil-Rivera, Fanny; Halasz, Annamaria; Manno, Dominic; Kuperman, Roman G.; Thiboutot, Sonia; Ampleman, Guy; Hawari, Jalal

2009-01-01

Hexanitrohexaazaisowurtzitane (CL-20) is an emerging explosive that may replace the currently used explosives such as RDX and HMX, but little is known about its fate in soil. The present study was conducted to determine degradation products of CL-20 in two sandy soils under abiotic and biotic anaerobic conditions. Biotic degradation was prevalent in the slightly acidic VT soil, which contained a greater organic C content, while the slightly alkaline SAC soil favored hydrolysis. CL-20 degradation was accompanied by the formation of formate, glyoxal, nitrite, ammonium, and nitrous oxide. Biotic degradation of CL-20 occurred through the formation of its denitrohydrogenated derivative (m/z 393 Da) while hydrolysis occurred through the formation of a ring cleavage product (m/z 156 Da) that was tentatively identified as CH 2 =N-C(=N-NO 2 )-CH=N-CHO or its isomer N(NO 2 )=CH-CH=N-CO-CH=NH. Due to their chemical specificity, these two intermediates may be considered as markers of in situ attenuation of CL-20 in soil. - Two key intermediates of CL-20 degradation are potential markers of its natural attenuation in soil

Study on Energetic Ions Behavior in Plasma Facing Materials at Lower Temperature

International Nuclear Information System (INIS)

Morimoto, Y.; Sugiyama, T.; Akahori, S.; Kodama, H.; Tega, E.; Sasaki, M.; Oyaidu, M.; Kimura, H.; Okuno, K.

2003-01-01

An apparatus equipped with X-ray Photoelectron Spectroscopy (XPS) and Thermal Desorption Spectroscopy (TDS) was constructed to study interactions of energetic hydrogen isotopes with plasma facing materials. It is a remarkable feature of the apparatus that energetic ion implantation is carried out at around 150K to study reactions of energetic ions with matrix by suppressing the reactions of thermalized ions. Using this apparatus, TDS experiments for pyrolytic graphite implanted with energetic D 2 ions at 173 and 373K were carried out. The experimental results suggest that the deuterium implanted was released through a four-step release processes, involving three D 2 and one CD x (x = 2, 3 and 4) desorption processes. Two deuterium and CD x desorption processes were observed in the temperature range from 700 to 1200 K. In addition, a new deuterium desorption process was observed for the deuterium-implanted sample at 173 K. This has never been observed for deuterium-implanted graphite implanted at temperatures higher than room temperature

Experimental flame speed in multi-layered nano-energetic materials

Energy Technology Data Exchange (ETDEWEB)

Manesh, Navid Amini; Basu, Saptarshi; Kumar, Ranganathan [Department of Mechanical, Material and Aerospace Engineering, University of Central Florida, Orlando, FL (United States)

2010-03-15

This paper deals with the reaction of dense Metastable Intermolecular Composite (MIC) materials, which have a higher density than conventional energetic materials. The reaction of a multilayer thin film of aluminum and copper oxide has been studied by varying the substrate material and thicknesses. The in-plane speed of propagation of the reaction was experimentally determined using a time of- flight technique. The experiment shows that the reaction is completely quenched for a silicon substrate having an intervening silica layer of less than 200 nm. The speed of reaction seems to be constant at 40 m/s for silica layers with a thickness greater than 1 {mu}m. Different substrate materials such as glass and photoresist were also used. (author)

Experimental Study on Reaction Characteristics of PTFE/Ti/W Energetic Materials under Explosive Loading

Directory of Open Access Journals (Sweden)

Yan Li

2016-11-01

Full Text Available Metal/fluoropolymer composites represent a new category of energetic structural materials that release energy through exothermic chemical reactions initiated under shock loading conditions. This paper describes an experiment designed to study the reaction characteristics of energetic materials with low porosity under explosive loading. Three PTFE (polytetrafluoroethylene/Ti/W mixtures with different W contents are processed through pressing and sintering. An inert PTFE/W mixture without reactive Ti particles is also prepared to serve as a reference. Shock-induced chemical reactions are recorded by high-speed video through a narrow observation window. Related shock parameters are calculated based on experimental data, and differences in energy release are discussed. The results show that the reaction propagation of PTFE/Ti/W energetic materials with low porosity under explosive loading is not self-sustained. As propagation distance increases, the energy release gradually decreases. In addition, reaction failure distance in PTFE/Ti/W composites is inversely proportional to the W content. Porosity increased the failure distance due to higher shock temperature.

2016 Energetic Materials Gordon Research Conference and Gordon Research Seminar Research Area 7: Chemical Sciences 7.0 Chemical Sciences (Dr. James K. Parker)

Science.gov (United States)

2016-08-10

Energetic Materials" 8:45 pm - 8:55 pm Discussion 8:55 pm - 9:20 pm Michael Zdilla (Temple University, USA) "Expedition to Breach the CHNO Ceiling by...Introduction by Discussion Leader 9:15 am - 9:45 am Ryan Austin (Lawrence Livermore National Laboratory, USA) "Investigating the Crystal -Level

Reactive thermal waves in energetic materials

Energy Technology Data Exchange (ETDEWEB)

Hill, Larry G [Los Alamos National Laboratory

2009-01-01

Reactive thermal waves (RTWs) arise in several energetic material applications, including self-propagating high-temperature synthesis (SHS), high explosive cookoff, and the detonation of heterogeneous explosives. In this paper I exmaine ideal RTWs, by which I mean that (1) material motion is neglected, (2) the state dependence of reaction is Arrhenius in the temperature, and (3) the reaction rate is modulated by an arbitrary mass-fraction-based reaction progress function. Numerical simulations demonstrate that one's natural intuition, which is based mainly upon experience with inert materials and which leads one to expect diffusion processes to become relatively slow after a short time period, is invalid for high energy, state-sensitive reactive systems. Instead, theory predicts that RTWs can propagate at very high speeds. This result agrees with estimates for detonating heterogeneous explosives, which indicate that RTWs must spread from hot-spot nucleation sites at rates comparable to the detonation speed in order to produce experimentally-observed reaction zone thicknesses. Using dimensionless scaling and further invoking the high activation energy approximation, I obtain an analytic formula for the steady plane RTW speed from numerical calculations. I then compute the RTW speed for real explosives, and discuss aspects of their behavior.

Molten salt destruction as an alternative to open burning of energetic material wastes

International Nuclear Information System (INIS)

Upadhye, R.S.; Watkins, B.E.; Pruneda, C.O.; Brummond, W.A.

1994-01-01

LLNL has built a small-scale (about 1 kg/hr throughput unit to test the destruction of energetic materials using the Molten Salt Destruction (MSD) process. We have modified the unit described in the earlier references to inject energetic waste material continuously into the unit. In addition to the HMX, other explosives we have destroyed include RDX, PETN, ammonium picrate, TNT, nitroguanadine, and TATB. We have also destroyed a liquid gun propellant comprising hydroxyl ammonium nitrate, triethanolammonium nitrate and water. In addition to these pure components, we have destroyed a number of commonly used formulations, such as LX-10 (HMX/Viton), LX-16 (PETN/FPC461, LX-17 (TATB/Kel F), and PBX-9404 (HMX)/CEF/Nitro cellulose). Our experiments have demonstrated that energetic materials can be safely and effectively treated by MSD.We have also investigated the issue of steam explosions in molten salt units, both experimentally and theoretically, and concluded that steam explosions can be avoided under proper design and operating conditions. We are currently building a larger unit (nominal capacity 5 kg/hr,) to investigate the relationship between residence time, temperature, feed concentration and throughputs, avoidance of back-burn, a;nd determination of the products of combustion under different operating conditions

Chemical physics of decomposition of energetic materials. Problems and prospects

International Nuclear Information System (INIS)

Smirnov, Lev P

2004-01-01

The review is concerned with analysis of the results obtained in the kinetic and mechanistic studies on decomposition of energetic materials (explosives, powders and solid propellants). It is shown that the state-of-the art in this field is inadequate to the potential of modern chemical kinetics and chemical physics. Unsolved problems are outlined and ways of their solution are proposed.

A Novel Approach to Detect Accelerated Aged and Surface-Mediated Degradation in Explosives by UPLC-ESI-MS.

Energy Technology Data Exchange (ETDEWEB)

Beppler, Christina L [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

2015-12-01

A new approach was created for studying energetic material degradation. This approach involved detecting and tentatively identifying non-volatile chemical species by liquid chromatography-mass spectrometry (LC-MS) with multivariate statistical data analysis that form as the CL-20 energetic material thermally degraded. Multivariate data analysis showed clear separation and clustering of samples based on sample group: either pristine or aged material. Further analysis showed counter-clockwise trends in the principal components analysis (PCA), a type of multivariate data analysis, Scores plots. These trends may indicate that there was a discrete shift in the chemical markers as the went from pristine to aged material, and then again when the aged CL-20 mixed with a potentially incompatible material was thermally aged for 4, 6, or 9 months. This new approach to studying energetic material degradation should provide greater knowledge of potential degradation markers in these materials.

20 Years of ClO Measurements in the Antarctic Lower Stratosphere

Science.gov (United States)

Nedoluha, Gerald E.; Connor, Brian J.; Mooney, Thomas; Barrett, James W.; Parrish, Alan; Gomez, R. Michael; Boyd, Ian; Allen, Douglas R.; Kotkamp, Michael; Kremser, Stefanie;

Energetics Conditioning Facility

Data.gov (United States)

Federal Laboratory Consortium — The Energetics Conditioning Facility is used for long term and short term aging studies of energetic materials. The facility has 10 conditioning chambers of which 2...

Theoretical study of energetic interactions between high temperature molten materials and a low temperature fluid

International Nuclear Information System (INIS)

Chen, S.H.H.

1984-01-01

Analytical models are developed to predict the hydrodynamical transients resulting from the energetic interactions between a high temperature molten material and a low temperature liquid coolant. Initially, the molten material at high temperature and pressure is separated from the low temperature fluid by a solid metal barrier. Upon contact between the molten material and solid barrier, thermal attack occurs eventually resulting in a loss of barrier integrity. Subsequently, the molten material is injected into the liquid pool resulting in energetic interactions. The analytical models integrate a wide variety of potentially mutually-interacting transport phenomena which dominate the transient process into a deterministic scheme to predict the hydrodynamic transient process into a deterministic scheme to predict the hydrodynamic transient process. The model calculations are compared with the existing experimental results to show its engineering accuracy and adequacy in predicting such energetic interactions. Two models are formulated to bracket the transport of molten material to the rupture site for the reactor system. The stratified model minimized the rate of transport of material to the break location while the dispersed model maximized such transport. These two models are applied to a reference pressure tube reactor to evaluate the pressure transients and the potential structural damages as a result of a postulated severe primary coolant blockage in a power channel

Surface Thermometry of Energetic Materials by Laser-Induced Fluorescence

Science.gov (United States)

1989-09-01

at 34 yttrium- aluminum -garnet (Dy:YAG). The simplified energy diagram of Dy:YAG is shown in Fig. 1. Absorbed laser light (at 355 nrm) can 5 excite the...the thermometric technique on a surface similar to that of an energetic material, a thermal-setting plastic supplied by Buehler, Ltd., was employed...temperature over the temperature range of interest. The rare-earth ion dysprosium (Dy) doped into a yttrium- aluminum -garnet (YAG) crystal was I determined

Electrostatic interactions for directed assembly of high performance nanostructured energetic materials of Al/Fe2O3/multi-walled carbon nanotube (MWCNT)

International Nuclear Information System (INIS)

Zhang, Tianfu; Ma, Zhuang; Li, Guoping; Wang, Zhen; Zhao, Benbo; Luo, Yunjun

2016-01-01

Electrostatic self-assembly in organic solvent without intensively oxidative or corrosive environments, was adopted to prepare Al/Fe 2 O 3 /MWCNT nanostructured energetic materials as an energy generating material. The negatively charged MWCNT was used as a glue-like agent to direct the self-assembly of the well dispersed positively charged Al (fuel) and Fe 2 O 3 (oxide) nanoparticles. This spontaneous assembly method without any surfactant chemistry or other chemical and biological moieties decreased the aggregation of the same nanoparticles largely, moreover, the poor interfacial contact between the Al (fuel) and Fe 2 O 3 (oxide) nanoparticles was improved significantly, which was the key characteristic of high performance nanostructured energetic materials. In addition, the assembly process was confirmed as Diffusion-Limited Aggregation. The assembled Al/Fe 2 O 3 /MWCNT nanostructured energetic materials showed excellent performance with heat release of 2400 J/g, peak pressure of 0.42 MPa and pressurization rate of 105.71 MPa/s, superior to that in the control group Al/Fe 2 O 3 nanostructured energetic materials prepared by sonication with heat release of 1326 J/g, peak pressure of 0.19 MPa and pressurization rate of 33.33 MPa/s. Therefore, the approach, which is facile, opens a promising route to the high performance nanostructured energetic materials. - Graphical abstract: The negatively charged MWCNT was used as a glue-like agent to direct the self-assembly of the well dispersed positively charged Al (fuel) and Fe 2 O 3 (oxide) nanoparticles. - Highlights: • A facile spontaneous electrostatic assembly strategy without surfactant was adopted. • The fuels and oxidizers assembled into densely packed nanostructured composites. • The assembled nanostructured energetic materials have excellent performance. • This high performance energetic material can be scaled up for practical application. • This strategy can be applied into other nanostructured

Prospective Symbiosis of Green Chemistry and Energetic Materials.

Science.gov (United States)

Kuchurov, Ilya V; Zharkov, Mikhail N; Fershtat, Leonid L; Makhova, Nina N; Zlotin, Sergey G

2017-10-23

A global increase in environmental pollution demands the development of new "cleaner" chemical processes. Among urgent improvements, the replacement of traditional hydrocarbon-derived toxic organic solvents with neoteric solvents less harmful for the environment is one of the most vital issues. As a result of the favorable combination of their unique properties, ionic liquids (ILs), dense gases, and supercritical fluids (SCFs) have gained considerable attention as suitable green chemistry media for the preparation and modification of important chemical compounds and materials. In particular, they have a significant potential in a specific and very important area of research associated with the manufacture and processing of high-energy materials (HEMs). These large-scale manufacturing processes, in which hazardous chemicals and extreme conditions are used, produce a huge amount of hard-to-dispose-of waste. Furthermore, they are risky to staff, and any improvements that would reduce the fire and explosion risks of the corresponding processes are highly desirable. In this Review, useful applications of almost nonflammable ILs, dense gases, and SCFs (first of all, CO 2 ) for nitration and other reactions used for manufacturing HEMs are considered. Recent advances in the field of energetic (oxygen-balanced and hypergolic) ILs are summarized. Significant attention is paid to the SCF-based micronization techniques, which improve the energetic performance of HEMs through an efficient control of the morphology and particle size distribution of the HEM fine particles, and to useful applications of SCFs in HEM processing that makes them less hazardous. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Analysis of CL-20 in Environmental Matrices: Water and Soil

National Research Council Canada - National Science Library

Larson, Steven

2001-01-01

... technologies for the treatment of contaminated soils and waters. Analytical techniques for the detection of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazatetracyclo5 .5.0.05,9.03,11dodecane (CL-20...

20 years of ClO measurements in the Antarctic lower stratosphere

Science.gov (United States)

Nedoluha, Gerald E.; Connor, Brian J.; Mooney, Thomas; Barrett, James W.; Parrish, Alan; Gomez, R. Michael; Boyd, Ian; Allen, Douglas R.; Kotkamp, Michael; Kremser, Stefanie; Deshler, Terry; Newman, Paul; Santee, Michelle L.

2016-08-01

We present 20 years (1996-2015) of austral springtime measurements of chlorine monoxide (ClO) over Antarctica from the Chlorine Oxide Experiment (ChlOE1) ground-based millimeter wave spectrometer at Scott Base, Antarctica, as well 12 years (2004-2015) of ClO measurements from the Aura Microwave Limb Sounder (MLS). From August onwards we observe a strong increase in lower stratospheric ClO, with a peak column amount usually occurring in early September. From mid-September onwards we observe a strong decrease in ClO. In order to study interannual differences, we focus on a 3-week period from 28 August to 17 September for each year and compare the average column ClO anomalies. These column ClO anomalies are shown to be highly correlated with the average ozone mass deficit for September and October of each year. We also show that anomalies in column ClO are strongly anti-correlated with 30 hPa temperature anomalies, both on a daily and an interannual timescale. Making use of this anti-correlation we calculate the linear dependence of the interannual variations in column ClO on interannual variations in temperature. By making use of this relationship, we can better estimate the underlying trend in the total chlorine (Cly = HCl + ClONO2 + HOCl + 2 × Cl2 + 2 × Cl2O2 + ClO + Cl). The resultant trends in Cly, which determine the long-term trend in ClO, are estimated to be -0.5 ± 0.2, -1.4 ± 0.9, and -0.6 ± 0.4 % year-1, for zonal MLS, Scott Base MLS (both 2004-2015), and ChlOE (1996-2015) respectively. These trends are within 1σ of trends in stratospheric Cly previously found at other latitudes. The decrease in ClO is consistent with the trend expected from regulations enacted under the Montreal Protocol.

Enzymes for Degradation of Energetic Materials and Demilitarization of Explosives Stockpiles - SERDP Annual (Interim) Report, 12/98

Energy Technology Data Exchange (ETDEWEB)

Shah, M.M.

1999-01-18

The current stockpile of energetic materials requiring disposal contains about half a million tons. Through 2001, over 2.1 million tons are expected to pass through the stockpile for disposal. Safe and environmentally acceptable methods for disposing of these materials are needed. This project is developing safe, economical, and environmentally sound processes using biocatalyst (enzymes) to degrade energetic materials and to convert them into economically valuable products. Alternative methods for destroying these materials are hazardous, environmentally unacceptable, and expensive. These methods include burning, detonation, land and sea burial, treatment at high temperature and pressure, and treatment with harsh chemicals. Enzyme treatment operates at room temperature and atmospheric pressure in a water solution.

2009 Insensitive Munitions and Energetic Materials Technology Symposium

Science.gov (United States)

2009-05-14

Government Civilian (Non-DOD/MOD) u Trade/Professional Assn. u Educator /Academia u Professional Services u Non-Defense Business u Other...synthesis; Available starting materials; Not yet commercialised Initial selection refined to 5, subsequently 3 candidates: • Oxadiazole (CL-14); hexahydro...is an integral part of OSD’s Educational Outreach Program in providing an ongoing source of scientific and engineering talent for government R&D labs

Insensitive high-energy energetic structural material of tungsten-polytetrafluoroethylene-aluminum composites

Directory of Open Access Journals (Sweden)

Liu Wang

2015-11-01

Full Text Available Energetic structural material is a kind of materials that are inert under normal conditions but could produce exothermic chemical reaction when subjected to impact. This report shows a kind of energetic structural material of tungsten (W-polytetrafluoroethylene (PTFE-aluminum (Al with density of 4.12 g/cm3, excellent ductility and dynamic compressive strength of 96 MPa. Moreover, 50W-35PTFE-15Al (wt% can exhibit a high reaction energy value of more than 2 times of TNT per unit mass and 5 times of TNT per unit volume, respectively, but with excellent insensitivity compared with traditional explosives. Under thermal conditions, the W-PTFE-Al composite can keep stable at 773 K. Under impact loading, when the strain rate up to ∼4820 s−1 coupled with the absorbed energy per unit volume of 120 J/cm3, deflagration occurs and combustion lasts for 500 μs. During impact compressive deformation, the PTFE matrix is elongated into nano-fibers, thus significantly increases the reaction activity of W-PTFE-Al composites. The nano-fiber structure is necessary for the reaction of W-PTFE-Al composites. The formation of PTFE nano-fibers must undergo severe plastic deformation, and therefore the W-PTFE-Al composites exhibit excellent insensitivity and safety. Furthermore, the reaction mechanisms of W-PTFE-Al composites in argon and in air are revealed.

Energetics of the interaction of the antitumour agent titanocene dichloride with glycine: enthalpy of formation of [Ti(η5-C5H5)2(OOCCH2NH3)2]Cl2

International Nuclear Information System (INIS)

Nunes, Paulo M.; Minas da Piedade, Manuel E.

2004-01-01

The standard molar enthalpy of formation of [Ti(η 5 -C 5 H 5 ) 2 (OOCCH 2 NH 3 ) 2 ]Cl 2 in the crystalline state, at T=298.15 K, was determined as Δ f H m 0 {[Ti(η 5 -C 5 H 5 ) 2 (OOCCH 2 NH 3 ) 2 ]Cl 2 , cr}=-(1447.6 ± 8.1) kJ · mol -1 , by reaction-solution calorimetry. A discussion of the energetics of the direct interaction of the antitumour agent Ti(η 5 -C 5 H 5 ) 2 Cl 2 with glycine is also presented

Papers of 5. Scientific-Technical Seminar: Material Study for Electric Power Stations and Energetics

International Nuclear Information System (INIS)

1998-01-01

The review of material research designed for energetic use has been done. The special emphasis have been put on the steels and alloys with desirable mechanical and corrosion properties in high temperature and pressure conditions. The methods for testing and non-destructive diagnostics of materials and welded joints have been also presented and discussed

20 years of ClO measurements in the Antarctic lower stratosphere

Directory of Open Access Journals (Sweden)

G. E. Nedoluha

2016-08-01

Full Text Available We present 20 years (1996–2015 of austral springtime measurements of chlorine monoxide (ClO over Antarctica from the Chlorine Oxide Experiment (ChlOE1 ground-based millimeter wave spectrometer at Scott Base, Antarctica, as well 12 years (2004–2015 of ClO measurements from the Aura Microwave Limb Sounder (MLS. From August onwards we observe a strong increase in lower stratospheric ClO, with a peak column amount usually occurring in early September. From mid-September onwards we observe a strong decrease in ClO. In order to study interannual differences, we focus on a 3-week period from 28 August to 17 September for each year and compare the average column ClO anomalies. These column ClO anomalies are shown to be highly correlated with the average ozone mass deficit for September and October of each year. We also show that anomalies in column ClO are strongly anti-correlated with 30 hPa temperature anomalies, both on a daily and an interannual timescale. Making use of this anti-correlation we calculate the linear dependence of the interannual variations in column ClO on interannual variations in temperature. By making use of this relationship, we can better estimate the underlying trend in the total chlorine (Cly  =  HCl + ClONO2 + HOCl + 2  ×  Cl2 + 2  ×  Cl2O2 + ClO + Cl. The resultant trends in Cly, which determine the long-term trend in ClO, are estimated to be −0.5 ± 0.2, −1.4 ± 0.9, and −0.6 ± 0.4 % year−1, for zonal MLS, Scott Base MLS (both 2004–2015, and ChlOE (1996–2015 respectively. These trends are within 1σ of trends in stratospheric Cly previously found at other latitudes. The decrease in ClO is consistent with the trend expected from regulations enacted under the Montreal Protocol.

Construct 3D porous hollow Co3O4 micro-sphere: A potential oxidizer of nano-energetic materials with superior reactivity

Science.gov (United States)

Wang, Jun; Zheng, Bo; Qiao, Zhiqiang; Chen, Jin; Zhang, Liyuan; Zhang, Long; Li, Zhaoqian; Zhang, Xingquan; Yang, Guangcheng

2018-06-01

High energy density and rapid reactivity are the future trend for nano-energetic materials. Energetic performance of nano-energetic materials depends on the interfacial diffusion and mass transfer during the reacted process. However, the development of desired structure to significantly enhance reactivity still remains challenging. Here we focused on the design and preparation of 3D porous hollow Co3O4 micro-spheres, in which gas-blowing agents (air) and maximize interfacial interactions were introduced to enhance mass transport and reduce the diffusion distance between the oxidizer and fuel (Aluminum). The 3D hierarchical Co3O4/Al based nano-energetic materials show a low-onset decomposition temperature (423 °C), and high heat output (3118 J g-1) resulting from porous and hollow nano-structure of Co3O4 micro-spheres. Furthermore, 3D hierarchical Co3O4/Al arrays were directly fabricated on the silicon substrate, which was fully compatible with silicon-based microelectromechanical systems to achieve functional nanoenergetics-on-a-chip. This approach provides a simple and efficient way to fabricate 3D ordered nano-energetic arrays with superior reactivity and the potential on the application in micro-energetic devices.

Fizičko-hemijske i detonacione karakteristike nitraminskih eksploziva - RDX, HMX i CL-20

OpenAIRE

Anđelković-Lukić Mirjana

2002-01-01

U radu su prikazane fizičko-hemijske i detonacione karakteristike nitraminskih brizantnih eksploziva, heksogena i oktogena, uporedene sa osobinama novog cikličnog nitraminskog eksploziva CL-20. Novi visokobrizantni eksploziv CL-20 postoji u četiri kristalne forme, stabilne na različitim temepraturama. Ima bolje detonacione karakteristike od heksogena i oktogena veću gustinu i brzinu detonacije, all mnogo veću osetljivost na udar i trenje, reda PETN. Zbog toga se ovaj eksploziv flegmatizuje sa...

Extended VHE γ-ray emission towards SGR1806-20, LBV 1806-20, and stellar cluster Cl* 1806-20

Science.gov (United States)

H.E.S.S. Collaboration; Abdalla, H.; Abramowski, A.; Aharonian, F.; Ait Benkhali, F.; Akhperjanian, A. G.; Angüner, E. O.; Arrieta, M.; Aubert, P.; Backes, M.; Balzer, A.; Barnard, M.; Becherini, Y.; Becker Tjus, J.; Berge, D.; Bernhard, S.; Bernlöhr, K.; Birsin, E.; Blackwell, R.; Böttcher, M.; Boisson, C.; Bolmont, J.; Bordas, P.; Bregeon, J.; Brun, F.; Brun, P.; Bryan, M.; Bulik, T.; Capasso, M.; Carr, J.; Casanova, S.; Chakraborty, N.; Chalme-Calvet, R.; Chaves, R. C. G.; Chen, A.; Chevalier, J.; Chrétien, M.; Colafrancesco, S.; Cologna, G.; Condon, B.; Conrad, J.; Couturier, C.; Cui, Y.; Davids, I. D.; Degrange, B.; Deil, C.; deWilt, P.; Djannati-Ataï, A.; Domainko, W.; Donath, A.; Drury, L. O.'C.; Dubus, G.; Dutson, K.; Dyks, J.; Dyrda, M.; Edwards, T.; Egberts, K.; Eger, P.; Ernenwein, J.-P.; Eschbach, S.; Farnier, C.; Fegan, S.; Fernandes, M. V.; Fiasson, A.; Fontaine, G.; Förster, A.; Funk, S.; Füßling, M.; Gabici, S.; Gajdus, M.; Gallant, Y. A.; Garrigoux, T.; Giavitto, G.; Giebels, B.; Glicenstein, J. F.; Gottschall, D.; Goyal, A.; Grondin, M.-H.; Grudzińska, M.; Hadasch, D.; Hahn, J.; Hawkes, J.; Heinzelmann, G.; Henri, G.; Hermann, G.; Hervet, O.; Hillert, A.; Hinton, J. A.; Hofmann, W.; Hoischen, C.; Holler, M.; Horns, D.; Ivascenko, A.; Jacholkowska, A.; Jamrozy, M.; Janiak, M.; Jankowsky, D.; Jankowsky, F.; Jingo, M.; Jogler, T.; Jouvin, L.; Jung-Richardt, I.; Kastendieck, M. A.; Katarzyński, K.; Katz, U.; Kerszberg, D.; Khélifi, B.; Kieffer, M.; King, J.; Klepser, S.; Klochkov, D.; Kluźniak, W.; Kolitzus, D.; Komin, Nu.; Kosack, K.; Krakau, S.; Kraus, M.; Krayzel, F.; Krüger, P. P.; Laffon, H.; Lamanna, G.; Lau, J.; Lees, J.-P.; Lefaucheur, J.; Lefranc, V.; Lemière, A.; Lemoine-Goumard, M.; Lenain, J.-P.; Leser, E.; Lohse, T.; Lorentz, M.; Liu, R.; Lypova, I.; Marandon, V.; Marcowith, A.; Mariaud, C.; Marx, R.; Maurin, G.; Maxted, N.; Mayer, M.; Meintjes, P. J.; Menzler, U.; Meyer, M.; Mitchell, A. M. W.; Moderski, R.; Mohamed, M.; Morå, K.; Moulin, E.; Murach, T.; de Naurois, M.; Niederwanger, F.; Niemiec, J.; Oakes, L.; Odaka, H.; Öttl, S.; Ohm, S.; Ostrowski, M.; Oya, I.; Padovani, M.; Panter, M.; Parsons, R. D.; Paz Arribas, M.; Pekeur, N. W.; Pelletier, G.; Petrucci, P.-O.; Peyaud, B.; Pita, S.; Poon, H.; Prokhorov, D.; Prokoph, H.; Pühlhofer, G.; Punch, M.; Quirrenbach, A.; Raab, S.; Reimer, A.; Reimer, O.; Renaud, M.; de Reyes, R.; Rieger, F.; Romoli, C.; Rosier-Lees, S.; Rowell, G.; Rudak, B.; Rulten, C. B.; Sahakian, V.; Salek, D.; Sanchez, D. A.; Santangelo, A.; Sasaki, M.; Schlickeiser, R.; Schüssler, F.; Schulz, A.; Schwanke, U.; Schwemmer, S.; Seyffert, A. S.; Shafi, N.; Shilon, I.; Simoni, R.; Sol, H.; Spanier, F.; Spengler, G.; Spies, F.; Stawarz, Ł.; Steenkamp, R.; Stegmann, C.; Stinzing, F.; Stycz, K.; Sushch, I.; Tavernet, J.-P.; Tavernier, T.; Taylor, A. M.; Terrier, R.; Tluczykont, M.; Trichard, C.; Tuffs, R.; van der Walt, J.; van Eldik, C.; van Soelen, B.; Vasileiadis, G.; Veh, J.; Venter, C.; Viana, A.; Vincent, P.; Vink, J.; Voisin, F.; Völk, H. J.; Vuillaume, T.; Wadiasingh, Z.; Wagner, S. J.; Wagner, P.; Wagner, R. M.; White, R.; Wierzcholska, A.; Willmann, P.; Wörnlein, A.; Wouters, D.; Yang, R.; Zabalza, V.; Zaborov, D.; Zacharias, M.; Zdziarski, A. A.; Zech, A.; Zefi, F.; Ziegler, A.; Żywucka, N.

2018-04-01

Using the High Energy Spectroscopic System (H.E.S.S.) telescopes we have discovered a steady and extended very high-energy (VHE) γ-ray source towards the luminous blue variable candidate LBV 1806-20, massive stellar cluster Cl* 1806-20, and magnetar SGR 1806-20. The new VHE source, HESS J1808-204, was detected at a statistical significance of >6σ (post-trial) with a photon flux normalisation (2.9 ± 0.4stat ± 0.5sys) × 10-13 ph cm-2 s-1 TeV-1 at 1 TeV and a power-law photon index of 2.3 ± 0.2stat ± 0.3sys. The luminosity of this source (0.2 to 10 TeV; scaled to distance d = 8.7 kpc) is LVHE 1.6 × 1034(d/8.7 kpc)2 erg s-1. The VHE γ-ray emission is extended and is well fit by a single Gaussian with statistical standard deviation of 0.095° ± 0.015°. This extension is similar to that of the synchrotron radio nebula G10.0-0.3, which is thought to be powered by LBV 1806-20. The VHE γ-ray luminosity could be provided by the stellar wind luminosity of LBV 1806-20 by itself and/or the massive star members of Cl* 1806-20. Alternatively, magnetic dissipation (e.g. via reconnection) from SGR 1806-20 can potentially account for the VHE luminosity. The origin and hadronic and/or leptonic nature of the accelerated particles responsible for HESS J1808-204 is not yet clear. If associated with SGR 1806-20, the potentially young age of the magnetar (650 yr) can be used to infer the transport limits of these particles to match the VHE source size. This discovery provides new interest in the potential for high-energy particle acceleration from magnetars, massive stars, and/or stellar clusters.

Stable isotope analyses of oxygen (18O:17O:16O) and chlorine (37Cl:35Cl) in perchlorate: reference materials, calibrations, methods, and interferences

Science.gov (United States)

Böhlke, John Karl; Mroczkowski, Stanley J.; Sturchio, Neil C.; Heraty, Linnea J.; Richman, Kent W.; Sullivan, Donald B.; Griffith, Kris N.; Gu, Baohua; Hatzinger, Paul B.

2017-01-01

RationalePerchlorate (ClO4−) is a common trace constituent of water, soils, and plants; it has both natural and synthetic sources and is subject to biodegradation. The stable isotope ratios of Cl and O provide three independent quantities for ClO4− source attribution and natural attenuation studies: δ37Cl, δ18O, and δ17O (or Δ17O or 17Δ) values. Documented reference materials, calibration schemes, methods, and interferences will improve the reliability of such studies.MethodsThree large batches of KClO4 with contrasting isotopic compositions were synthesized and analyzed against VSMOW-SLAP, atmospheric O2, and international nitrate and chloride reference materials. Three analytical methods were tested for O isotopes: conversion of ClO4− to CO for continuous-flow IRMS (CO-CFIRMS), decomposition to O2 for dual-inlet IRMS (O2-DIIRMS), and decomposition to O2 with molecular-sieve trap (O2-DIIRMS+T). For Cl isotopes, KCl produced by thermal decomposition of KClO4 was reprecipitated as AgCl and converted into CH3Cl for DIIRMS.ResultsKClO4 isotopic reference materials (USGS37, USGS38, USGS39) represent a wide range of Cl and O isotopic compositions, including non-mass-dependent O isotopic variation. Isotopic fractionation and exchange can affect O isotope analyses of ClO4− depending on the decomposition method. Routine analyses can be adjusted for such effects by normalization, using reference materials prepared and analyzed as samples. Analytical errors caused by SO42−, NO3−, ReO42−, and C-bearing contaminants include isotope mixing and fractionation effects on CO and O2, plus direct interference from CO2 in the mass spectrometer. The results highlight the importance of effective purification of ClO4− from environmental samples.ConclusionsKClO4 reference materials are available for testing methods and calibrating isotopic data for ClO4− and other substances with widely varying Cl or O isotopic compositions. Current ClO4−extraction, purification

Environmentally benign destruction of waste energetic materials (EMs)

International Nuclear Information System (INIS)

Schneider, R. L.; Donahue, B. A.

1998-01-01

Studies by the U. S. Army Corps of Engineers during 1991-1997 involving various methods for the destruction of waste generated by pyrotechnic, explosive and propellant materials are described. The methods assessed and evaluated include controlled incineration (CI), wet air oxidation (WAO), and hydrothermal oxidation (HTO), using a U.S. Army triple-base propellant as the initial common standard for all destructor comparative testing. All three of these methods has special feed line restrictions requiring mechanical diminution and comminution of the energetic material which, for safety reasons, cannot be used with contaminated heterogeneous production wastes. Supercritical fluid extraction with carbon dioxide, alkaline hydrolysis, electrolysis and fluid cutting with very high pressure water jets and liquid nitrogen are alternate technologies that were evaluated as pre-treatment for production wastes. Wet air oxidation and electrochemical reduction studies were conducted using the U.S. Navy double propellant NOSIH-AA2, which contains a lead-based ballistic modifier. Wet air oxidation and hydrothermal oxidation studies were done using potassium dinitramide phase-stabilized nitrate as an oxidizer. All of these technologies are considered to be suitable for the environmentally benign destruction of pyrotechnic materials, including fireworks. 17 refs., 8 tabs., 4 figs

Electrostatic interactions for directed assembly of high performance nanostructured energetic materials of Al/Fe{sub 2}O{sub 3}/multi-walled carbon nanotube (MWCNT)

Energy Technology Data Exchange (ETDEWEB)

Zhang, Tianfu; Ma, Zhuang; Li, Guoping; Wang, Zhen; Zhao, Benbo; Luo, Yunjun, E-mail: yjluo@bit.edu.cn

2016-05-15

Electrostatic self-assembly in organic solvent without intensively oxidative or corrosive environments, was adopted to prepare Al/Fe{sub 2}O{sub 3}/MWCNT nanostructured energetic materials as an energy generating material. The negatively charged MWCNT was used as a glue-like agent to direct the self-assembly of the well dispersed positively charged Al (fuel) and Fe{sub 2}O{sub 3} (oxide) nanoparticles. This spontaneous assembly method without any surfactant chemistry or other chemical and biological moieties decreased the aggregation of the same nanoparticles largely, moreover, the poor interfacial contact between the Al (fuel) and Fe{sub 2}O{sub 3} (oxide) nanoparticles was improved significantly, which was the key characteristic of high performance nanostructured energetic materials. In addition, the assembly process was confirmed as Diffusion-Limited Aggregation. The assembled Al/Fe{sub 2}O{sub 3}/MWCNT nanostructured energetic materials showed excellent performance with heat release of 2400 J/g, peak pressure of 0.42 MPa and pressurization rate of 105.71 MPa/s, superior to that in the control group Al/Fe{sub 2}O{sub 3} nanostructured energetic materials prepared by sonication with heat release of 1326 J/g, peak pressure of 0.19 MPa and pressurization rate of 33.33 MPa/s. Therefore, the approach, which is facile, opens a promising route to the high performance nanostructured energetic materials. - Graphical abstract: The negatively charged MWCNT was used as a glue-like agent to direct the self-assembly of the well dispersed positively charged Al (fuel) and Fe{sub 2}O{sub 3} (oxide) nanoparticles. - Highlights: • A facile spontaneous electrostatic assembly strategy without surfactant was adopted. • The fuels and oxidizers assembled into densely packed nanostructured composites. • The assembled nanostructured energetic materials have excellent performance. • This high performance energetic material can be scaled up for practical application. • This

Stereo-specificity for pro-(R) hydrogen of NAD(P)H during enzyme-catalyzed hydride transfer to CL-20

International Nuclear Information System (INIS)

Bhushan, Bharat; Halasz, Annamaria; Hawari, Jalal

2005-01-01

A dehydrogenase from Clostridium sp. EDB2 and a diaphorase from Clostridium kluyveri were reacted with CL-20 to gain insights into the enzyme-catalyzed hydride transfer to CL-20, and the enzyme's stereo-specificity for either pro-R or pro-S hydrogens of NAD(P)H. Both enzymes biotransformed CL-20 at rates of 18.5 and 24 nmol/h/mg protein, using NADH and NADPH as hydride-source, respectively, to produce a N-denitrohydrogenated product with a molecular weight of 393 Da. In enzyme kinetics studies using reduced deuterated pyridine nucleotides, we found a kinetic deuterium isotopic effect of 2-fold on CL-20 biotransformation rate using dehydrogenase enzyme against (R)NADD as a hydride-source compared to either (S)NADD or NADH. Whereas, in case of diaphorase, the kinetic deuterium isotopic effect of about 1.5-fold was observed on CL-20 biotransformation rate using (R)NADPD as hydride-source. In a comparative study with LC-MS, using deuterated and non-deuterated NAD(P)H, we found a positive mass-shift of 1 Da in the N-denitrohydrogenated product suggesting the involvement of a deuteride (D - ) transfer from NAD(P)D. The present study thus revealed that both dehydrogenase and diaphorase enzymes from the two Clostridium species catalyzed a hydride transfer to CL-20 and showed stereo-specificity for pro-R hydrogen of NAD(P)H

Papers of 4. Scientific-Technical Seminar: Material Study for Electric Power Stations and Energetics

International Nuclear Information System (INIS)

1997-01-01

The research on the materials commonly used in electric power stations and energetics have been summarized in the course of the seminar. Especially a different kinds of steels have been investigated from the view point of their desirable mechanical and corrosion properties

A Coupled Damage and Reaction Model for Simulating Energetic Material Response to Impact Hazards

International Nuclear Information System (INIS)

BAER, MELVIN R.; DRUMHELLER, D.S.; MATHESON, E.R.

1999-01-01

The Baer-Nunziato multiphase reactive theory for a granulated bed of energetic material is extended to allow for dynamic damage processes, that generate new surfaces as well as porosity. The Second Law of Thermodynamics is employed to constrain the constitutive forms of the mass, momentum, and energy exchange functions as well as those for the mechanical damage model ensuring that the models will be dissipative. The focus here is on the constitutive forms of the exchange functions. The mechanical constitutive modeling is discussed in a companion paper. The mechanical damage model provides dynamic surface area and porosity information needed by the exchange functions to compute combustion rates and interphase momentum and energy exchange rates. The models are implemented in the CTH shock physics code and used to simulate delayed detonations due to impacts in a bed of granulated energetic material and an undamaged cylindrical sample

Reaction path of energetic materials using THOR code

Science.gov (United States)

Durães, L.; Campos, J.; Portugal, A.

1998-07-01

The method of predicting reaction path, using THOR code, allows for isobar and isochor adiabatic combustion and CJ detonation regimes, the calculation of the composition and thermodynamic properties of reaction products of energetic materials. THOR code assumes the thermodynamic equilibria of all possible products, for the minimum Gibbs free energy, using HL EoS. The code allows the possibility of estimating various sets of reaction products, obtained successively by the decomposition of the original reacting compound, as a function of the released energy. Two case studies of thermal decomposition procedure were selected, calculated and discussed—pure Ammonium Nitrate and its based explosive ANFO, and Nitromethane—because their equivalence ratio is respectively lower, near and greater than the stoicheiometry. Predictions of reaction path are in good correlation with experimental values, proving the validity of proposed method.

Study on penetration-induced initiation of energetic fragment

Science.gov (United States)

Qiao, Xiangxin; Xu, Heyang

2017-09-01

In order to investigate penetration-induced initiation of energetic fragment penetrating target, PTFE/Al (mass ratio 73.5/26.5) pressed and sintered into a Ф8mm × 8mm cylinder. To form energetic fragment, the cylinder was put into a closed container made by 35CrMnSiA. The container is 12mm long, 2mm thick. Energetic fragments were launched by a 14.5mm ballistic gun with a series of velocities and the penetrate process was simulated by AUTODYN-3D. The results show that the stress peak of energetic material exceed the initiation threshold, and energetic material will deflagrate, when energetic fragments impact velocity more than 800 m/s. The research results can provide reference for designs of energetic warhead.

Real time in-situ sensing of damage evolution in nanocomposite bonded surrogate energetic materials

Science.gov (United States)

Sengezer, Engin C.; Seidel, Gary D.

2016-04-01

The current work aims to explore the potential for in-situ structural health monitoring in polymer bonded energetic materials through the introduction of carbon nanotubes (CNTs) into the binder phase as a means to establish a significant piezoresistive response through the resulting nanocomposite binder. The experimental effort herein is focused towards electro-mechanical characterization of surrogate materials in place of actual energetic (explosive) materials in order to provide proof of concept for the strain and damage sensing. The electrical conductivity and the piezoresistive behavior of samples containing randomly oriented MWCNTs introduced into the epoxy (EPON 862) binder of 70 wt% ammonium perchlorate-epoxy hybrid composites are quantitatively and qualitatively evaluated. Brittle failure going through linear elastic behavior, formation of microcracks leading to reduction in composite load carrying capacity and finally macrocracks resulting in eventual failure are observed in the mechanical response of MWNT-ammonium perchlorateepoxy hybrid composites. Incorporating MWNTs into local polymer binder improves the effective stiffness about 40% compared to neat ammonium perchlorate-polymer samples. The real time in-situ relative change in resistance for MWNT hybrid composites was detected with the applied strains through piezoresistive response.

Solubility relations in the ternary system NaCl-CsCl-H2O at 1 atm. 1. Solubilities of halite from 20 to 100 °C

Science.gov (United States)

Chou, I.-Ming; Lee, R.D.

1983-01-01

Solubilities of halite in the ternary system NaCl-CsCl-H2O have been determined by the visual polythermal method at 1 atm from 20 to 100??C along five constant CsCl/(CsCl + H2O) weight ratio lines. These five constant weight ratios are 0.1, 0.2, 0.3, 0.4, and 0.5. The maximum uncertainties in these measurements are ??0.02 wt % NaCl and ??0.15??C. The data along each constant CsCl/(CsCl + H2O) weight ratio line were regressed to a smooth curve. The maximum deviation of the measured solubilities from the smooth curves is 0.06 wt % NaCl. Isothermal solubilities of halite were calculated from smoothed curves at 25, 50, and 75??C.

Evaluation report on CCTF core-I reflood tests Cl-17(Run 36) and Cl-20(Run 39)

International Nuclear Information System (INIS)

Murao, Yoshio; Iguchi, Tadashi

1983-02-01

In the safety analysis of the reflood phase of a PWR LOCA, the core thermo-hydrodynamic behavior is analyzed as a phenomena in a single channel core. In other words, the core thermo-hydrodynamic behavior is treated one-dimensionally. In order to confirm the validity of the one-dimensional treatment, tests named Asymmetric power test Cl-17(Run 36) and Asymmetric temperature test Cl-20(Run 39) were performed, whose test conditions were similar to the base case test Cl-5(Run 14) (the reference test for the parametric effect tests) except for the power distribution and the initial temperature distribution in core, respectively. First the results of the base case test were investigated. And the results of Asymmetric power test and Asymmetric temperature test were compared with the results of the base case test. The main conclusions are as follows: (1) The water accumulation was observed along the whole core even above quench front almost simultaneously just after reflood initiation and almost terminated within 20 to 30 seconds. The flow pattern was recognized as a slug flow. (2) In the lower two-thirds of the core, bottom quench was observed and the core water accumulation was one-dimensional even under the thermally asymmetric conditions. (3) In the upper portion of the core, the multi-dimensional effect was observed, i.e. the top quench occurred locally. (4) The water accumulation behavior or void fraction in the lower two-thirds of the core, i.e. our concerning region for the peak clad temperature analysis, and the core behavior for system analysis can be one-dimensionally analyzed with a representing single channel core. (author)

Preparation and Characterization of cis- and trans-[Ir(tn)2Cl2]CF3SO3 and of [Ir(tn)3]Cl3 (tn=propane-1,3-diamine)

DEFF Research Database (Denmark)

Brorson, Michael; Galsbøl, Frode; Simonsen, Kim

1998-01-01

for the preparation of [Rh(tn)3]Cl3 in quantitative yield from Rh(thtp)3Cl3 is also given. The complexes were characterized by 1H and 13C NMR and by UV/VIS spectroscopy. The conformation of the six-membered chelate rings of [Ir(tn)3]3+ in the solid state was determined by single-crystal X-ray diffraction of [Ir(tn)3......Procedures are given for the preparation and isolation of cis- and trans-[Ir(tn)2Cl2]CF3SO3 and of [Ir(tn)3]Cl3, (tn=propane-1,3-diamine). The compounds were prepared by the use of Ir(thtp)3Cl3 (thtp=tetrahydrothiophene) as starting material, using either DMSO or neat tn as solvent. A procedure......] [Co(CN)6] x 5H2O. The three chelate rings all adopt the energetically favoured chair conformation; however, the overall idealized symmetry is C1. A comparative ligand field analysis, based on Gaussian resolution of the solution UV/VIS spectra for a number of homoleptic [M(N6)]3+ (M=CoIII, RhIII, Ir...

Experimental studies on cycling stable characteristics of inorganic phase change material CaCl2·6H2O-MgCl2·6H2O modified with SrCl2·6H2O and CMC

Science.gov (United States)

He, Meizhi; Yang, Luwei; Zhang, Zhentao

2018-01-01

By means of mass ratio method, binary eutectic hydrated salts inorganic phase change thermal energy storage system CaCl2·6H2O-20wt% MgCl2·6H2O was prepared, and through adding nucleating agent 1wt% SrCl2·6H2O and thickening agent 0.5wt% carboxy methyl cellulose (CMC), inoganic phase change material (PCM) modified was obtained. With recording cooling-melting curves simultaneously, this PCM was frozen and melted for 100 cycles under programmable temperature control. After per 10 cycles, the PCM was charaterized by differential scanning calorimeter (DSC), X-ray diffraction (XRD) and density meter, then analysing variation characteristics of phase change temperature, supercooling degree, superheat degree, latent heat, crystal structure and density with the increase of cycle index. The results showed that the average values of average phase change temperature for cooling and heating process were 25.70°C and 27.39°C respectively with small changes. The average values of average supercooling and superheat degree were 0.59°C and 0.49°C respectively, and the maximum value was 1.10°C. The average value and standard deviation of latent heat of fusion were 120.62 J/g and 1.90 J/g respectively. Non-molten white solid sediments resulted from phase separation were tachyhydrite (CaMg2Cl6·12H2O), which was characterized by XRD. Measuring density of the PCM after per 10 cycles, and the results suggested that the total mass of tachyhydrite was limited. In summary, such modified inoganic PCM CaCl2·6H2O-20wt% MgCl2·6H2O-1wt% SrCl2·6H2O-0.5wt% CMC could stay excellent circulation stability within 100 cycles, and providing reference value in practical use.

Molecular Modeling of Energetic Materials: The Parameterization and Validation of Nitrate Esters in the COMPASS Force Field

National Research Council Canada - National Science Library

Bunte, Steven

2000-01-01

To investigate the mechanical and other condensed phase properties of energetic materials using atomistic simulation techniques, the COMPASS force field has been expanded to include high-energy nitro functional groups...

Large-Scale Reactive Atomistic Simulation of Shock-induced Initiation Processes in Energetic Materials

Science.gov (United States)

Thompson, Aidan

2013-06-01

Initiation in energetic materials is fundamentally dependent on the interaction between a host of complex chemical and mechanical processes, occurring on scales ranging from intramolecular vibrations through molecular crystal plasticity up to hydrodynamic phenomena at the mesoscale. A variety of methods (e.g. quantum electronic structure methods (QM), non-reactive classical molecular dynamics (MD), mesoscopic continuum mechanics) exist to study processes occurring on each of these scales in isolation, but cannot describe how these processes interact with each other. In contrast, the ReaxFF reactive force field, implemented in the LAMMPS parallel MD code, allows us to routinely perform multimillion-atom reactive MD simulations of shock-induced initiation in a variety of energetic materials. This is done either by explicitly driving a shock-wave through the structure (NEMD) or by imposing thermodynamic constraints on the collective dynamics of the simulation cell e.g. using the Multiscale Shock Technique (MSST). These MD simulations allow us to directly observe how energy is transferred from the shockwave into other processes, including intramolecular vibrational modes, plastic deformation of the crystal, and hydrodynamic jetting at interfaces. These processes in turn cause thermal excitation of chemical bonds leading to initial chemical reactions, and ultimately to exothermic formation of product species. Results will be presented on the application of this approach to several important energetic materials, including pentaerythritol tetranitrate (PETN) and ammonium nitrate/fuel oil (ANFO). In both cases, we validate the ReaxFF parameterizations against QM and experimental data. For PETN, we observe initiation occurring via different chemical pathways, depending on the shock direction. For PETN containing spherical voids, we observe enhanced sensitivity due to jetting, void collapse, and hotspot formation, with sensitivity increasing with void size. For ANFO, we

Data on trapping and re-emission of energetic hydrogen isotopes and helium in materials, supplement 1

International Nuclear Information System (INIS)

Yamaguchi, Sadae; Sugizaki, Yasuaki; Ozawa, Kunio; Nakai, Yohta.

1984-05-01

This is the supplement to the data on trapping and re-emission of energetic hydrogen isotopes and helium in materials (JAERI-M 82-118). It contains 32 data up to end of 1982, dividing it into following 6 sections: 1) Dose Dependence, 2) Target Material Dependence, 3) Target Temperature Dependence, 4) Incident Energy Dependence, 5) Damage Effects and 6) Ion-Induced Release. (author)

Experimental Investigation of the Role of Defects in Detonation Sensitivity of Energetic Materials: Development of Techniques for Characterization

Science.gov (United States)

2009-12-31

materials. The initial work was focused on design and construction of an apparatus for injecting defects into the crystals using PZT ceramics ...in the energy partitioning (Table 2), which offers some insight into the nature of the energetic texture of crystalline materials not apparent in

Hot spots in energetic materials generated by infrared and ultrasound, detected by thermal imaging microscopy.

Science.gov (United States)

Chen, Ming-Wei; You, Sizhu; Suslick, Kenneth S; Dlott, Dana D

2014-02-01

We have observed and characterized hot spot formation and hot-spot ignition of energetic materials (EM), where hot spots were created by ultrasonic or long-wavelength infrared (LWIR) exposure, and were detected by high-speed thermal microscopy. The microscope had 15-20 μm spatial resolution and 8.3 ms temporal resolution. LWIR was generated by a CO2 laser (tunable near 10.6 μm or 28.3 THz) and ultrasound by a 20 kHz acoustic horn. Both methods of energy input created spatially homogeneous energy fields, allowing hot spots to develop spontaneously due to the microstructure of the sample materials. We observed formation of hot spots which grew and caused the EM to ignite. The EM studied here consisted of composite solids with 1,3,5-trinitroperhydro-1,3,5-triazine crystals and polymer binders. EM simulants based on sucrose crystals in binders were also examined. The mechanisms of hot spot generation were different with LWIR and ultrasound. With LWIR, hot spots were most efficiently generated within the EM crystals at LWIR wavelengths having longer absorption depths of ∼25 μm, suggesting that hot spot generation mechanisms involved localized absorbing defects within the crystals, LWIR focusing in the crystals or LWIR interference in the crystals. With ultrasound, hot spots were primarily generated in regions of the polymer binder immediately adjacent to crystal surfaces, rather than inside the EM crystals.

Modeling of high energy laser ignition of energetic materials

International Nuclear Information System (INIS)

Lee, Kyung-cheol; Kim, Ki-hong; Yoh, Jack J.

2008-01-01

We present a model for simulating high energy laser heating and ignition of confined energetic materials. The model considers the effect of irradiating a steel plate with long laser pulses and continuous lasers of several kilowatts and the thermal response of well-characterized high explosives for ignition. Since there is enough time for the thermal wave to propagate into the target and to create a region of hot spot in the high explosives, electron thermal diffusion of ultrashort (femto- and picosecond) lasing is ignored; instead, heat diffusion of absorbed laser energy in the solid target is modeled with thermal decomposition kinetic models of high explosives. Numerically simulated pulsed-laser heating of solid target and thermal explosion of cyclotrimethylenetrinitramine, triaminotrinitrobenzene, and octahydrotetranitrotetrazine are compared to experimental results. The experimental and numerical results are in good agreement

Novel Method to Characterize and Model the Multiaxial Constitutive and Damage Response of Energetic Materials.

Energy Technology Data Exchange (ETDEWEB)

Kaneshige, Michael J. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Rabbi, Md Fazle [Univ. of Texas, El Paso, TX (United States); Kaneshige, Michael J. [Univ. of Texas, El Paso, TX (United States); Mach, Robert [Univ. of Texas, El Paso, TX (United States); Catzin, Carlos A. [Univ. of Texas, El Paso, TX (United States); Stewart, Calvin M. [Univ. of Texas, El Paso, TX (United States)

2017-12-01

Simulant polymer bonded explosives are widely used to simulate the mechanical response of real energetic materials. In this paper, the fracture resistance of a simulant polymer bo nded explosive (PBX) is experimentally investigated. The simulant is composed of 80 wt.% soda lime glass beads (SLGB) and 20 wt.% high impact Polystyrene 825 (HIPS). Brazilian disk tests are performed to characterize the tensile and compressive properties. Fracture toughness and energy tests are performed in the semi - circular bending (SCB) configuration on 80, 81, 82, and 83 wt % SLGB compositions. Digital image correlation is performed to record the surface displacements and calculate surface strains during testing. The m icromechanical behavior of ductile and brittle fracture are evaluated using digital microscopy and scanning electron microscopy of the fracture surface. It is determined that (i) the manufacturing process produces a credible simulant of PBX properties, and (ii) the SCB test measures fracture resistance with a reasonable coefficient of variation.

Energetics Laboratory Facilities

Data.gov (United States)

Federal Laboratory Consortium — These energetic materials laboratories are equipped with explosion proof hoods with blow out walls for added safety, that are certified for safe handling of primary...

Reduce the Sensitivity of CL-20 by Improving Thermal Conductivity Through Carbon Nanomaterials.

Science.gov (United States)

Wang, Shuang; An, Chongwei; Wang, Jingyu; Ye, Baoyun

2018-03-27

The graphene (rGO) and carbon nanotube (CNT) were adopted to enhance the thermal conductivity of CL-20-based composites as conductive fillers. The microstructure features were characterized using scanning electron microscopy (SEM) and X-ray diffraction (XRD), and tested the properties by differential scanning calorimeter (DSC), static electricity accumulation, special height, thermal conductivity, and detonation velocity. The results showed that the mixture of rGO and CNT had better effect in thermal conductivity than rGO or CNT alone under the same loading (1 wt%) and it formed a three-dimensional heat-conducting network structure to improve the heat property of the system. Besides, the linear fit proved that the thermal conductivity of the CL-20-based composites were negatively correlated with the impact sensitivity, which also explained that the impact sensitivity was significantly reduced after the thermal conductivity increased and the explosive still maintained better energy.

Reduce the Sensitivity of CL-20 by Improving Thermal Conductivity Through Carbon Nanomaterials

Science.gov (United States)

Wang, Shuang; An, Chongwei; Wang, Jingyu; Ye, Baoyun

2018-03-01

The graphene (rGO) and carbon nanotube (CNT) were adopted to enhance the thermal conductivity of CL-20-based composites as conductive fillers. The microstructure features were characterized using scanning electron microscopy (SEM) and X-ray diffraction (XRD), and tested the properties by differential scanning calorimeter (DSC), static electricity accumulation, special height, thermal conductivity, and detonation velocity. The results showed that the mixture of rGO and CNT had better effect in thermal conductivity than rGO or CNT alone under the same loading (1 wt%) and it formed a three-dimensional heat-conducting network structure to improve the heat property of the system. Besides, the linear fit proved that the thermal conductivity of the CL-20-based composites were negatively correlated with the impact sensitivity, which also explained that the impact sensitivity was significantly reduced after the thermal conductivity increased and the explosive still maintained better energy.

Computational studies on energetic properties of nitrogen-rich ...

Indian Academy of Sciences (India)

Computational studies on energetic properties of nitrogen-rich energetic materials with ditetrazoles. LI XIAO-HONGa,b,∗ and ZHANG RUI-ZHOUa. aCollege of Physics and Engineering, Henan University of Science and Technology, Luoyang 471 003, China. bLuoyang Key Laboratory of Photoelectric Functional Materials, ...

Structure and Stability of Deflagrations in Porous Energetic Materials

Energy Technology Data Exchange (ETDEWEB)

stephen B. Margolis; Forman A. Williams

1999-03-01

Theoretical two-phase-flow analyses have recently been developed to describe the structure and stability of multi-phase deflagrations in porous energetic materials, in both confined and unconfined geometries. The results of these studies are reviewed, with an emphasis on the fundamental differences that emerge with respect to the two types of geometries. In particular, pressure gradients are usually negligible in unconfined systems, whereas the confined problem is generally characterized by a significant gas-phase pressure difference, or overpressure, between the burned and unburned regions. The latter leads to a strong convective influence on the burning rate arising from the pressure-driven permeation of hot gases into the solid/gas region and the consequent preheating of the unburned material. It is also shown how asymptotic models that are suitable for analyzing stability may be derived based on the largeness of an overall activation-energy parameter. From an analysis of such models, it is shown that the effects of porosity and two-phase flow are generally destabilizing, suggesting that degraded propellants, which exhibit greater porosity than their pristine counterparts, may be more readily subject to combustion instability and nonsteady deflagration.

SIMULATION OF ENERGETIC NEUTRAL ATOMS FROM SOLAR ENERGETIC PARTICLES

Energy Technology Data Exchange (ETDEWEB)

Wang, Linghua [Institute of Space Physics and Applied Technology, Peking University, Beijing 100871 (China); Li, Gang [Department of Space Science and CSPAR, University of Alabama in Huntsville, Huntsville, AL 35899 (United States); Shih, Albert Y. [Solar Physics Laboratory, NASA Goddard Space Flight Center, Greenbelt, MD 20770 (United States); Lin, Robert P. [Space Sciences Laboratory, University of California, Berkeley, CA 94720-7450 (United States); Wimmer-Schweingruber, Robert F., E-mail: wanglhwang@gmail.com [Institut fuer Experimentelle und Angewandte Physik, University of Kiel, Leibnizstrasse 11, D-24118 Kiel (Germany)

2014-10-01

Energetic neutral atoms (ENAs) provide the only way to observe the acceleration site of coronal-mass-ejection-driven (CME-driven) shock-accelerated solar energetic particles (SEPs). In gradual SEP events, energetic protons can charge exchange with the ambient solar wind or interstellar neutrals to become ENAs. Assuming a CME-driven shock with a constant speed of 1800 km s{sup –1} and compression ratio of 3.5, propagating from 1.5 to 40 R{sub S} , we calculate the accelerated SEPs at 5-5000 keV and the resulting ENAs via various charge-exchange interactions. Taking into account the ENA losses in the interplanetary medium, we obtain the flux-time profiles of these solar ENAs reaching 1 AU. We find that the arriving ENAs at energies above ∼100 keV show a sharply peaked flux-time profile, mainly originating from the shock source below 5 R{sub S} , whereas the ENAs below ∼20 keV have a flat-top time profile, mostly originating from the source beyond 10 R{sub S} . Assuming the accelerated protons are effectively trapped downstream of the shock, we can reproduce the STEREO ENA fluence observations at ∼2-5 MeV/nucleon. We also estimate the flux of ENAs coming from the charge exchange of energetic storm protons, accelerated by the fast CME-driven shock near 1 AU, with interstellar hydrogen and helium. Our results suggest that appropriate instrumentation would be able to detect ENAs from SEPs and to even make ENA images of SEPs at energies above ∼10-20 keV.

Initial Chemical Events in CL-20 Under Extreme Conditions: An Ab Initio Molecular Dynamics Study

National Research Council Canada - National Science Library

Isaev, Olexandr; Kholod, Yana; Gorb, Leonid; Qasim, Mohammad; Fredrickson, Herb; Leszczynski, Jerzy

2006-01-01

.... In the present study molecular structure, electrostatic potential, vibrational spectrum and dynamics of thermal decomposition of CL-20 have been investigated by static and dynamic methods of ab...

Seeded Reaction Waves in Composites: Fast Structure Transforming Materials that Respond to Energetic Stimuli

Science.gov (United States)

2016-10-21

change in the structure of the capsule system . The temperatures at which the capsules undergo transformation are in accordance with the results in DSC...Structure- Transforming Materials that Respond to Energetic Stimuli Sb. GRANT NUMBER N00014-13-1-0170 Sc. PROGRAM ELEMENT NUMBER 6. AUTHOR(S) Sd...encapsulated super- cooled fluids into a polymer matrix allows for rapid changes in mechanical properties. Frontal polymerization within a microvascular

Molecular Theory of Detonation Initiation: Insight from First Principles Modeling of the Decomposition Mechanisms of Organic Nitro Energetic Materials.

Science.gov (United States)

Tsyshevsky, Roman V; Sharia, Onise; Kuklja, Maija M

2016-02-19

This review presents a concept, which assumes that thermal decomposition processes play a major role in defining the sensitivity of organic energetic materials to detonation initiation. As a science and engineering community we are still far away from having a comprehensive molecular detonation initiation theory in a widely agreed upon form. However, recent advances in experimental and theoretical methods allow for a constructive and rigorous approach to design and test the theory or at least some of its fundamental building blocks. In this review, we analyzed a set of select experimental and theoretical articles, which were augmented by our own first principles modeling and simulations, to reveal new trends in energetic materials and to refine known existing correlations between their structures, properties, and functions. Our consideration is intentionally limited to the processes of thermally stimulated chemical reactions at the earliest stage of decomposition of molecules and materials containing defects.

Importance of the gas phase role to the prediction of energetic material behavior: An experimental study

International Nuclear Information System (INIS)

Ali, A.N.; Son, S.F.; Asay, B.W.; Sander, R.K.

2005-01-01

Various thermal (radiative, conductive, and convective) initiation experiments are performed to demonstrate the importance of the gas phase role in combustion modeling of energetic materials (EM). A previously published condensed phase model that includes a predicted critical irradiance above which ignition is not possible is compared to experimental laser ignition results for octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) and 2,4,6-trinitrotoluene (TNT). Experimental results conflict with the predicted critical irradiance concept. The failure of the model is believed to result from a misconception about the role of the gas phase in the ignition process of energetic materials. The model assumes that ignition occurs at the surface and that evolution of gases inhibits ignition. High speed video of laser ignition, oven cook-off and hot wire ignition experiments captures the ignition of HMX and TNT in the gas phase. A laser ignition gap test is performed to further evaluate the effect of gas phase laser absorption and gas phase disruption on the ignition process. Results indicate that gas phase absorption of the laser energy is probably not the primary factor governing the gas phase ignition observations. It is discovered that a critical gap between an HMX pellet and a salt window of 6 mm±0.4 mm exists below which ignition by CO 2 laser is not possible at the tested irradiances of 29 W/cm 2 and 38 W/cm 2 for HMX ignition. These observations demonstrate that a significant disruption of the gas phase, in certain scenarios, will inhibit ignition, independent of any condensed phase processes. These results underscore the importance of gas phase processes and illustrate that conditions can exist where simple condensed phase models are inadequate to accurately predict the behavior of energetic materials

Importance of the gas phase role to the prediction of energetic material behavior: An experimental study

Science.gov (United States)

Ali, A. N.; Son, S. F.; Asay, B. W.; Sander, R. K.

2005-03-01

Various thermal (radiative, conductive, and convective) initiation experiments are performed to demonstrate the importance of the gas phase role in combustion modeling of energetic materials (EM). A previously published condensed phase model that includes a predicted critical irradiance above which ignition is not possible is compared to experimental laser ignition results for octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) and 2,4,6-trinitrotoluene (TNT). Experimental results conflict with the predicted critical irradiance concept. The failure of the model is believed to result from a misconception about the role of the gas phase in the ignition process of energetic materials. The model assumes that ignition occurs at the surface and that evolution of gases inhibits ignition. High speed video of laser ignition, oven cook-off and hot wire ignition experiments captures the ignition of HMX and TNT in the gas phase. A laser ignition gap test is performed to further evaluate the effect of gas phase laser absorption and gas phase disruption on the ignition process. Results indicate that gas phase absorption of the laser energy is probably not the primary factor governing the gas phase ignition observations. It is discovered that a critical gap between an HMX pellet and a salt window of 6mm±0.4mm exists below which ignition by CO2 laser is not possible at the tested irradiances of 29W /cm2 and 38W/cm2 for HMX ignition. These observations demonstrate that a significant disruption of the gas phase, in certain scenarios, will inhibit ignition, independent of any condensed phase processes. These results underscore the importance of gas phase processes and illustrate that conditions can exist where simple condensed phase models are inadequate to accurately predict the behavior of energetic materials.

First remote sensing measurements of ClOOCl along with ClO and ClONO2 in activated and deactivated Arctic vortex conditions using new ClOOCl IR absorption cross sections

Directory of Open Access Journals (Sweden)

M. Birk

2010-02-01

Full Text Available Active chlorine species play a dominant role in the catalytic destruction of stratospheric ozone in the polar vortices during the late winter and early spring seasons. Recently, the correct understanding of the ClO dimer cycle was challenged by the release of new laboratory absorption cross sections (Pope et al., 2007 yielding significant model underestimates of observed ClO and ozone loss (von Hobe et al., 2007. Under this aspect, nocturnal Arctic stratospheric limb emission measurements carried out by the balloon version of the Michelson Interferometer for Passive Atmospheric Sounding (MIPAS-B from Kiruna (Sweden on 11 January 2001 and 20/21 March 2003 have been reanalyzed with regard to the chlorine reservoir species ClONO2 and the active species, ClO and ClOOCl (Cl2O2. New laboratory measurements of IR absorption cross sections of ClOOCl for various temperatures and pressures allowed for the first time the retrieval of ClOOCl mixing ratios from remote sensing measurements. High values of active chlorine (ClOx of roughly 2.3 ppbv at 20 km were observed by MIPAS-B in the cold mid-winter Arctic vortex on 11 January 2001. While nighttime ClOOCl shows enhanced values of nearly 1.1 ppbv at 20 km, ClONO2 mixing ratios are less than 0.1 ppbv at this altitude. In contrast, high ClONO2 mixing ratios of nearly 2.4 ppbv at 20 km have been observed in the late winter Arctic vortex on 20 March 2003. No significant ClOx amounts are detectable on this date since most of the active chlorine has already recovered to its main reservoir species ClONO2. The observed values of ClOx and ClONO2 are in line with the established polar chlorine chemistry. The thermal equilibrium constants between the dimer formation and its dissociation, as derived from the balloon measurements, are on the lower side of reported data and in good agreement with values recommended by von Hobe et al. (2007. Calculations with the ECHAM/MESSy Atmospheric Chemistry model (EMAC using

Performance of LiCl Impregnated Mesoporous Material Coating over Corrugated Heat Exchangers in a Solid Sorption Chiller

Directory of Open Access Journals (Sweden)

Hongzhi Liu

2018-06-01

Full Text Available The composite material made by impregnating 40 wt. % lithium chloride (LiCl into the mesopores of a kind of natural porous rock (Wakkanai Siliceous Shale: WSS micropowders (short for “WSS + 40 wt. % LiCl” had been developed previously, and can be regenerated below 100 °C with a cooling coefficient of performance (COP of approximately 0.3 when adopted as a sorbent in a sorption cooler. In this study, experiments have been carried out on an intermittent solid sorption chiller with the WSS + 40 wt. % LiCl coating over two aluminum corrugated heat exchangers. Based on the experimental condition (regeneration temperature of 80 °C, condensation temperature of 30 °C in the desorption process; sorption temperature of 30 °C and evaporation temperature of 12 °C in the sorption process, the water sorption amount changes from 20 wt. % to 70 wt. % in one sorption cooling cycle. Moreover, a specific cooling power (SCP of 86 W/kg, a volumetric specific cooling power (VSCP of 42 W/dm3, and a specific sorption power of 170 W/kg can be achieved with a total sorption and desorption time of 20 min. The obtained cooling COP is approximately 0.16.

Surface characterization of an energetic material, pentaerythritoltetranitrate (PETN), having a thin coating achieved through a starved addition microencapsulation technique

Energy Technology Data Exchange (ETDEWEB)

Worley, C.M.

1986-05-07

The objective of this research was to: (1) determine the nature of a thin coating on an explosive material which was applied using a starved addition microencapsulation technique, (2) understand the coating/crystal bond, and (3) investigate the wettability/adhesion of plastic/solvent combinations using the coating process. The coating used in this work was a Firestone Plastic Company copolymer (FPC-461) of vinylchloride/trifluorochloroethylene in a 1.5/1.0 weight ratio. The energetic explosive examined was pentaerythritoltetranitrate (PETN). The coating process used was starved addition followed by a solvent evaporation technique. Surface analytical studies, completed for characterization of the coating process, show (1) evidence that the polymer coating is present, but not continuous, over the surface of PETN; (2) the average thickness of the polymer coating is between 16-32 A and greater than 44 A, respectively, for 0.5 and 20 wt % coated PETN; (3) no changes in surface chemistry of the polymer or the explosive material following microencapsulation; and (4) the presence of explosive material on the surface of 0.5 wt % FPC-461 coated explosives. 5 refs., 15 figs., 6 tabs.

Molecular Theory of Detonation Initiation: Insight from First Principles Modeling of the Decomposition Mechanisms of Organic Nitro Energetic Materials

Directory of Open Access Journals (Sweden)

Roman V. Tsyshevsky

2016-02-01

Full Text Available This review presents a concept, which assumes that thermal decomposition processes play a major role in defining the sensitivity of organic energetic materials to detonation initiation. As a science and engineering community we are still far away from having a comprehensive molecular detonation initiation theory in a widely agreed upon form. However, recent advances in experimental and theoretical methods allow for a constructive and rigorous approach to design and test the theory or at least some of its fundamental building blocks. In this review, we analyzed a set of select experimental and theoretical articles, which were augmented by our own first principles modeling and simulations, to reveal new trends in energetic materials and to refine known existing correlations between their structures, properties, and functions. Our consideration is intentionally limited to the processes of thermally stimulated chemical reactions at the earliest stage of decomposition of molecules and materials containing defects.

Cl@ssi 2.0: experience in Emilia Romagna

Directory of Open Access Journals (Sweden)

Elena Pacetti

2013-06-01

Full Text Available This article presents some of the results of the Ministerial Initiative Cl@ssi 2.0 in the Emilia Romagna Region. Having described the reference field in which the scaffolding action of the research group of the University of Bologna, coordinated by Prof. Luigi Guerra, is positioned, the paper presents the coaching model through which the design and documentation of the teaching practices adopted in schools was supported. Analysing the experiences of the ER classes, we have identified eight project themes, subsequently modelled on two levels: the didactic modelling of the experiences (construction of interpretation hypotheses; and the construction of a themes/models map (checking/adapting the hypotheses, experimentation through which each school was able to describe and publish processes, products, etc. which characterised their specific project experience. The paper concludes with a series of general reflections on the three years' work.

The structure of PbCl2 on the {100} surface of NaCl and its consequences for crystal growth

Science.gov (United States)

Townsend, Eleanor R.; Brugman, Sander J. T.; Blijlevens, Melian A. R.; Smets, Mireille M. H.; de Poel, Wester; van Enckevort, Willem J. P.; Meijer, Jan A. M.; Vlieg, Elias

2018-04-01

The role that additives play in the growth of sodium chloride is a topic which has been widely researched but not always fully understood at an atomic level. Lead chloride (PbCl2) is one such additive which has been reported to have growth inhibition effects on NaCl {100} and {111}; however, no definitive evidence has been reported which details the mechanism of this interaction. In this investigation, we used the technique of surface x-ray diffraction to determine the interaction between PbCl2 and NaCl {100} and the structure at the surface. We find that Pb2+ replaces a surface Na+ ion, while a Cl- ion is located on top of the Pb2+. This leads to a charge mismatch in the bulk crystal, which, as energetically unfavourable, leads to a growth blocking effect. While this is a similar mechanism as in the anticaking agent ferrocyanide, the effect of PbCl2 is much weaker, most likely due to the fact that the Pb2+ ion can more easily desorb. Moreover, PbCl2 has an even stronger effect on NaCl {111}.

Recent advances in the molten salt technology for the destruction of energetic materials

International Nuclear Information System (INIS)

Upadhye, R.S.; Watkins, B.E.; Pruneda, C.O.

1995-11-01

The DOE has thousands of pounds of energetic materials which result from dismantlement operations at the Pantex Plant. The authors have demonstrated the Molten Salt Destruction (MSD) Process for the treatment of explosives and explosive-containing wastes on a 1.5 kilogram of explosive per hour scale and are currently building a 5 kilogram per hour unit. MSD converts the organic constituents of the waste into non-hazardous substances such as carbon dioxide, nitrogen and water. Any inorganic constituents of the waste, such as binders and metallic particles, are retained in the molten salt. The destruction of energetic material waste is accomplished by introducing it, together with air, into a crucible containing a molten salt, in this case a eutectic mixture of Na, K, and Li carbonates. The following pure component DOE and DoD explosives have been destroyed in LLNL's experimental unit at their High Explosives Applications Facility (HEAF): ammonium picrate, HMX, K-6, NQ, NTO, PETN, RDX, TATB, and TNT. In addition, the following formulations were also destroyed: Comp B, LX-10, LX-16, LX-17, PBX-9404, and XM46, a US Army liquid gun propellant. In this 1.5 kg/hr unit, the fractions of carbon converted to CO and of chemically bound nitrogen converted to NOx were found to be well below 1T. In addition to destroying explosive powders and molding powders the authors have also destroyed materials that are typical of real world wastes. These include shavings from machined pressed parts of plastic bonded explosives and sump waste containing both explosives and non-explosive debris. Based on the information obtained on the smaller unit, the authors have constructed a 5 kg/hr MSD unit, incorporating LLNL's advanced chimney design. This unit is currently under shakedown tests and evaluation

Stability, energetic particles, waves, and current drive summary

International Nuclear Information System (INIS)

Stambaugh, R.D.

2005-01-01

This is the summary paper for the subjects of plasma stability, energetic particles, waves, and current drive for the 20th IAEA Fusion Energy Conference, 1-6 November 2004, Vilamoura, Portugal. Material summarized herein was drawn from 65 contributed papers and 21 overview papers. The distribution of contributed papers by subjects is shown. Significant advances were reported on the principal instabilities in magnetically confined plasmas, even looking forward to the burning plasma state. Wave-plasma physics is maturing and novel methods of current drive and noninductive current generation are being developed. (author)

Source Characterization Model (SCM): A Predictive Capability for the Source Terms of Residual Energetic Materials from Burning and/or Detonation Activities

National Research Council Canada - National Science Library

Brown, Robert C; Kolb, Charles E; Conant, John A; Zhang, John; Dussault, David M; Rush, Tamera L; Conway, Brooke E; Morris, James W; Touma, Joe

2004-01-01

.... Detonation of energetic materials produces a wide range of air and surface pollutants, including carbon monoxide, nitrogen oxides, volatile organic compounds, acid gases, and particulate matter...

Climate protection, natural resources management and soil improvement by combined Energetic and Material Utilization of lignocellulosic agricultural WAstes and residues (CEMUWA)

International Nuclear Information System (INIS)

Schuech, Andrea; Nelles, Michael; Tscherpel, Burckhard; El Behery, Ahmed; Menanz, Rania; Bahl, Hubert; Scheel, Michael; Nipkow, Mareen

2015-01-01

The project Climate protection, natural resources management and soil improvement by combined Energetic and Material Utilization of lignocellulosic agricultural WAstes and residues (CEMUWA) was implemented with long-term partners from Egypt and Germany leaded by the Department Waste Management and Material Flow from September 2011 until October 2013. Aim of the project was the development of technologies for the utilization of agricultural wastes and residues at the example of rice straw, with the focus on the energetic and material use. In the long term a contribution to climate protection and natural resource management could be reached. The focus was on investigations in the field of biogas, ethanol and butanol production including pretreatment as well as the material use in horticulture. The results show that the biogas and ethanol production with adapted pretreatments of rice straws is possible. The technical adaptation of a biogas plant (eo-digestion) would be associated with about 20% higher investment costs and higher operating costs with an approximately 15% higher energy demand. In Germany, however, this may still economically by the substitution of expensive or difficult available energy crops (reduction of substrate costs by 30 to 35% for a 600 kWel-BGP using maize silage). The investigated solutions for material use in Egypt showed good results, which in some cases exceeded the expectations. By the use of rice straw imported peat substrates could be substitute or irrigation water saved, what is ecologically and economically useful. The production of ethanol from rice straw was implemented on laboratory scale and preconditions for investigations in semi-industrial and partly pilot scale were created. The bilateral project'' was funded in the framework of the German-Egypt-Research-Fond (GERF) by the German Federal Ministry of Education and Research (BMBF) and the Egyptian Science and Technology Development Fund in Egypt (STDF). The total budget

Structural and electrochemical properties of Cl-doped LiFePO{sub 4}/C

Energy Technology Data Exchange (ETDEWEB)

Sun, C.S.; Zhang, Y.; Zhang, X.J.; Zhou, Z. [Institute of New Energy Material Chemistry, Nankai University, Tianjin 300071 (China)

2010-06-01

Cl-doped LiFePO{sub 4}/C cathode materials were synthesized through a carbothermal reduction route, and the microstructure and electrochemical performances were systematically studied. Cl-doped LiFePO{sub 4}/C cathode materials presented a high discharge capacity of {proportional_to}90 mAh g{sup -1} at the rate of 20 C (3400 mA g{sup -1}) at room temperature. Electrochemical impedance spectroscopy and cyclic voltamperometry indicated the optimized electrochemical reaction and Li{sup +} diffusion in the bulk of LiFePO{sub 4} due to Cl-doping. The improved Li{sup +} diffusion capability is attributed to the microstructure modification of LiFePO{sub 4} via Cl-doping. (author)

Catalysis of the reduction of Tl+ and of CH2Cl2 by colloidal silver in aqueous solution

International Nuclear Information System (INIS)

Henglein, A.

1979-01-01

(CH 3 ) 2 COH radicals (1-hydroxy-1-methylethyl) do not reduce Tl + or CH 2 CL 2 in homogeneous aqueous solution. In the presence of 2.5 x 10 -4 g atom/L of colloidal silver, Tl + is reduced to yield colloidal thallium, and CH 2 Cl 2 to yield Cl - plus CH 3 Cl. These reactions occur in competition with the silver-catalyzed reduction of water. Tl + is reduced in a one-electron transfer reaction and CH 2 Cl 2 in a two-electron transfer process. The effects are understood in terms of the colloidal particles acting as a pool for electrons that is continuously charged by the organic radicals and discharged by water or dissolved substrates. The specific rate for the CH 2 Cl 2 reduction at the silver pool is 4.3 x 10 3 times greater than that of the water reduction. Electrochemical considerations are carried out to estimate a stationary potential of -0.62 V (vs the standard hydrogen electrode) for the electron pool and to discuss the energetics of the observed reactions and tha materials handling point of view, are being determined

Second School of Nuclear Energetics

International Nuclear Information System (INIS)

2009-01-01

At 3-5 Nov 2009 Institute of Nuclear Energy POLATOM, Association of Polish Electrical Engineers (SEP) and Polish Nuclear Society have organized Second School of Nuclear Energetics. 165 participants have arrived from all Poland and represented both different central institutions (e.g. ministries) and local institutions (e.g. Office of Technical Inspection, The Voivodship Presidential Offices, several societies, consulting firms or energetic enterprises). Students from the Warsaw Technical University and Gdansk Technical University, as well as the PhD students from the Institute of Nuclear Chemistry and Technology (Warsaw) attended the School. 20 invited lectures presented by eminent Polish specialists concerned basic problems of nuclear energetics, nuclear fuel cycle and different problems of the NPP construction in Poland. [pl

Criticality conditions of heterogeneous energetic materials under shock loading

Science.gov (United States)

Nassar, Anas; Rai, Nirmal Kumar; Sen, Oishik; Udaykumar, H. S.

2017-06-01

Shock interaction with the microstructural heterogeneities of energetic materials can lead to the formation of locally heated regions known as hot spots. These hot spots are the potential sites where chemical reaction may be initiated. However, the ability of a hot spot to initiate chemical reaction depends on its size, shape and strength (temperature). Previous study by Tarver et al. has shown that there exists a critical size and temperature for a given shape (spherical, cylindrical, and planar) of the hot spot above which reaction initiation is imminent. Tarver et al. assumed a constant temperature variation in the hot spot. However, the meso-scale simulations show that the temperature distribution within a hot spot formed from processes such as void collapse is seldom constant. Also, the shape of a hot spot can be arbitrary. This work is an attempt towards development of a critical hot spot curve which is a function of loading strength, duration and void morphology. To achieve the aforementioned goal, mesoscale simulations are conducted on porous HMX material. The process is repeated for different loading conditions and void sizes. The hot spots formed in the process are examined for criticality depending on whether they will ignite or not. The metamodel is used to obtain criticality curves and is compared with the critical hot spot curve of Tarver et al.

Crystal structure, vibrational spectra, optical and DFT studies of bis (3-azaniumylpropyl) azanium pentachloroantimonate (III) chloride monohydrate (C6H20N3)SbCl5·Cl·H2O

Science.gov (United States)

Ahmed, Houssem Eddine; Kamoun, Slaheddine

2017-09-01

The crystal structure of (C6H20N3)SbCl5·Cl·H2O is built up of [NH3(CH2)3NH2(CH2)3NH3]3 + cations, [SbCl5]2 - anions, free Cl- anions and neutral water molecules connected together by Nsbnd H ⋯ Cl, Nsbnd H ⋯ O and Osbnd H ⋯ Cl hydrogen bonds. The optical band gap determined by diffuse reflection spectroscopy (DRS) is 3.78 eV for a direct allowed transition. Optimized molecular geometry, atomic Mulliken charges, harmonic vibrational frequencies, HOMO-LUMO and related molecular properties of the (C6H20N3)SbCl5·Cl·H2O compound were calculated by Density functional theory (DFT) using B3LYP method with GenECP sets. The calculated structural parameters (bond lengths and angles) are in good agreement with the experimental XRD data. The vibrational unscaled wavenumbers were calculated and scaled by a proper scaling factor of 0.984. Acceptable consistency was observed between calculated and experimental results. The assignments of wavenumbers were made on the basis of potential energy distribution (PED) using Vibrational Energy Distribution Analysis (VEDA) software. The HOMO-LUMO study was extended to calculate various molecular parameters like ionization potential, electron affinity, global hardness, electro-chemical potential, electronegativity and global electrophilicity of the given molecule.

Energetic Diagrams and Structural Properties of Monohaloacetylenes HC≡CX (X = F, Cl, Br).

Science.gov (United States)

Khiri, D; Hochlaf, M; Chambaud, G

2016-08-04

Highly correlated electronic wave functions within the Multi Reference Configuration Interaction (MRCI) approach are used to study the stability and the formation processes of the monohaloacetylenes HCCX and monohalovinylidenes C2HX (X = F, Cl, Br) in their electronic ground state. These tetra-atomics can be formed through the reaction of triatomic fragments C2F, C2Cl, and C2Br with a hydrogen atom or of C2H with halogen atoms via barrierless reactions, whereas the reactions between the diatomics [C2 + HX] need to overcome barriers of 1.70, 0.89, and 0.58 eV for X = F, Cl, and Br. It is found that the linear HCCX isomers, in singlet symmetry, are more stable than the singlet C2HX iso-forms by 1.995, 2.083, and 1.958 eV for X = F, Cl, and Br. The very small isomerization barriers from iso to linear forms are calculated 0.067, 0.044, and 0.100 eV for F, Cl, and Br systems. The dissociation energies of the HCCX systems (without ZPE corrections), resulting from the breaking of the CX bond, are calculated to be 5.647, 4.691, and 4.129 eV for X = F, Cl, Br, respectively. At the equilibrium geometry of the X(1)Σ(+) state of HCCX, the vertical excitation energies in singlet and triplet symmetries are all larger than the respective dissociation energies. Stable excited states are found only as (3)A', (3)A″, and (1)A″ monohalovinylidene structures.

Multiphase Combustion of Metalized Nanocomposite Energetic Materials

Science.gov (United States)

2014-12-19

on thermal conductivity and absorption coefficient for consolidated aluminum nanoparticles, International Journal of Heat and Mass Transfer, (06...28. Stacy, S.C., Zhang, X., Pantoya, M.L., Weeks, B., Effect of Density on Thermal Conductivity and Absorption Coefficient for Consolidated Aluminum...energetic powder to ESD stimuli generated from a piezo electric crystal ( PZT ). Results show that a high PZT dielectric strength leads to faster

Stability of quasi-steady deflagrations in confined porous energetic materials

Energy Technology Data Exchange (ETDEWEB)

Alexander M. Telengator; Stephen B. Margolis; Forman A. Williams

2000-03-01

Previous analyses have shown that unconfined deflagrations propagating through both porous and nonporous energetic materials can exhibit a thermal/diffusive instability that corresponds to the onset of various oscillatory modes of combustion. For porous materials, two-phase-flow effects, associated with the motion of the gas products relative to the condensed material, play a significant role that can shift stability boundaries with respect to those associated with the nonporous problem. In the present work, additional significant effects are shown to be associated with confinement, which produces an overpressure in the burned-gas region that leads to reversal of the gas flow and hence partial permeation of the hot gases into the unburned porous material. This results in a superadiabatic effect that increases the combustion temperature and, consequently, the burning rate. Under the assumption of gas-phase quasi-steadiness, an asymptotic model is presented that facilitates a perturbation analysis of both the basic solution, corresponding to a steadily propagating planar combustion wave, and its stability. The neutral stability boundaries collapse to the previous results in the absence of confinement, but different trends arising from the presence of the gas-permeation layer are predicted for the confined problem. Whereas two-phase-flow effects are generally destabilizing in the unconfined geometry, the effects of increasing overpressure and hence combustion temperature associated with confinement are shown to be generally stabilizing with respect to thermal/diffusive instability, analogous to the effects of decreasing heat losses on combustion temperature and stability in single-phase deflagrations.

Measurement of deuteron induced gamma-ray emission differential cross sections on {sup nat}Cl from 1.0 to 2.0 MeV

Energy Technology Data Exchange (ETDEWEB)

Jokar, A., E-mail: arezajokar@gmail.com; Kakuee, O.; Lamehi-Rachti, M.

2016-06-15

In this research work, measured differential cross sections for gamma-ray emission from the nuclear reactions {sup 35}Cl(d,pγ{sub 1-0}){sup 36}Cl (E{sub γ} = 788 keV), {sup 35}Cl(d,pγ{sub 2-0}){sup 36}Cl (Eγ = 1165 keV), {sup 37}Cl(d,pγ{sub 1-0}){sup 38}Cl (E{sub γ} = 671 keV) and {sup 37}Cl(d,pγ{sub 2-0}){sup 38}Cl (E{sub γ} = 755 keV) are presented. For these measurements a thin natural BaCl{sub 2} target evaporated onto a 50 μm-thick Mo foil was used. The gamma-rays and backscattered deuterons were detected simultaneously. An HPGe detector placed at an angle of 90° with respect to the beam direction was employed to collect gamma-rays while an ion implanted Si detector placed at a scattering angle of 165° was used to detect backscattered deuterons. The validity of the obtained differential cross sections was verified through a thick target benchmarking experiment. The overall systematic uncertainty of cross section values was estimated to be ±10%.

Energetic materials research and development activities at Sandia National Laboratories supported under DP-10 programs

Energy Technology Data Exchange (ETDEWEB)

Ratzel, A.C. III

1998-09-01

This report provides summary descriptions of Energetic Materials (EM) Research and Development activities performed at Sandia National Laboratories and funded through the Department of Energy DP-10 Program Office in FY97 and FY98. The work falls under three major focus areas: EM Chemistry, EM Characterization, and EM Phenomenological Model Development. The research supports the Sandia component mission and also Sandia's overall role as safety steward for the DOE Nuclear Weapons Complex.

Toxicity Determinations for Five Energetic Materials, Weathered and Aged in Soil, to the Collembolan Folsomia Candida

Science.gov (United States)

2015-03-01

obtained from the Soil Fauna and Ecotoxicology Research Unit, Department of Terrestrial Ecology, National Environmental Research Institute (Silkeborg...AND AGED IN SOIL , TO THE COLLEMBOLAN FOLSOMIA CANDIDA ECBC-TR-1273 Carlton T. Phillips Ronald T. Checkai Roman G. Kuperman Michael Simini...for Five Energetic Materials, Weathered and Aged in Soil , to the Collembolan Folsomia candida 5a. CONTRACT NUMBER 5b. GRANT NUMBER 5c

Three-dimensional simulations of void collapse in energetic materials

Science.gov (United States)

Rai, Nirmal Kumar; Udaykumar, H. S.

2018-03-01

The collapse of voids in porous energetic materials leads to hot-spot formation and reaction initiation. This work advances the current knowledge of the dynamics of void collapse and hot-spot formation using 3D reactive void collapse simulations in HMX. Four different void shapes, i.e., sphere, cylinder, plate, and ellipsoid, are studied. For all four shapes, collapse generates complex three-dimensional (3D) baroclinic vortical structures. The hot spots are collocated with regions of intense vorticity. The differences in the vortical structures for the different void shapes are shown to significantly impact the relative sensitivity of the voids. Voids of high surface area generate hot spots of greater intensity; intricate, highly contorted vortical structures lead to hot spots of corresponding tortuosity and therefore enhanced growth rates of reaction fronts. In addition, all 3D voids are shown to be more sensitive than their two-dimensional (2D) counterparts. The results provide physical insights into hot-spot formation and growth and point to the limitations of 2D analyses of hot-spot formation.

Conditioning ad energetic utilization of wooden materials for landscape conservation; Aufbereitung und Energetische Nutzung von holzigem Landschaftspflegematerial

Energy Technology Data Exchange (ETDEWEB)

Letalik, Christian [C.A.R.M.E.N. e.V., Straubing (Germany). Abt. Festbrennstoffe

2013-10-01

It has become common practice to energetically recover ligneous materials from landscape conservation activities in heat (and power) generation plants. The treatment of green cuttings along roads, railways or power supply lines is state of the art. Such landscaping materials are ligneous green residues e.g. from tree lopping in orchard meadows or shrub hedges - there are about 45,000 kilometers of hedgerows in Schleswig-Holstein, Germany, alone. Shredder machines disintegrate the materials into any required size. By means of adjustable perforated baskets on the disintegrating engine and subsequent sieving steps, homogenous fuels of defined dimensions and low shares of fines can be provided, whichever required. Depending on the water content, such wood chips contain about 20% less energy (calorific value) than comparable forest wood chips. It is important, however, that mineral fine particles like sand, soil or small stones are being sieved out before the combustion because they do not only decrease the calorific value and hence the boiler performance but also cause problems in the combustion areas resulting in higher costs for maintenance, cleaning and ash utilization. Composting plants are regularly well-equipped. They use well-proven management concepts for the material flow to merely condition as much landscape cuttings into fuels, enable the aerobe composting process with less ligneous and more humid materials to continue. For both compost and wood fuels there is sufficient demand resulting in increasing revenues. The EEG amendment 2012 classifies landscape conservation materials as raw materials of remuneration class II (= 8 ct/kWhel on top of the basic remuneration). This is likely to further increment the demand for ligneous fuel from landscape conservation. According to the EEG 2012 there will no longer be power plants without reasonable heat concepts. (orig.)

Prediction of detonation and JWL eos parameters of energetic materials using EXPLO5 computer code

CSIR Research Space (South Africa)

Peter, Xolani

2016-09-01

Full Text Available Ballistic Organization Cape Town, South Africa 27-29 September 2016 1 PREDICTION OF DETONATION AND JWL EOS PARAMETERS OF ENERGETIC MATERIALS USING EXPLO5 COMPUTER CODE X. Peter*, Z. Jiba, M. Olivier, I.M. Snyman, F.J. Mostert and T.J. Sono.... Nowadays many numerical methods and programs are being used for carrying out thermodynamic calculations of the detonation parameters of condensed explosives, for example a BKW Fortran (Mader, 1967), Ruby (Cowperthwaite and Zwisler, 1974) TIGER...

Structure and energetics of clusters relevant to thorium tetrachloride melts

International Nuclear Information System (INIS)

Akdeniz, Z.; Tosi, M.P.

2000-08-01

We study within an ionic model the structure and the energetics of neutral and charged clusters which may exist as structural units in molten ThCl 4 and in its liquid mixtures with alkali chlorides, with reference to Raman scattering experiments by Photiadis and Papatheodorou. As stressed by these authors, the most striking facts for ThCl 4 in comparison with other tetrachlorides (and in particular with ZrCl 4 ) are the appreciable ionic conductivity of the pure melt and the continuous structural changes which occur in the melt mixtures with varying composition. After adjusting our model to data on the isolated ThCl 4 tetrahedral molecule, we evaluate (i) the Th 2 Cl 8 dimer and the singly charged species obtained by chlorine-ion transfer between two such neutral dimers; (ii) the ThCl 6 and ThCl 7 clusters both as charged anions and as alkali -compensated species; and (iii) various oligomers carrying positive or negative double charges. Our study shows that the characteristic structural properties of the ThCl 4 compound and of the alkali-Th chloride systems are the consequence of the relatively high ionic character of the binding, which is already evident in the isolated ThCl 4 molecular monomer. (author)

Investigations on deflagration to detonation transition in porous energetic materials. Final report

Energy Technology Data Exchange (ETDEWEB)

Stewart, D.S. [Univ. of Illinois, Urbana, IL (United States)

1999-07-01

The research carried out by this contract was part of a larger effort funded by LANL in the areas of deflagration to detonation in porous energetic materials (DDT) and detonation shock dynamics in high explosives (DSD). In the first three years of the contract the major focus was on DDT. However, some researchers were carried out on DSD theory and numerical implementation. In the last two years the principal focus of the contract was on DSD theory and numerical implementation. However, during the second period some work was also carried out on DDT. The paper discusses DDT modeling and DSD modeling. Abstracts are included on the following topics: modeling deflagration to detonation; DSD theory; DSD wave front tracking; and DSD program burn implementation.

Thermoluminescence and recovery processes in pure and doped NaCl after 20 K irradiation

International Nuclear Information System (INIS)

Lopez, F.J.; Aguilar, M.; Jaque, F.; Agullo-Lopez, F.

1980-01-01

The thermoluminescence (TL) spectra after X-ray irradiation at 20 K have been investigated for pure as well as divalent cation doped NaCl. The F-centre decay has also been determined in pure and Ca and Mg doped NaCl for comparison purposes. A clear decrease in F-centre concentration appears to correlate with glow peaks at 44 and 50 K for pure and Ca-doped samples. Main glow peak appearing at 69 K is not associated to any appreciable F-centre decay step. Below liquid nitrogen temperature (LNT) all peaks show both σ and π exciton emission bands. Above LNT, the glow peaks for doped samples show the σ emission together with another band at 410 nm, whereas pure samples still present the intrinsic emission bands. (author)

Compatibility study of trans-1,4,5,8-tetranitro-1,4,5,8-tetraazadecalin (TNAD) with some energetic components and inert materials

International Nuclear Information System (INIS)

Yan Qilong; Li Xiaojiang; Zhang Laying; Li Jizhen; Li Hongli; Liu Ziru

2008-01-01

The compatibility of trans-1,4,5,8-tetranitro-1,4,5,8-tetraazadecalin (TNAD) with some energetic components and inert materials of solid propellants was studied by using the pressure DSC method where, cyclotetramethylenetetranitroamine (HMX), cyclotrimethylenetrinitramine (RDX), 1,4-dinitropiperazine (DNP), 1.25/1-NC/NG mixture, lead 3-nitro-1,2,4-triazol-5-onate (NTO-Pb), aluminum powder (Al, particle size = 13.6 μm) and N-nitrodihydroxyethylaminedinitrate (DINA) were used as energetic components and polyethylene glycol (PEG), polyoxytetramethylene-co-oxyethylene (PET), addition product of hexamethylene diisocyanate and water (N-100), 2-nitrodianiline (2-NDPA), 1,3-dimethyl-1,3-diphenyl urea (C 2 ), carbon black (C.B.), aluminum oxide (Al 2 O 3 ), cupric 2,4-dihydroxy-benzoate (β-Cu), cupric adipate (AD-Cu) and lead phthalate (φ-Pb) were used as inert materials. It was concluded that the binary systems of TNAD with NTO-Pb, RDX, PET and Al powder are compatible, and systems of TNAD with DINA and HMX are slightly sensitive, and with 2-NDPA, φ-Pb, β-Cu, AD-Cu and Al 2 O 3 are sensitive, and with PEG, N-100, C 2 and C.B. are incompatible. The impact and friction sensitivity data of the TNAD and TNAD in combination with the other energetic materials under present study was also obtained, and there was no consequential affiliation between sensitivity and compatibility

Enhanced low-temperature thermoelectrical properties of BiTeCl grown by topotactic method

International Nuclear Information System (INIS)

Jacimovic, J.; Mettan, X.; Pisoni, A.; Gaal, R.; Katrych, S.; Demko, L.; Akrap, A.; Forro, L.; Berger, H.; Bugnon, P.; Magrez, A.

2014-01-01

We developed a topotactic strategy to grow BiTeCl single crystals. Structural characterization by means of X-ray diffraction was performed, and the high crystallinity of the material was proven. Measurements of the thermoelectrical coefficients electrical resistivity, thermoelectric power and thermal conductivity show an enhanced room temperature power factor of 20 μW cm −1 K −2 . The high value of the figure of merit (ZT = 0.17) confirms that BiTeCl is a promising material for engineering in thermoelectric applications at low temperature

Preliminary Hazard Analysis of Supercritical Fluid Separation of Energetic Materials

National Research Council Canada - National Science Library

1997-01-01

.... Army Research Laboratory (ARL) and elsewhere, particularly at the Phasex Corporation, Lawrence, MA, has demonstrated the feasibility of separating the energetic moieties by use of supercritical CO2...

High (36)Cl/Cl ratios in Chernobyl groundwater.

Science.gov (United States)

Roux, Céline; Le Gal La Salle, Corinne; Simonucci, Caroline; Van Meir, Nathalie; Fifield, L Keith; Diez, Olivier; Bassot, Sylvain; Simler, Roland; Bugai, Dmitri; Kashparov, Valery; Lancelot, Joël

2014-12-01

After the explosion of the Chernobyl Nuclear Power Plant in April 1986, contaminated material was buried in shallow trenches within the exclusion zone. A (90)Sr plume was evidenced downgradient of one of these trenches, trench T22. Due to its conservative properties, (36)Cl is investigated here as a potential tracer to determine the maximal extent of the contamination plume from the trench in groundwater. (36)Cl/Cl ratios measured in groundwater, trench soil water and leaf leachates are 1-5 orders of magnitude higher than the theoretical natural (36)Cl/Cl ratio. This contamination occurred after the Chernobyl explosion and currently persists. Trench T22 acts as an obvious modern point source of (36)Cl, however other sources have to be involved to explain such contamination. (36)Cl contamination of groundwater can be explained by dilution of trench soil water by uncontaminated water (rainwater or deep groundwater). With a plume extending further than that of (90)Sr, radionuclide which is impacted by retention and decay processes, (36)Cl can be considered as a suitable tracer of contamination from the trench in groundwater provided that modern release processes of (36)Cl from trench soil are better characterized. Copyright © 2014 Elsevier Ltd. All rights reserved.

Uptake and retardation of Cl during cement carbonation

Energy Technology Data Exchange (ETDEWEB)

Milodowski, A.E.; Rochelle, C.A.; Purser, G. [British Geological Survey, Environmental Science Centre, Keyworth, Nottingham, NG12 5GG (United Kingdom)

2013-07-01

The presence of {sup 36}Cl in low- and intermediate-level radioactive waste (L/ILW) is of concern in repository performance assessment. Its mobility and its relatively long half-life (302,000 years) could potentially lead to early release from the waste and its return to the biosphere within the 10{sup 6} timescale. Experiments have been undertaken to examine the impact of carbonation on the mineralogical and physical properties of NRVB cement in relation to the degradation of organic material in the L/ILW, and with oil well Type-G cement in relation to borehole sealing for carbon capture and storage. These show that the cements can uptake a significant amount of Cl through the formation of transient secondary calcium chloroaluminate and Cl-rich calcium silicate hydrate phases. The formation of the Cl-rich phases is enhanced by carbonation reactions and also by low temperatures (20 deg. C). The process may be important in retarding the migration of {sup 36}Cl from a repository for L/ILW. (authors)

Exterior Site Occupancy Infers Chloride-Induced Proton Gating in a Prokaryotic Homolog of the ClC Chloride Channel

Science.gov (United States)

Bostick, David L.; Berkowitz, Max L.

2004-01-01

The ClC family of anion channels mediates the efficient, selective permeation of Cl− across the biological membranes of living cells under the driving force of an electrochemical gradient. In some eukaryotes, these channels are known to exhibit a unique gating mechanism, which appears to be triggered by the permeant Cl− anion. We infer details of this gating mechanism by studying the free energetics of Cl− occupancy in the pore of a prokaryotic ClC homolog. These free energetics were gleaned from 30 ns of molecular dynamics simulation on an ∼133,000-atom system consisting of a hydrated membrane embedded StClC transporter. The binding sites for Cl− in the transporter were determined for the cases where the putative gating residue, Glu148, was protonated and unprotonated. When the glutamate gate is protonated, Cl− favorably occupies an exterior site, Sext, to form a queue of anions in the pore. However, when the glutamate gate is unprotonated, Cl− cannot occupy this site nor, consequently, pass through the pore. An additional, previously undetected, site was found in the pore near the outer membrane that exists regardless of the protonation state of Glu148. Although this suggests that, for the prokaryotic homolog, protonation of Glu148 may be the first step in transporting Cl− at the expense of H+ transport in the opposite direction, an evolutionary argument might suggest that Cl− opens the ClC gate in eukaryotic channels by inducing the conserved glutamate's protonation. During an additional 20 ns free dynamics simulation, the newly discovered outermost site, Sout, and the innermost site, Sint, were seen to allow spontaneous exchange of Cl− ions with the bulk electrolyte while under depolarization conditions. PMID:15345547

Ultrafast Laser Diagnostics for Energetic-Material Ignition Mechanisms: Tools for Physics-Based Model Development.

Energy Technology Data Exchange (ETDEWEB)

Kearney, Sean Patrick; Jilek, Brook Anton; Kohl, Ian Thomas; Farrow, Darcie; Urayama, Junji

2014-11-01

We present the results of an LDRD project to develop diagnostics to perform fundamental measurements of material properties during shock compression of condensed phase materials at micron spatial scales and picosecond time scales. The report is structured into three main chapters, which each focus on a different diagnostic devel opment effort. Direct picosecond laser drive is used to introduce shock waves into thin films of energetic and inert materials. The resulting laser - driven shock properties are probed via Ultrafast Time Domain Interferometry (UTDI), which can additionally be used to generate shock Hugoniot data in tabletop experiments. Stimulated Raman scattering (SRS) is developed as a temperature diagnostic. A transient absorption spectroscopy setup has been developed to probe shock - induced changes during shock compressio n. UTDI results are presented under dynamic, direct - laser - drive conditions and shock Hugoniots are estimated for inert polystyrene samples and for the explosive hexanitroazobenzene, with results from both Sandia and Lawrence Livermore presented here. SRS a nd transient absorption diagnostics are demonstrated on static thin - film samples, and paths forward to dynamic experiments are presented.

Roughness generation during Si etching in Cl{sub 2} pulsed plasma

Energy Technology Data Exchange (ETDEWEB)

Mourey, Odile; Petit-Etienne, Camille; Cunge, Gilles, E-mail: gilles.cunge@cea.fr; Darnon, Maxime; Despiau-Pujo, Emilie; Brichon, Paulin; Lattu-Romain, Eddy; Pons, Michel; Joubert, Olivier [Univ. Grenoble Alpes, CNRS, CEA-Leti Minatec, LTM, F-38054 Grenoble Cedex (France)

2016-07-15

Pulsed plasmas are promising candidates to go beyond limitations of continuous waves' plasma. However, their interaction with surfaces remains poorly understood. The authors investigated the silicon etching mechanism in inductively coupled plasma (ICP) Cl{sub 2} operated either in an ICP-pulsed mode or in a bias-pulsed mode (in which only the bias power is pulsed). The authors observed systematically the development of an important surface roughness at a low duty cycle. By using plasma diagnostics, they show that the roughness is correlated to an anomalously large (Cl atoms flux)/(energetic ion flux) ratio in the pulsed mode. The rational is that the Cl atom flux is not modulated on the timescale of the plasma pulses although the ion fluxes and energy are modulated. As a result, a very strong surface chlorination occurs during the OFF period when the surface is not exposed to energetic ions. Therefore, each energetic ion in the ON period will bombard a heavily chlorinated silicon surface, leading to anomalously high etching yield. In the ICP pulsed mode (in which the ion energy is high), the authors report yields as high as 40, which mean that each individual ion impacts will generate a “crater” of about 2 nm depth at the surface. Since the ion flux is very small in the pulsed ICP mode, this process is stochastic and is responsible for the roughness initiation. The roughness expansion can then be attributed partly to the ion channeling effect and is probably enhanced by the formation of a SiClx reactive layer with nonhomogeneous thickness over the topography of the surface. This phenomenon could be a serious limitation of pulsed plasma processes.

FORMATION OF THE SHORT-LIVED RADIONUCLIDE 36Cl IN THE PROTOPLANETARY DISK DURING LATE-STAGE IRRADIATION OF A VOLATILE-RICH RESERVOIR

International Nuclear Information System (INIS)

Jacobsen, Benjamin; Yin Qingzhu; Matzel, Jennifer; Hutcheon, Ian D.; Ramon, Erick C.; Weber, Peter K.; Krot, Alexander N.; Nagashima, Kazuhide; Ishii, Hope A.; Ciesla, Fred J.

2011-01-01

Short-lived radionuclides (SLRs) in the early solar system provide fundamental insight into protoplanetary disk evolution. We measured the 36 Cl- 36 S-isotope abundance in wadalite ( 36 Cl (τ 1/2 ∼ 3 x 10 5 yr) in the early solar system. Its presence, initial abundance, and the noticeable decoupling from 26 Al raise serious questions about the origin of SLRs. The inferred initial 36 Cl abundance for wadalite, corresponding to a 36 Cl/ 35 Cl ratio of (1.81 ± 0.13) x 10 -5 , is the highest 36 Cl abundance ever reported in any early solar system material. The high level of 36 Cl in wadalite and the absence of 26 Al ( 26 Al/ 27 Al ≤ 3.9 x 10 -6 ) in co-existing grossular (1) unequivocally support the production of 36 Cl by late-stage solar energetic particle irradiation in the protoplanetary disk and (2) indicates that the production of 36 Cl, recorded by wadalite, is unrelated to the origin of 26 Al and other SLRs ( 10 Be, 53 Mn) recorded by primary minerals of CAIs and chondrules. We infer that 36 Cl was largely produced by irradiation of a volatile-rich reservoir in an optically thin protoplanetary disk adjacent to the region in which the CV chondrite parent asteroid accreted while the Sun was a weak T Tauri star. Subsequently, 36 Cl accreted into the Allende CV chondrite together with condensed water ices.

High 36Cl/Cl ratios in Chernobyl groundwater

International Nuclear Information System (INIS)

Roux, Céline; Le Gal La Salle, Corinne; Simonucci, Caroline; Van Meir, Nathalie; Fifield, L. Keith; Diez, Olivier; Bassot, Sylvain

2014-01-01

After the explosion of the Chernobyl Nuclear Power Plant in April 1986, contaminated material was buried in shallow trenches within the exclusion zone. A 90 Sr plume was evidenced downgradient of one of these trenches, trench T22. Due to its conservative properties, 36 Cl is investigated here as a potential tracer to determine the maximal extent of the contamination plume from the trench in groundwater. 36 Cl/Cl ratios measured in groundwater, trench soil water and leaf leachates are 1–5 orders of magnitude higher than the theoretical natural 36 Cl/Cl ratio. This contamination occurred after the Chernobyl explosion and currently persists. Trench T22 acts as an obvious modern point source of 36 Cl, however other sources have to be involved to explain such contamination. 36 Cl contamination of groundwater can be explained by dilution of trench soil water by uncontaminated water (rainwater or deep groundwater). With a plume extending further than that of 90 Sr, radionuclide which is impacted by retention and decay processes, 36 Cl can be considered as a suitable tracer of contamination from the trench in groundwater provided that modern release processes of 36 Cl from trench soil are better characterized. - Highlights: • High 36 Cl/Cl ratios measured in the Chernobyl Pilot Site groundwater. • Trench T22 acts as a modern source of groundwater contamination by 36 Cl but other sources are involved. • Contamination results from dilution of a contaminated “T22” soil water with rainwater. • Processes involved in the modern release need to be investigated

Immobilization of Alkali Metal Fluorides via Recrystallization in a Cationic Lamellar Material, [Th(MoO4)(H2O)4Cl]Cl·H2O.

Science.gov (United States)

Lin, Jian; Bao, Hongliang; Qie, Meiying; Silver, Mark A; Yue, Zenghui; Li, Xiaoyun; Zhu, Lin; Wang, Xiaomei; Zhang, Linjuan; Wang, Jian-Qiang

2018-06-05

Searching for cationic extended materials with a capacity for anion exchange resulted in a unique thorium molybdate chloride (TMC) with the formula of [Th(MoO 4 )(H 2 O) 4 Cl]Cl·H 2 O. The structure of TMC is composed of zigzagging cationic layers [Th(MoO 4 )(H 2 O) 4 Cl] + with Cl - as interlamellar charge-balancing anions. Instead of performing ion exchange, alkali thorium fluorides were formed after soaking TMC in AF (A = Na, K, and Cs) solutions. The mechanism of AF immobilization is elucidated by the combination of SEM-EDS, PXRD, FTIR, and EXAFS spectroscopy. It was observed that four water molecules coordinating with the Th 4+ center in TMC are vulnerable to competition with F - , due to the formation of more favorable Th-F bonds compared to Th-OH 2 . This leads to a single crystal-to-polycrystalline transformation via a pathway of recrystallization to form alkali thorium fluorides.

NbCl 5 and CrCl 3 catalysts effect on synthesis and hydrogen ...

Indian Academy of Sciences (India)

Two kinds of novel materials, Mg–1.6 mol% Ni–0.4 mol% NiO–2 mol% MCl (MCl = NbCl5, CrCl3), along with Mg–1.6 mol% Ni–0.4 mol% NiO for comparison, were examined for their potential use in hydrogen storage applications, having been fabricated via cryomilling. The effects of NbCl5 and CrCl3 on hydrogen storage ...

Test results of a 20 kA high temperature superconductor current lead using REBCO tapes

Science.gov (United States)

Heller, R.; Fietz, W. H.; Gröner, F.; Heiduk, M.; Hollik, M.; Lange, C.; Lietzow, R.

2018-05-01

The Karlsruhe Institute of Technology has developed a 20 kA high temperature superconductor (HTS) current lead (CL) using the second generation material REBCO, as industry worldwide concentrate on the production of this material. The aim was to demonstrate the possibility of replacing the Bi-2223/AgAu tapes by REBCO tapes, while for easy comparison of results, all other components are copies of the 20 kA HTS CL manufactured for the satellite tokamak JT-60SA. After the manufacture of all CL components including the newly developed REBCO module, the assembly of the CL has been executed at KIT and an experiment has been carried out in the CuLTKa test facility where the REBCO CL was installed and connected to a JT-60SA CL via a superconducting bus bar. The experiment covers steady state operation up to 20 kA, pulsed operation, measurement of the heat load at 4.5 K end, loss-of-flow-accident simulations, and quench performance studies. Here the results of these tests are reported and directly compared to those of the JT-60SA CL.

A multi-scale methodology to model damage, deformation and ignition of highly-filled energetic materials

Energy Technology Data Exchange (ETDEWEB)

Vivier, G. [Paris Univ., Paris (France). LMT Cachan; CEA Le Ripault, Monts (France); Trumel, H. [CEA Le Ripault, Monts (France); Hild, F. [Paris Univ., Paris (France). LMT Cachan

2009-07-01

The kinetic energy that occurs when energetic materials are impacted can be converted to heat through dissipative deformation processes while the macroscopic temperature remains unaffected. In this study, a thermodynamics-based approach was used to model the elasto-plastic behaviour that occurs during the deformation process of microstructures. Macroscopic material was modelled as a statistical distribution of unit cells containing a crack grain embedded in an elastic mortar-like matrix. A mesoscopic unit cell model was also developed under confined shear. The study demonstrated that stored energy is a non-negligible part of the total energy of the system, and that stored energy can be released during the unloading process. It was concluded that the mesoscopic analysis of the cracked cell demonstrates that continuum thermodynamics can be used to predict hot spots induced by friction. 7 refs., 7 figs.

Energetic balance and air pollutant emissions estimates in the Aburra Valley, 1999: A preliminary approximation

International Nuclear Information System (INIS)

Molina Perez; Francisco; Saavedra Duque, Marcela; Obregon Cardona Mauricio

2003-01-01

Based on the application of Material Fluxes Analysis, this paper presents the composition of the energetic basket in Valle de Aburra during 1999 and the atmospheric emissions caused by the consumption of those energetic materials. Basically, it was found that the daily energetic consumption of the system was 43,2 Tcal that generated 716 ton. by day of atmospheric contaminants as an output. The results show that the main energetic materials that participate in the global metabolism of the system, was those consumed in the transportation sector (gasoline and diesel). Therefore transportation sector contributes with the principal load of contaminants represented by carbon monoxide that overtake the 77,6% of the whole emissions

Electronic Structure of the Kitaev Material α-RuCl3 Probed by Photoemission and Inverse Photoemission Spectroscopies

OpenAIRE

Soobin Sinn; Choong Hyun Kim; Beom Hyun Kim; Kyung Dong Lee; Choong Jae Won; Ji Seop Oh; Moonsup Han; Young Jun Chang; Namjung Hur; Hitoshi Sato; Byeong-Gyu Park; Changyoung Kim; Hyeong-Do Kim; Tae Won Noh

2016-01-01

Recently, $\\alpha$-$\\textrm{RuCl}_3$ has attracted much attention as a possible material realization of the honeycomb Kitaev model, which may stabilize a quantum-spin-liquid state. Compared to extensive studies on its magnetic properties, there is still a lack of understanding on its electronic structure, which is strongly related with its Kitaev physics. Here, the electronic structure of $\\alpha$-$\\textrm{RuCl}_3$ is investigated by photoemission (PE) and inverse photoemission (IPE) spectros...

Properties of 20Na, 24Al, 28P, 32Cl, and 36K for studies of explosive hydrogen burning

International Nuclear Information System (INIS)

Wrede, C.; Clark, J. A.; Deibel, C. M.; Faestermann, T.; Parikh, A.; Bishop, S.; Eppinger, K.; Kruecken, R.; Lepyoshkina, O.; Rugel, G.; Hertenberger, R.; Wirth, H.-F.; Chen, A. A.; Freeman, B. M.; Setoodehnia, K.

2010-01-01

The radiative proton-capture reactions 19 Ne(p,γ) 20 Na, 23 Mg(p,γ) 24 Al, 27 Si(p,γ) 28 P, 31 S(p,γ) 32 Cl, and 35 Ar(p,γ) 36 K potentially influence energy generation and/or nucleosynthesis during explosive hydrogen burning in classical novae and/or type I x-ray bursts. The thermonuclear rates of these reactions are dependent on resonance energies E r =E x -Q and strengths ωγ. The 20 Ne( 3 He,t) 20 Na, 24 Mg( 3 He,t) 24 Al, 28 Si( 3 He,t) 28 P, 32 S( 3 He,t) 32 Cl, and 36 Ar( 3 He,t) 36 K reactions have been measured using a 32-MeV, 3 He 2+ beam; ion-implanted carbon-foil targets developed at the University of Washington; and the Munich Q3D magnetic spectrograph. This experiment has already yielded precision mass measurements of 20 Na, 24 Al, 28 P, and 32 Cl [C. Wrede et al., Phys. Rev. C 81, 055503 (2010)], which are used presently to constrain the corresponding (p,γ) reaction Q values. The new 24 Al and 28 P masses resolve a discrepancy in the energy of the lowest-energy resonance in the 23 Mg(p,γ) 24 Al reaction and better constrain a direct measurement of its strength. Excitation energies in 32 Cl and 36 K have also been measured. An important new proton-unbound level has been found at E x =2196.9(7) keV in 36 K and the uncertainties in 36 K excitation energies have been reduced by over an order of magnitude. Using the new data on 36 K, the A=36, T=1 triplets have been reassigned. The thermonuclear 35 Ar(p,γ) 36 K reaction rate is found to be much higher than a commonly adopted rate and this could affect energy generation in type I x-ray bursts.

An ab-initio study of the energetics and geometry of sulfide, sulfite and sulfate incorporation into apatite: The thermodynamic basis for using this system as an oxybarometer

Science.gov (United States)

Kim, Y.; Konecke, B.; Fiege, A.; Simon, A. C.; Becker, U.

2017-12-01

We use ab-initio calculations to investigate the energetics and geometry of incorporation of S with its oxidation states S6+, S4+, and S2- into the apatite end-members fluor-, chlor-, and hydroxylapatite, [Ca10(PO4)6(F,Cl,OH)2]. The reaction energy of the balanced equation indicates the stability of the modeled S-incorporated apatite relative to the host apatite, the source, and sink phases. One possible coupled substitution mechanism involves the replacement of La3+ + PO43- ↔ Ca2+ + SO42-. Our results show that the incorporation of SO42- into La- and Na-bearing apatite, Ca8NaLa(PO4)6(F,Cl,OH)2, is energetically favored over the incorporation into La- and Si-bearing apatite, Ca9La(PO4)5(SiO4)(F,Cl,OH)2. Co-incorporation of SO42- and SO32- is energetically favored when the lone pair electrons of SO32- face towards the anion column site, compared to facing away from it. Full or partial incorporation of S2- is favored on the column anion site in the form of [Ca10(PO4)6S] and [Ca20(PO4)12SX2)], where X = F, Cl, or OH. Upon full incorporation (i.e., replacing all column ions by sulfide ions), S2- is positioned in the anion column at z = 0.5 (half way between the mirror planes at z = 1/4 and z = 3/4) in the energy-optimized structure. The calculated energies for partial incorporation of S2- demonstrate that in an energy-optimized structure, S2- is displaced from the mirror plane at z = 1/4 or 3/4, by 1.0 to 1.6 Å, depending on the surrounding species (F-, Cl- or OH-); however, the probability for S2- to be incorporated into the apatite structure is highest for chlorapatite end-members. Our results describe energetically feasible incorporation mechanisms for all three oxidations states of S (S6+, S4+, S2-) in apatite, along with structural distortion and concurring electronic structure changes. These observations are consistent with recently published experimental results (Konecke et al. 2017) that demonstrate S6+, S4+ and S2- incorporation into apatite, where the

Structure and redox properties of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20 adsorbed on a silica surface. M05 computational study

Directory of Open Access Journals (Sweden)

Liudmyla K. Sviatenko

2016-03-01

Full Text Available The cluster approximation was applied at M05/tzvp level to model adsorption of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20 on (001 surface of α-quartz. Structures of the obtained CL-20–silica complexes confirm close to parallel orientation of the nitrocompound toward surface. The binding between CL-20 and silica surface was analyzed and bond energies were calculated applying the atoms in molecules (AIM method. Hydrogen bonds were found to significantly contribute in adsorption energy. An attaching of electron leads to significant deviation from coplanarity in complexes and to strengthening of hydrogen bonding. Redox properties of adsorbed CL-20 were compared with those of gas-phase and hydrated species by calculation of electron affinity, ionization potential, reduction Gibbs free energy, oxidation Gibbs free energy, reduction and oxidation potentials. It was shown that adsorbed CL-20 has lower ability to redox transformation as compared with hydrated one.

Analysis of hohlraum energetics of the SG series and the NIF experiments with energy balance model

Directory of Open Access Journals (Sweden)

Guoli Ren

2017-01-01

Full Text Available The basic energy balance model is applied to analyze the hohlraum energetics data from the Shenguang (SG series laser facilities and the National Ignition Facility (NIF experiments published in the past few years. The analysis shows that the overall hohlraum energetics data are in agreement with the energy balance model within 20% deviation. The 20% deviation might be caused by the diversity in hohlraum parameters, such as material, laser pulse, gas filling density, etc. In addition, the NIF's ignition target designs and our ignition target designs given by simulations are also in accordance with the energy balance model. This work confirms the value of the energy balance model for ignition target design and experimental data assessment, and demonstrates that the NIF energy is enough to achieve ignition if a 1D spherical radiation drive could be created, meanwhile both the laser plasma instabilities and hydrodynamic instabilities could be suppressed.

Novel approach to the preparation of organic energetic film for microelectromechanical systems and microactuator applications.

Science.gov (United States)

Wang, Jun; Zhang, Wenchao; Wang, Lianwei; Shen, Ruiqi; Xu, Xing; Ye, Jiahai; Chao, Yimin

2014-07-23

An activated RDX-Fe2O3 xerogel in a Si-microchannel plate (MCP) has been successfully prepared by a novel propylene epoxide-mediated sol-gel method. A decrease of nearly 40 °C in decomposition temperature has been observed compared with the original cyclotrimethylene trinitramine (RDX). The RDX-Fe2O3 xerogel can release gas and solid matter simultaneously, and the ratio of gas to solid can be tailored easily by changing the initial proportions of RDX and FeCl3·6H2O, which significantly enhances the explosive and propulsion effects and is of great benefit to the applications. The approach, which is simple, safe, and fully compatible with MEMS technology, opens a new route to the introduction of organic energetic materials to a silicon substrate.

Trapping and re-emission of energetic hydrogen and helium ions in materials

International Nuclear Information System (INIS)

Yamaguchi, Sadae

1981-01-01

The experimental results on the trapping and re-emission of energetic hydrogen and helium ions in materials are explained. The trapping of deuterium and helium in graphite saturates at the concentration of 10 18 ions/cm 2 . The trapping rate of hydrogen depends on the kinds of target materials. In the case of the implantation in Mo over 3 x 10 16 H/cm 2 , hydrogen is hardly trapped. On the other hand, the trapping of hydrogen in Ti, Zr and Ta which form solid solution is easily made. The hydrogen in these metals can diffuse toward the inside of metals. The deuterium retained in 316 SS decreased with time. The trapping rate reached saturation more rapidly at higher implantation temperature. The effective diffusion constant for the explanation of the re-emission process is 1/100 as small as the ordinary value. The radiation damage due to helium irradiation affects on the trapping of deuterium in Mo. The temperature dependence of the trapping rate can be explained by the diffusion model based on the Sievert's law. The re-emission of helium was measured at various temperature. At low temperature, the re-emission was low at first, then the rate increased. At high temperature, the re-emission rate was high from the beginning. (Kato, T.)

Measurement of cosmogenic 36Cl/Cl in young volcanic rocks: An application of accelerator mass spectrometry in geochronology

International Nuclear Information System (INIS)

Leavy, B.D.; Phillips, F.M.; Elmore, D.; Kubik, P.W.

1987-01-01

We have measured 36 Cl/Cl ratios in a number of young volcanic rocks in order to test the feasibility of using 36 Cl buildup as a geochronometer for materials less than about 700,000 years old. All of the analyzed rocks have been dated independently using K-Ar or other radiometric dating methods and have exposure histories that are known or can be reasonably assumed. Measured 36 Cl/Cl ratios in these rocks are in good agreement with the calculated in-situ 36 Cl buildup curve. These analyses indicate that AMS measurement of 36 Cl buildup in young rocks is a potentially powerful new method for dating materials that had previously been undatable, and as such will have broad applications in volcanology, tectonics, geophysics, and Quaternary research

Analytical investigation of AlCl[3]/SO[2]Cl[2] catholyte materials for secondary fuze reserve batteries.

Energy Technology Data Exchange (ETDEWEB)

Butler, Paul Charles; Rodriguez, Mark Andrew; Segall, Judith M.; Malizia, Louis A., Jr.; Cherry, Brian Ray; Andrews, Nicholas L.; Clark, Nancy H.; Alam, Todd Michael; Ingersoll, David T.; Tallant, David Robert; Simpson, Regina Lynn; Boyle, Timothy J.; Garcia, Manuel Joseph

2004-05-01

Exploration of the fundamental chemical behavior of the AlCl{sub 3}/SO{sub 2}Cl{sub 2} catholyte system for the ARDEC Self-Destruct Fuze Reserve Battery Project under accelerated aging conditions was completed using a variety of analytical tools. Four different molecular species were identified in this solution, three of which are major. The relative concentrations of the molecular species formed were found to depend on aging time, initial concentrations, and storage temperature, with each variable affecting the kinetics and thermodynamics of this complex reaction system. We also evaluated the effect of water on the system, and determined that it does not play a role in dictating the observed molecular species present in solution. The first Al-containing species formed was identified as the dimer [Al({mu}-Cl)Cl{sub 2}]{sub 2}, and was found to be in equilibrium with the monomer, AlCl{sub 3}. The second species formed in the reaction scheme was identified by single crystal X-ray diffraction studies as [Cl{sub 2}Al({mu}-O{sub 2}SCl)]{sub 2} (I), a scrambled AlCl{sub 3}{center_dot}SO{sub 2} adduct. The SO{sub 2}(g) present, as well as CL{sub 2}(g), was formed through decomposition of SO{sub 2}CL{sub 2}. The SO{sub 2}(g) generated was readily consumed by AlCl{sub 3} to form the adduct 1 which was experimentally verified when 1 was also isolated from the reaction of SO{sub 2}(g) and AlCl {sub 3}. The third species found was tentatively identified as a compound having the general formula {l_brace}[Al(O)Cl{sub 2}][OSCl{sub 2}]{r_brace}{sub n}. This was based on {sup 27}Al NMR data that revealed a species with tetrahedrally coordinated Al metal centers with increased oxygen coordination and the fact that the precipitate, or gel, that forms over time was shown by Raman spectroscopic studies to possess a component that is consistent with SOCl{sub 2}. The precursor to the precipitate should have similar constituents, thus the assignment of {l_brace}[Al(O)Cl{sub 2}][OSCl{sub 2

Nano-Aluminum Reaction with Nitrogen in the Burn Front of Oxygen-Free Energetic Materials

International Nuclear Information System (INIS)

Tappan, B. C.; Son, S. F.; Moore, D. S.

2006-01-01

Nano-particulate aluminum metal was added to the high nitrogen energetic material triaminoguanidium azotetrazolate (TAGzT) in order to determine the effects on decomposition behavior. Standard safety testing (sensitivity to impact, spark and friction) are reported and show that the addition of nano-Al actually decreases the sensitivity of the pure TAGzT. Thermo-equilibrium calculations (Cheetah) indicate that the all of the Al reacts to form AlN in TAGzT decomposition, and the calculated specific impulses are reported. T-Jump/FTIR spectroscopy was performed on the neat TAGzT. Emission spectra were collected to determine the temperature of AlN formation in combustion. Burning rates were also collected, and the effects of nano-Al on rates are discussed

The flexibility of modified-linker MIL-53 materials.

Science.gov (United States)

Munn, Alexis S; Pillai, Renjith S; Biswas, Shyam; Stock, Norbert; Maurin, Guillaume; Walton, Richard I

2016-03-14

The flexibility of eight aluminium hydroxo terephthalates [Al(OH)(BDC-X)]·n(guest) (BDC = 1,4-benzene-dicarboxylate; X = -H, -CH3, -Cl, -Br, -NH2, -NO2, -(OH)2, -CO2H) crystallising in the MIL-53-type structure was investigated upon thermal dehydration of as-made samples, superhydration and methanol adsorption/desorption using in situ powder X-ray diffraction (PXRD). Profile fitting was used to determine lattice parameters as a function of time and/or temperature to describe their structural evolution. It has thus been shown that while methanol vapour adsorption induces an opening of all the modified frameworks, except the -NH2 material, superhydration only leads to open structures for Al-MIL-53-NO2, -Br and -(OH)2. All the MIL-53 solids, except Al-MIL-53-(OH)2 are present in the open structures upon thermal dehydration. In addition to the exploration of the breathing behavior of this MIL-53 series, the issue of disorder in the distribution of the functional groups between the organic linkers was explored. As a typical illustration, density functional theory calculations were carried out on different structures of Al-MIL-53-Cl, in which the distribution of -Cl within two adjacent BDC linkers is varied. The results show that the most energetically stable configuration leads to the best agreement with the experimental PXRD pattern. This observation supports that the distribution of the selected linker substituent in the functionalised solid is governed by energetics and that there is a preference for an ordering of this arrangement.

Energetics and dynamics in organic–inorganic halide perovskite photovoltaics and light emitters

International Nuclear Information System (INIS)

Sum, Tze Chien; Chen, Shi; Xing, Guichuan; Liu, Xinfeng; Wu, Bo

2015-01-01

The rapid transcendence of organic–inorganic metal halide perovskite solar cells to above the 20% efficiency mark has captivated the broad photovoltaic community. As the efficiency race continues unabated, it is essential that fundamental studies keep pace with these developments. Further gains in device efficiencies are expected to be increasingly arduous and harder to come by. The key to driving the perovskite solar cell efficiencies towards their Shockley–Queisser limit is through a clear understanding of the interfacial energetics and dynamics between perovskites and other functional materials in nanostructured- and heterojunction-type devices. In this review, we focus on the current progress in basic characterization studies to elucidate the interfacial energetics (energy-level alignment and band bending) and dynamical processes (from the ultrafast to the ultraslow) in organic–inorganic metal halide perovskite photovoltaics and light emitters. Major findings from these studies will be distilled. Open questions and scientific challenges will also be highlighted. (topical review)

1-Amine-1,2,3-triazolium salts with oxidizing anions: A new family of energetic materials with good performance

Science.gov (United States)

Zhang, Zhi-Bin; Zhang, Jian-Guo

2018-04-01

A series of 1-amino-1,2,3-triazole (ATZ) based energetic nitrogen-rich salts are prepared by using acid-base neutralization reaction (1:1 M ratio), and fully characterized. Structures of the salts are recrystallized and determined by single-crystal X-ray diffraction, which dominated by a strong hydrogen-bond influence with the densities ranging from 1.692 to 1.868 g cm-3. Thermal behaviors have characterized by using the DSC and TG-DTG technologies. The enthalpies of formation have calculated by using Gaussian 03. The detonation parameters of the salts are determined by using the K-J method, and most salts show promising detonation performances (D: 6699-8231 m s-1, P: 19.2-30.7 GPa), among which the salt of 1-amino-1,2,3-triazolium trinitrophloroglucinate has a detonation properties comparable to RDX. The sensitivities results provided the salts as insensitive energetic materials.

Progress Towards a Benchtop Energetics Capability (BRIEFING CHARTS)

National Research Council Canada - National Science Library

Fajardo, Mario E; Lewis, William K

2006-01-01

The incorporation of nanometric (sub-micron size) metal fuel and oxidizer particles into energetic materials is a promising approach to increasing significantly the systems-level performance of munitions...

Novel germanetellones: XYGe=Te (X, Y = H, F, Cl, Br, I and CN) - structures and energetics. Comparison with the first synthetic successes.

Science.gov (United States)

Jaufeerally, Naziah B; Abdallah, Hassan H; Ramasami, Ponnadurai; Schaefer, Henry F

2014-03-14

No stable germanetellone was described until Tbt(Dis)Ge=Te and Tbt(Tip)Ge=Te (Tbt = 2,4,6-tris[bis(trimethylsilyl)methyl]phenyl, Dis = bis(trimethylsilyl)methyl and Tip = 2,4,6-triisopropylphenyl) were reported in 1997. Following these initial experiments, there has arisen considerable interest in Ge[double bond, length as m-dash]Te systems. An obvious question is: why have the simple XYGe=Te (X, Y = H, F, Cl, Br, I and CN) molecules not yet been isolated? In view of the present situation, theoretical information may be of great help for further advances in germanetellone chemistry. A systematic investigation of the XYGe=Te molecules is carried out using the second order Møller-Plesset perturbation theory (MP2) and density functional theory (DFT). The structures and energetics, including ionization potentials (IPad and IPad(ZPVE)), four different forms of neutral-anion separations (EAad, EAad(ZPVE), VEA and VDE) and the singlet-triplet gaps, are reported. The electronegativity (χ) reactivity descriptor for the halogens (F, Cl, Br and I) and the natural charge separations of the Ge=Te moiety are used to assess the interrelated properties of germanetellone and its derivatives. The results are analyzed, discussed and compared with analogous studies of telluroformaldehyde, silanetellone and their derivatives. The thermodynamic viabilities of some of the novel germanetellones have also been evaluated in terms of the bond dissociation enthalpies of Tbt(Dis)Ge=Te and Tbt(Tip)Ge=Te. The simple mono-substituted germanetellones appear to be slightly more thermodynamically favored than Tbt(Dis)Ge=Te and Tbt(Tip)Ge=Te, since the bond dissociation enthalpies of these kinetically stabilized germanetellones are about 28 and 51 kcal mol(-1) lower, respectively.

Materials and systems developments on solid absorption refrigeration with CaCl2·xNH3

International Nuclear Information System (INIS)

Iloeji, O.C.

1995-10-01

The paper presents some developments on the stabilization of CaCl 2 for use as a solid absorption material in refrigerators, the development of a refrigerator using the stabilized salt, and computer modelling of the refrigerator system. (author). 8 refs, 19 figs

Energetic Systems

Data.gov (United States)

Federal Laboratory Consortium — The Energetic Systems Division provides full-spectrum energetic engineering services (project management, design, analysis, production support, in-service support,...

Computational Study on Substituted s-Triazine Derivatives as Energetic Materials

Directory of Open Access Journals (Sweden)

Vikas D. Ghule

2012-01-01

Full Text Available s-Triazine is the essential candidate of many energetic compounds due to its high nitrogen content, enthalpy of formation and thermal stability. The present study explores s-triazine derivatives in which different -NO2, -NH2 and -N3 substituted azoles are attached to the triazine ring via C-N linkage. The density functional theory is used to predict geometries, heats of formation and other energetic properties. Among the designed compounds, -N3 derivatives show very high heats of formation. The densities for designed compounds were predicted by using the crystal packing calculations. Introduction of -NO2 group improves density as compared to -NH2 and -N3, their order of increasing density can be given as NO2>N3>NH2. Analysis of the bond dissociation energies for C-NO2, C-NH2 and C-N3 bonds indicates that substitutions of the -N3 and -NH2 group are favorable for enhancing the thermal stability of s-triazine derivatives. The nitro and azido derivatives of triazine are found to be promising candidates for the synthetic studies.

Effects of bagging materials and CaCl2 spray on fruit calcium concentration in fruit-bagged apple trees

International Nuclear Information System (INIS)

Yim, Y.J.; Choi, J.S.; Kim, S.B.

1989-01-01

This experiment was carried out to investigate the effects of bagging materials and CaCl 2 spray on fruit Ca concentration in fruit-bagged apple trees (Malus domestica Borkh.). No difference was noted in fruit Ca concentration among bagging materials during the growing season. And also, there was no difference in fruit Ca concentration between bagged and non-bagged fruits. The fruit flesh Ca concentration of bagged fruits was significantly lower than that of non-bagged fruits in the same tree, which 0.5 % CaCl 2 was sprayed 5 times in the late growing season. The radioactivity of 45 Ca was highest in the sprayed shoot leaves and bark, while only a trace amount was detected in the fruit and shoot proximate to the treated shoot 3 weeks after 3 times application of 45 CaCl 2 (5 micro Ci/ml). As a result, it is confirmed that the Ca once accumulated in a specific part is hardly retranslocated. Therefore, it is concluded that Ca foliar spray to the fruit-bagged tree has no influence on Ca concentration in the fruit

Coating and Characterization of Mock and Explosive Materials

Directory of Open Access Journals (Sweden)

Emily M. Hunt

2012-01-01

Full Text Available This project develops a method of manufacturing plastic-bonded explosives by using use precision control of agglomeration and coating of energetic powders. The energetic material coating process entails suspending either wet or dry energetic powders in a stream of inert gas and contacting the energetic powder with atomized droplets of a lacquer composed of binder and organic solvent. By using a high-velocity air stream to pneumatically convey the energetic powders and droplets of lacquer, the energetic powders are efficiently wetted while agglomerate drying begins almost immediately. The result is an energetic powder uniformly coated with binder, that is, a PBX, with a high bulk density suitable for pressing. Experiments have been conducted using mock explosive materials to examine coating effectiveness and density. Energetic materials are now being coated and will be tested both mechanically and thermally. This allows for a comprehensive comparison of the morphology and reactivity of the newly coated materials to previously manufactured materials.

Scenery for final use of energy by residential sector in the next 20 years: implications for a strategy of energetic sustainable development; Cenarios de uso final de energia no setor residencial no Brasil nos proximos 20 anos: implicacoes para uma estrategia de desenvolvimento energetico sustentavel

Energy Technology Data Exchange (ETDEWEB)

Machado, Giovani; Szklo, Alexandre Salem; Schaeffer, Roberto; Achao, Carla Lopes; Pereira Junior, Amaro Olimpio [Universidade Federal do Rio de Janeiro (UFRJ), RJ (Brazil). Coordenacao dos Programas de Pos-graduacao de Engenharia (COPPE). Programa de Planejamento Energetico]. E-mail: giovani@ppe.ufrj.br

2006-07-01

This article synthesizes the main projection results for final use of energy consumed by residential sector on the next 20 years in Brazil, and evaluates their implications for a strategy of energetic sustainable development in Brazil. Arising out of previous studies performed for the Petroleum Brazilian Institute, for the Brazilian Ministry of Mines and Energy and for the IAEA, this article considers two sceneries: reference (REF) which considers significant changes, beyond those already consolidated; alternative (ALT), which considers progressive changes in the structure of residential sector (proportion of residences by income by revenue level and consumption), the energetic efficiency and a augmented participation of 'clean' energy sources. Both sceneries estimates potential growing of residences, gain of energetic efficiency, participation of commercial sources and use of natural gas in Brazil, and the rhythm of the implementation. The results show that the difference between the final use of energy by residential sector in REF (33.7 MtEP) in 2023 and in ALT (30.5 MtEP in 2023) can reach almost 10% during the next 20 years.

Special section containing papers presented at the 13th IAEA Technical Meeting on Energetic Particles in Magnetic Confinement Systems (Beijing, China, 17-20 September 2013) Special section containing papers presented at the 13th IAEA Technical Meeting on Energetic Particles in Magnetic Confinement Systems (Beijing, China, 17-20 September 2013)

Science.gov (United States)

Lin, Z.

2014-10-01

In magnetic fusion plasmas, a significant fraction of the kinetic pressure is contributed by superthermal charged particles produced by auxiliary heating (fast ions and electrons) and fusion reactions (a-particles). Since these energetic particles are often far away from thermal equilibrium due to their non-Maxwellian distribution and steep pressure gradients, the free energy can excite electromagnetic instabilities to intensity levels well above the thermal fluctuations. The resultant electromagnetic turbulence could induce large transport of energetic particles, which could reduce heating efficiency, degrade overall plasma confinement, and damage fusion devices. Therefore, understanding and predicting energetic particle confinement properties are critical to the success of burning plasma experiments such as ITER since the ignition relies on plasma self-heating by a-particles. To promote international exchanges and collaborations on energetic particle physics, the biannual conference series under the auspices of the International Atomic Energy Agency (IAEA) were help in Kyiv (1989), Aspenas (1991), Trieste (1993), Princeton (1995), JET/Abingdon (1997), Naka (1999), Gothenburg (2001), San Diego (2003), Takayama (2005), Kloster Seeon (2007), Kyiv (2009), and Austin (2011). The papers in this special section were presented at the most recent meeting, the 13th IAEA Technical Meeting on Energetic Particles in Magnetic Confinement Systems, which was hosted by the Fusion Simulation Center, Peking University, Beijing, China (17-20 September 2013). The program of the meeting consisted of 71 presentations, including 13 invited talks, 26 oral contributed talks, 30 posters, and 2 summary talks, which were selected by the International Advisory Committee (IAC). The IAC members include H. Berk, L.G. Eriksson, A. Fasoli, W. Heidbrink, Ya. Kolesnichenko, Ph. Lauber, Z. Lin, R. Nazikian, S. Pinches, S. Sharapov, K. Shinohara, K. Toi, G. Vlad, and X.T. Ding. The conference program

Electronic Structure of the Kitaev Material α-RuCl3 Probed by Photoemission and Inverse Photoemission Spectroscopies

Science.gov (United States)

Sinn, Soobin; Kim, Choong Hyun; Kim, Beom Hyun; Lee, Kyung Dong; Won, Choong Jae; Oh, Ji Seop; Han, Moonsup; Chang, Young Jun; Hur, Namjung; Sato, Hitoshi; Park, Byeong-Gyu; Kim, Changyoung; Kim, Hyeong-Do; Noh, Tae Won

2016-12-01

Recently, α-RuCl3 has attracted much attention as a possible material to realize the honeycomb Kitaev model of a quantum-spin-liquid state. Although the magnetic properties of α-RuCl3 have been extensively studied, its electronic structure, which is strongly related to its Kitaev physics, is poorly understood. Here, the electronic structure of α-RuCl3 was investigated by photoemission (PE) and inverse-photoemission (IPE) spectroscopies. The band gap was directly measured from the PE and IPE spectra and was found to be 1.9 eV, much larger than previously estimated values. Local density approximation (LDA) calculations showed that the on-site Coulomb interaction U could open the band gap without spin-orbit coupling (SOC). However, the SOC should also be incorporated to reproduce the proper gap size, indicating that the interplay between U and SOC plays an essential role. Several features of the PE and IPE spectra could not be explained by the results of LDA calculations. To explain such discrepancies, we performed configuration-interaction calculations for a RuCl63- cluster. The experimental data and calculations demonstrated that the 4d compound α-RuCl3 is a Jeff = 1/2 Mott insulator rather than a quasimolecular-orbital insulator. Our study also provides important physical parameters required for verifying the proposed Kitaev physics in α-RuCl3.

OpenCL programming guide

CERN Document Server

Munshi, Aaftab; Mattson, Timothy G; Fung, James; Ginsburg, Dan

2011-01-01

Using the new OpenCL (Open Computing Language) standard, you can write applications that access all available programming resources: CPUs, GPUs, and other processors such as DSPs and the Cell/B.E. processor. Already implemented by Apple, AMD, Intel, IBM, NVIDIA, and other leaders, OpenCL has outstanding potential for PCs, servers, handheld/embedded devices, high performance computing, and even cloud systems. This is the first comprehensive, authoritative, and practical guide to OpenCL 1.1 specifically for working developers and software architects. Written by five leading OpenCL authorities, OpenCL Programming Guide covers the entire specification. It reviews key use cases, shows how OpenCL can express a wide range of parallel algorithms, and offers complete reference material on both the API and OpenCL C programming language. Through complete case studies and downloadable code examples, the authors show how to write complex parallel programs that decompose workloads across many different devices. They...

Nuclear energy I, Non-energetic applications

International Nuclear Information System (INIS)

Lartigue G, J.; Navarrete T, M.; Cabrera M, L.; Arandia, P.A.; Arriola S, H.

1986-01-01

The nuclear energy is defined as the energy produced or absorbed in the nuclear reactions, therefore, these are divided in endothermic and exothermic. The exothermic nuclear reactions present more interest from the point of view of its applications and they can show in four main forms: radioactivity (from 0 to 4 MeV/reaction; light nucleus fusion ( ∼ 20 MeV/reaction), heavy nucleus fusion (∼ 200 MeV/reaction) and nucleons annihilation ( ∼ 2000 MeV/reaction). Nowadays only the fission has reached the stage of profitable energetic application, finding the other three forms in research and development. The non-energetic applications of the nuclear energy are characterized by they do not require of prior conversion to another form of energy and they are made through the use of radioisotopes as well as through the use of endothermic reaction caused in particle accelerators. In this work are presented some of the non-energetic applications with its theoretical and experimental basis as well as its benefits of each one. (Author)

High-resolution simulations of cylindrical void collapse in energetic materials: Effect of primary and secondary collapse on initiation thresholds

Science.gov (United States)

Rai, Nirmal Kumar; Schmidt, Martin J.; Udaykumar, H. S.

2017-04-01

Void collapse in energetic materials leads to hot spot formation and enhanced sensitivity. Much recent work has been directed towards simulation of collapse-generated reactive hot spots. The resolution of voids in calculations to date has varied as have the resulting predictions of hot spot intensity. Here we determine the required resolution for reliable cylindrical void collapse calculations leading to initiation of chemical reactions. High-resolution simulations of collapse provide new insights into the mechanism of hot spot generation. It is found that initiation can occur in two different modes depending on the loading intensity: Either the initiation occurs due to jet impact at the first collapse instant or it can occur at secondary lobes at the periphery of the collapsed void. A key observation is that secondary lobe collapse leads to large local temperatures that initiate reactions. This is due to a combination of a strong blast wave from the site of primary void collapse and strong colliding jets and vortical flows generated during the collapse of the secondary lobes. The secondary lobe collapse results in a significant lowering of the predicted threshold for ignition of the energetic material. The results suggest that mesoscale simulations of void fields may suffer from significant uncertainty in threshold predictions because unresolved calculations cannot capture the secondary lobe collapse phenomenon. The implications of this uncertainty for mesoscale simulations are discussed in this paper.

Using isotope 36Cl to study utilization of Cl by crops and distribution and movement of Cl in soil

International Nuclear Information System (INIS)

Pan Jiarong; Wen Xianfang; Tang Nianxin

1991-06-01

Results from using isotope 36 Cl show that a large quantity of Cl is absorbed and utilized by spring wheat, cotton and tobacco from the chloride fertilizers. The utilization coefficient of Cl increases with the growing time of plants and reaches peak at mature stage. The utilization coefficient of above plants are 26.72%, 3317% and 26.19% respectively. The absorption and utilization of residual Cl in soil is much smaller than that in fertilizers, and the utilization coefficient is decreasing with the increasing of growth season. For spring wheat, utilization coefficient is 12.7% in second season and 9.3% in third season. The ability of absorbing and utilizing Cl from organic materials by crops is very low and the utilization coefficient is 10% or less, that depends on circumstances. For rice the utilization coefficient is 3.1% in dry land and 24.3% in flooded land. The distribution of absorbed Cl is mainly in stalk, a little in husk and a few in seeds and roots. After irrigating water it is equivalent to 9.1 mm of rainfall in soil, the Cl moves rapidly to depth 10∼12 cm. Cl moves faster in porous soil than in clay soil, and faster in horizontal direction than in vertical direction

Investigation of Fumed Silica/Aqueous NaCl Superdielectric Material

Directory of Open Access Journals (Sweden)

Natalie Jenkins

2016-02-01

Full Text Available A constant current charge/discharge protocol which showed fumed silica filled to the point of incipient wetness with aqueous NaCl solution to have dielectric constants >108 over the full range of dielectric thicknesses of 0.38–3.9 mm and discharge times of 0.25–>100 s was studied, making this material another example of a superdielectric. The dielectric constant was impacted by both frequency and thickness. For time to discharge greater than 10 s the dielectric constant for all thicknesses needed to be fairly constant, always >109, although trending higher with increasing thickness. At shorter discharge times the dielectric constant consistently decreased, with decreasing time to discharge. Hence, it is reasonable to suggest that for time to discharge >10 s the dielectric constant at all thicknesses will be greater than 109. This in turn implies an energy density for a 5 micron thick dielectric layer in the order of 350 J/cm3 for discharge times greater than 10 s.

Investigation of Fumed Silica/Aqueous NaCl Superdielectric Material.

Science.gov (United States)

Jenkins, Natalie; Petty, Clayton; Phillips, Jonathan

2016-02-20

A constant current charge/discharge protocol which showed fumed silica filled to the point of incipient wetness with aqueous NaCl solution to have dielectric constants >10⁸ over the full range of dielectric thicknesses of 0.38-3.9 mm and discharge times of 0.25->100 s was studied, making this material another example of a superdielectric. The dielectric constant was impacted by both frequency and thickness. For time to discharge greater than 10 s the dielectric constant for all thicknesses needed to be fairly constant, always >10⁸, although trending higher with increasing thickness. At shorter discharge times the dielectric constant consistently decreased, with decreasing time to discharge. Hence, it is reasonable to suggest that for time to discharge >10 s the dielectric constant at all thicknesses will be greater than 10⁸. This in turn implies an energy density for a 5 micron thick dielectric layer in the order of 350 J/cm³ for discharge times greater than 10 s.

Nonperturbative effects of energetic ions on Alfven eigenmodes

International Nuclear Information System (INIS)

Todo, Y.; Nakajima, N.; Shinohara, K.; Takechi, M.; Ishikawa, M.; Yamamoto, S.

2005-01-01

Linear properties and nonlinear evolutions of an energetic-ion driven instability in a JT-60U plasma were investigated using a simulation code for magnetohydrodynamics and energetic particles. The spatial profile of the unstable mode peaks near the plasma center where the safety factor profile is flat. The unstable mode is not a toroidal Alfven eigenmode (TAE) because the spatial profile deviates from the expected location of TAE and the spatial profile consists of a single primary harmonic m/n = 2/1 where m, n are poloidal and toroidal mode numbers. The real frequency of the unstable mode is close to the experimental starting frequency of the fast frequency sweeping mode. The simulation results demonstrate that the energetic ion orbit width and the energetic ion pressure significantly broaden radial profile of the unstable mode. For the smallest value among the investigated energetic ion orbit width, the unstable mode is localized within 20% of the minor radius. This gives an upper limit of the spatial profile width of the unstable mode which the magnetohydrodynamic effects alone can induce. For the experimental condition of the JT-60U plasma, the energetic ions broaden the spatial profile of the unstable mode by a factor of 3 compared with the smallest orbit width case. The unstable mode is primarily induced by the energetic particles. It is demonstrated that the frequency shifts both upward and downward in the nonlinear evolution at the rate close to that of the fast frequency sweeping mode. In addition to the energetic particle mode in the JT-60U plasma, an investigation of TAE in an LHD-like plasma using the simulation code for the helical coordinate system is reported. (author)

Nonperturbative effects of energetic ions on Alfven eigenmodes

International Nuclear Information System (INIS)

Todo, Y.; Nakajima, N.; Shinohara, Kouji; Takechi, Manabu; Ishikawa, Masao

2005-01-01

Linear properties and nonlinear evolutions of an energetic-ion driven instability in a JT-60U plasma were investigated using a simulation code for magnetohydrodynamics and energetic particles. The spatial profile of the unstable mode peaks near the plasma center where the safety factor profile is flat. The unstable mode is not a toroidal Alfven eigenmode (TAE) because the spatial profile deviates from the expected location of TAE and the spatial profile consists of a single primary harmonic m/n=2/1 where m, n are poloidal and toroidal mode numbers. The real frequency of the unstable mode is close to the experimental starting frequency of the fast frequency sweeping mode. The simulation results demonstrate that the energetic ion orbit width and the energetic ion pressure significantly broaden radial profile of the unstable mode. For the smallest value among the investigated energetic ion orbit width, the unstable mode is localized within 20% of the minor radius. This gives an upper limit of the spatial profile width of the unstable mode which the magnetohydrodynamic effects alone can induce. For the experimental condition of the JT-60U plasma, the energetic ions broaden the spatial profile of the unstable mode by a factor of 3 compared with the smallest orbit width case. The unstable mode is primarily induced by the energetic particles. It is demonstrated that the frequency shifts both upward and downward in the nonlinear evolution at the rate close to that of the fast frequency sweeping mode. In addition to the energetic particle mode in the JT-60U plasma, an investigation of TAE in an LHD-like plasma using the simulation code for the helical coordinate system is reported. (author)

Nanocrystals of Cesium Lead Halide Perovskites (CsPbX₃, X = Cl, Br, and I): Novel Optoelectronic Materials Showing Bright Emission with Wide Color Gamut.

Science.gov (United States)

Protesescu, Loredana; Yakunin, Sergii; Bodnarchuk, Maryna I; Krieg, Franziska; Caputo, Riccarda; Hendon, Christopher H; Yang, Ruo Xi; Walsh, Aron; Kovalenko, Maksym V

2015-06-10

Metal halides perovskites, such as hybrid organic-inorganic CH3NH3PbI3, are newcomer optoelectronic materials that have attracted enormous attention as solution-deposited absorbing layers in solar cells with power conversion efficiencies reaching 20%. Herein we demonstrate a new avenue for halide perovskites by designing highly luminescent perovskite-based colloidal quantum dot materials. We have synthesized monodisperse colloidal nanocubes (4-15 nm edge lengths) of fully inorganic cesium lead halide perovskites (CsPbX3, X = Cl, Br, and I or mixed halide systems Cl/Br and Br/I) using inexpensive commercial precursors. Through compositional modulations and quantum size-effects, the bandgap energies and emission spectra are readily tunable over the entire visible spectral region of 410-700 nm. The photoluminescence of CsPbX3 nanocrystals is characterized by narrow emission line-widths of 12-42 nm, wide color gamut covering up to 140% of the NTSC color standard, high quantum yields of up to 90%, and radiative lifetimes in the range of 1-29 ns. The compelling combination of enhanced optical properties and chemical robustness makes CsPbX3 nanocrystals appealing for optoelectronic applications, particularly for blue and green spectral regions (410-530 nm), where typical metal chalcogenide-based quantum dots suffer from photodegradation.

Phase equilibria and interaction between the CsCl-PbCl{sub 2}-PbO system components

Energy Technology Data Exchange (ETDEWEB)

Arkhipov, Pavel A.; Zakiryanova, Irina D. [Russian Academy of Sciences, Ekatherinburg (Russian Federation). Inst. of High Temperature Electrochemistry; Kholkina, Anna S.; Bausheva, Alexandra V.; Khudorozhkova, Anastasia O. [Russian Academy of Sciences, Ekatherinburg (Russian Federation). Inst. of High Temperature Electrochemistry; Ural Federal Univ., Ekatherinburg (Russian Federation)

2015-07-01

Thermal analysis was applied to determine liquidus temperatures in the CsCl-PbCl{sub 2}-PbO system, with the PbO concentration ranging from 0 to 20 mol%. The temperature dependence of the PbO solubility in the CsCl-PbCl{sub 2} eutectic melt was studied, and the thermodynamic parameters of the PbO dissolution were calculated. The type, morphology, and composition of oxychloride ionic groupings in the melt were determined in situ using Raman spectroscopy.

Energetic materials under high pressures and temperatures: stability, polymorphism and decomposition of RDX

International Nuclear Information System (INIS)

Dreger, Z A

2012-01-01

A recent progress in understanding the response of energetic crystal of cyclotrimethylene trinitramine (RDX) to high pressures and temperatures is summarized. The optical spectroscopy and imaging studies under static compression and high temperatures provided new insight into phase diagram, polymorphism and decomposition mechanisms at pressures and temperatures relevant to those under shock compression. These results have been used to aid the understanding of processes under shock compression, including the shock-induced phase transition and identification of the crystal phase at decomposition. This work demonstrates that studies under static compression and high temperatures provide important complementary route for elucidating the physical and chemical processes in shocked energetic crystals.

Very High Performance High Nitrogen Energetic Ingredients and Energetic Polymers for Structural Components

Science.gov (United States)

2011-12-31

13. SUPPLEMENTARY NOTES SoUoWtoo^ 14. ABSTRACT This project investigated new energetic materials for use with a triazole cured binder system ...The reaction was repeated using two equivalents of KH. An even more insoluble product was obtained. Figure 8 and 9 show the C-13 and N-15 CP/MAS...Sonnenberg, M. Hada, M. Ehara, K. Toyota , R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda , O. Kitao, H. Nakai, T. Vreven, J. A. Montgomery, Jr

Quinquennial National Program (1990-1994) for the Energetic Modernization

International Nuclear Information System (INIS)

1990-01-01

The Mexican Energetics Sector currently has the eighth possition regarding reserves of hydrocarbons and the sixth regarding oil production, the installed capacity in electricity matters is among the first 20 of the world. The Program established first, a general balance of the situation in which the energetics sector lays today. It also points out the strategic role that this sector holds, as well an on the solutions to the problems faced. This Program establishes the objectives pursued by the energetics sector and that are as follows: to guarantee enough supply of energetics, to strenghten the link between the energetics sector and economy, society and environmental protection, to consolidate an energetics sector that is more current and better integrated. This Program presents the proposal to tend to five priorities: productivity, saving and effective use of energy, financing of the development and expansion of the offer, to diversify sources, as well as an efficient participation in international markets. In the chapter the effort regarding supply and demand of energy, it is evident that the effort made to expand the offer must be great, facing the total demand of energy demonstrated by the figures. For 1994 this demmand is of 31 - 36 % greater to that observed in 1988. Lastly, two statistic documents are enclosed, one historic, with general pointers of the sector, and another with the basic variables for national energy balance

Crevice corrosion resistance of high alloyed materials in 3.5 % NaCl solution

International Nuclear Information System (INIS)

Alar, Vesna; Stojanovic, Ivan; Simunovic, Vinko

2014-01-01

The effects of applied torque on the corrosion behaviour of W.-Nr. 1.4404 and 1.4462 stainless steels and W.-Nr. 2.4605 and 2.4858 nickel alloys with crevices were investigated using the cyclic potentiodynamic polarization method. Crevice corrosion (material-to-polytetrafluoroethylene) was tested in 3.5 % NaCl solution at 22 C. The corroded surface was examined using scanning electron microscopy. The results indicate similar trends in susceptibility to crevice corrosion with increasing torque. Among the four specimens, the W.-Nr. 1.4404 is the most susceptible to crevice corrosion. (orig.)

Heterogeneous computing with OpenCL

CERN Document Server

2013-01-01

Heterogeneous Computing with OpenCL teaches OpenCL and parallel programming for complex systems that may include a variety of device architectures: multi-core CPUs, GPUs, and fully-integrated Accelerated Processing Units (APUs) such as AMD Fusion technology. Designed to work on multiple platforms and with wide industry support, OpenCL will help you more effectively program for a heterogeneous future. Written by leaders in the parallel computing and OpenCL communities, this book will give you hands-on OpenCL experience to address a range of fundamental parallel algorithms. The authors explore memory spaces, optimization techniques, graphics interoperability, extensions, and debugging and profiling. Intended to support a parallel programming course, Heterogeneous Computing with OpenCL includes detailed examples throughout, plus additional online exercises and other supporting materials.

Spectrophotometric and chromatographic determination of insensitive energetic materials: HNS and NTO, in the presence of sensitive nitro-explosives.

Science.gov (United States)

Can, Ziya; Uzer, Ayşem; Tekdemir, Yasemin; Erçağ, Erol; Türker, Lemi; Apak, Reşat

2012-02-15

As there are no molecular spectroscopic determination methods for the most widely used insensitive energetic materials, 2,2',4,4',6,6'-hexanitrostilbene (HNS) and 3-nitro-1,2,4-triazole-5-one (NTO), in the presence of sensitive nitro-explosives, two novel spectrophotometric methods were developed. For HNS and TNT mixtures, both analytes react with dicyclohexylamine (DCHA) forming different colored charge-transfer complexes, which can be resolved by derivative spectroscopy. The spectrophotometric method for NTO measures the 416-nm absorbance of its yellow-colored Na(+)NTO(-) salt formed with NaOH. TNT, if present, is pre-extracted into IBMK as its Meisenheimer anion forming an ion-pair with the cationic surfactant cetyl pyridinium (CP(+)) in alkaline medium, whereas the unextracted NTO is determined in the aqueous phase. The molar absorptivity (ε, L mol(-1)cm(-1)) and limit of quantification (LOQ, mg L(-1)) are as follows: for HNS, ε=2.75 × 10(4) and LOQ=0.48 (in admixture with TNT); for NTO, ε=6.83 × 10(3) and LOQ=0.73. These methods were not affected from nitramines and nitrate esters in synthetic mixtures or composite explosives. The developed methods were statistically validated against HPLC, and the existing chromatographic method was modified so as to enable NTO determination in the presence of TNT. These simple, low-cost, and versatile methods can be used in criminology, remediation/monitoring of contaminated sites, and kinetic stability modeling of munitions containing desensitized energetic materials. Copyright © 2012 Elsevier B.V. All rights reserved.

Raw material and energetic matrix: a synthetic, generic and attention considerations for the future of the Camacari Industrial pole, Bahia, Brazil; Materias-prima e matriz energetica: uma visao sintetica, generica e de atencao para o futuro do Polo Industrial de Camacari

Energy Technology Data Exchange (ETDEWEB)

Lins Neto, Joao Bispo [Braskem S.A., Camacari, BA (Brazil). Gerencia de Energia], e-mail: joao.lins@braskem.com.br; Lima, Alberto Ferreira [Bahia Pulp, Camacari, BA (Brazil). Gerencia de Qualidade e Desenvolvimento de Produto], e-mail: alberto_lima@bahiapulp.com; Petti, Ana Carla [Braskem S.A., Camacari, BA (Brazil). Gerencia de Gestao e Regulacao de Energia], e-mail: ana.petti@braskem.com.br; Correia, Antonia Lucia Santiago [PETROBRAS S.A., Norte/Nordeste (Brazil)

2008-01-15

This paper makes a synthetic evaluation of the present and raw material situation and the energetic matrix, and future perspectives, focusing on the following aspects: analysis of the existent production chains; threats to the raw material and incomes; integration between the enterprises and opportunities for new business, and availability and competitiveness of the energetic matrix.

40 CFR 465.20 - Applicability; description of the galvanized basis material subcategory.

Science.gov (United States)

2010-07-01

... galvanized basis material subcategory. 465.20 Section 465.20 Protection of Environment ENVIRONMENTAL PROTECTION AGENCY (CONTINUED) EFFLUENT GUIDELINES AND STANDARDS COIL COATING POINT SOURCE CATEGORY Galvanized Basis Material Subcategory § 465.20 Applicability; description of the galvanized basis material...

Study on the covalence of Cu and chemical bonding in an inorganic fullerene-like molecule, [CuCl]20[Cp*FeP5]12[Cu-(CH3CN)2+Cl-]5, by a density functional approach

Institute of Scientific and Technical Information of China (English)

WANG; Bingwu; XU; Guangxian; CHEN; Zhida

2004-01-01

The electronic structure and chemical bonding in a recently synthesized inorganic fullerene-like molecule, {[CuCl]20[Cp*FeP5]12 [Cu(CH3CN)+2Cl-]5}, has been studied by a density functional approach. Geometrical optimization of the three basic structural units of the molecule is performed with Amsterdam Density Functional Program. The results are in agreement with the experiment. Localized MO's obtained by Boys-Foster method give a clear picture of the chemical bonding in this molecule. The reason why CuCl can react with Cp*FeP5 in solvent CH3CN to form the fullerene-like molecule is explained in terms of the soft-hard Lewis acid base theory and a new concept of covalence.

Initial mechanisms for the decomposition of electronically excited energetic materials: 1,5′-BT, 5,5′-BT, and AzTT

International Nuclear Information System (INIS)

Yuan, Bing; Yu, Zijun; Bernstein, Elliot R.

2015-01-01

Decomposition of nitrogen-rich energetic materials 1,5′-BT, 5,5′-BT, and AzTT (1,5′-Bistetrazole, 5,5′-Bistetrazole, and 5-(5-azido-(1 or 4)H-1,2,4-triazol-3-yl)tetrazole, respectively), following electronic state excitation, is investigated both experimentally and theoretically. The N 2 molecule is observed as an initial decomposition product from the three materials, subsequent to UV excitation, with a cold rotational temperature (<30 K). Initial decomposition mechanisms for these three electronically excited materials are explored at the complete active space self-consistent field (CASSCF) level. Potential energy surface calculations at the CASSCF(12,8)/6-31G(d) level illustrate that conical intersections play an essential role in the decomposition mechanism. Electronically excited S 1 molecules can non-adiabatically relax to their ground electronic states through (S 1 /S 0 ) CI conical intersections. 1,5′-BT and 5,5′-BT materials have several (S 1 /S 0 ) CI conical intersections between S 1 and S 0 states, related to different tetrazole ring opening positions, all of which lead to N 2 product formation. The N 2 product for AzTT is formed primarily by N–N bond rupture of the –N 3 group. The observed rotational energy distributions for the N 2 products are consistent with the final structures of the respective transition states for each molecule on its S 0 potential energy surface. The theoretically derived vibrational temperature of the N 2 product is high, which is similar to that found for energetic salts and molecules studied previously

MOISTURE HUMIDITY EQUILIBRIUM OF WOOD CHIPS FROM ENERGETIC CROPS

Directory of Open Access Journals (Sweden)

Jan Barwicki

2008-09-01

Full Text Available Processes occurring during storage of wood chips for energetic or furniture industry purposes were presented. As a result of carried out investigations, dependences of temperature and relative humidity changes of surrounding air were shown. Modified Henderson equation can be utilized for computer simulation of storing and drying processes concerning wood chips for energetic and furniture industry purposes. It reflects also obtained results from experiments carried out with above mentioned material. Using computer simulation program we can examine different wood chips storing conditions to avoid overheating and loss problems.

A new method for determining gas phase heat of formation of aromatic energetic compounds

Energy Technology Data Exchange (ETDEWEB)

Keshavarz, Mohammad H. [Department of Chemistry, Malek-ashtar University of Technology, Shahin-shahr P. O. Box 83145/115 (Iran); Tehrani, Masoud K. [Department of Physics, Malek-ashtar University of Technology, Shahin-shahr P. O. Box 83145/115 (Iran)

2007-04-15

A new correlation is introduced for desk calculation of gas phase heat of formation of aromatic energetic compounds that contain the elements of carbon, hydrogen, nitrogen and oxygen. Predicted gas phase heats of formation for 26 energetic compounds have a root mean square of deviation from experiment of 20.67 kJ/mol, which is in good agreement with respect to measured values of oxygen-lean and oxygen-rich aromatic energetic compounds. (Abstract Copyright [2007], Wiley Periodicals, Inc.)

Low-temperature anharmonicity in cesium chloride (CsCl)

Energy Technology Data Exchange (ETDEWEB)

Sist, Mattia; Faerch Fischer, Karl Frederik; Brummerstedt Iversen, Bo [Center for Materials Crystallography, Department of Chemistry and iNANO, Aarhus University (Denmark); Kasai, Hidetaka [Center for Materials Crystallography, Department of Chemistry and iNANO, Aarhus University (Denmark); Faculty of Pure and Applied Sciences, TIMS and CiRfSE, University of Tsukuba (Japan)

2017-03-20

Anharmonic lattice vibrations govern heat transfer in materials, and anharmonicity is commonly assumed to be dominant at high temperature. The textbook cubic ionic defect-free crystal CsCl is shown to have an unexplained low thermal conductivity at room temperature (ca. 1 W/(m K)), which increases to around 13 W/(m K) at 25 K. Through high-resolution X-ray diffraction it is unexpectedly shown that the Cs atomic displacement parameter becomes anharmonic at 20 K. (copyright 2017 Wiley-VCH Verlag GmbH and Co. KGaA, Weinheim)

First Principle Quantum Description of the Energetics Associated with LaBr3, LaCl3, and Ce Doped Scintillators

International Nuclear Information System (INIS)

Michael E. McIlwain; Da Gao; Nick Thompson

2007-01-01

Considerable interest is given to the excellent scintillation properties of cerium doped lanthanum chloride (LaCl3) and lanthanum bromide (LaBr3). The scintillation efficiencies are much greater than other materials, even those containing cerium. This high efficiency is attributed to the high mobility of electrons and holes, unique placement of the cerium 5d states within the band gap, and energy of the band gap. To better understand the scintillation process and better define the nature of the Self Trapped Exciton (STE) within these unique scintillation materials, density functional theory (DFT), and Ab-initio (HF-MP2) calculations are reported. DFT calculations have yielded a qualitative description of the orbital composition and energy distribution of the band structure in the crystalline material. MP2 and single configuration interaction calculations have provided quantitative values for the band gap and provided energies for the possible range of excited states created following hole and electron creation. Based on this theoretical treatment, one possible description of the STE is the combination of Vk center (Br2-1) and LaBr+1 species that recombine to form a distorted geometry LaBr3* (triplet state). Depending on the distance between the LaBr and Br2, the STE emission band can be reproduced

Atmospheric production rate of 36Cl

International Nuclear Information System (INIS)

Parrat, Y.; Hajdas, W.; Baltensperger, U.; Synal, H.A.; Kubik, P.W.; Gaeggeler, H.W.; Suter, M.

1997-01-01

Using experimental cross sections, a new calculation of the atmospheric production rate of 36 Cl was carried out. A mean production rate of 20 atoms m -2 s -1 was obtained, which is lower than mean 36 Cl deposition rates. (author) 2 figs., 7 refs

Possible effect of extreme solar energetic particle event of 20 January 2005 on polar stratospheric aerosols: direct observational evidence

Directory of Open Access Journals (Sweden)

I. A. Mironova

2012-01-01

Full Text Available Energetic cosmic rays are the main source of ionization of the low-middle atmosphere, leading to associated changes in atmospheric properties. Via the hypothetical influence of ionization on aerosol growth and facilitated formation of clouds, this may be an important indirect link relating solar variability to climate. This effect is highly debated, however, since the proposed theoretical mechanisms still remain illusive and qualitative, and observational evidence is inconclusive and controversial. Therefore, important questions regarding the existence and magnitude of the effect, and particularly the fraction of aerosol particles that can form and grow, are still open. Here we present empirical evidence of the possible effect caused by cosmic rays upon polar stratospheric aerosols, based on a case study of an extreme solar energetic particle (SEP event of 20 January 2005. Using aerosol data obtained over polar regions from different satellites with optical instruments that were operating during January 2005, such as the Stratospheric Aerosol and Gas Experiment III (SAGE III, and Optical Spectrograph and Infrared Imaging System (OSIRIS, we found a significant simultaneous change in aerosol properties in both the Southern and Northern Polar regions in temporal association with the SEP event. We speculate that ionization of the atmosphere, which was abnormally high in the lower stratosphere during the extreme SEP event, might have led to formation of new particles and/or growth of preexisting ultrafine particles in the polar stratospheric region. However, a detailed interpretation of the effect is left for subsequent studies. This is the first time high vertical resolution measurements have been used to discuss possible production of stratospheric aerosols under the influence of cosmic ray induced ionization. The observed effect is marginally detectable for the analyzed severe SEP event and can be undetectable for the majority of weak

Possible effect of extreme solar energetic particle event of 20 January 2005 on polar stratospheric aerosols: direct observational evidence

Science.gov (United States)

Mironova, I. A.; Usoskin, I. G.; Kovaltsov, G. A.; Petelina, S. V.

2012-01-01

Energetic cosmic rays are the main source of ionization of the low-middle atmosphere, leading to associated changes in atmospheric properties. Via the hypothetical influence of ionization on aerosol growth and facilitated formation of clouds, this may be an important indirect link relating solar variability to climate. This effect is highly debated, however, since the proposed theoretical mechanisms still remain illusive and qualitative, and observational evidence is inconclusive and controversial. Therefore, important questions regarding the existence and magnitude of the effect, and particularly the fraction of aerosol particles that can form and grow, are still open. Here we present empirical evidence of the possible effect caused by cosmic rays upon polar stratospheric aerosols, based on a case study of an extreme solar energetic particle (SEP) event of 20 January 2005. Using aerosol data obtained over polar regions from different satellites with optical instruments that were operating during January 2005, such as the Stratospheric Aerosol and Gas Experiment III (SAGE III), and Optical Spectrograph and Infrared Imaging System (OSIRIS), we found a significant simultaneous change in aerosol properties in both the Southern and Northern Polar regions in temporal association with the SEP event. We speculate that ionization of the atmosphere, which was abnormally high in the lower stratosphere during the extreme SEP event, might have led to formation of new particles and/or growth of preexisting ultrafine particles in the polar stratospheric region. However, a detailed interpretation of the effect is left for subsequent studies. This is the first time high vertical resolution measurements have been used to discuss possible production of stratospheric aerosols under the influence of cosmic ray induced ionization. The observed effect is marginally detectable for the analyzed severe SEP event and can be undetectable for the majority of weak-moderate events. The present

Active interrogation using energetic protons

International Nuclear Information System (INIS)

Morris, Christopher L.; Chung, Kiwhan; Greene, Steven J.; Hogan, Gary E.; Makela, Mark; Mariam, Fesseha; Milner, Edward C.; Murray, Matthew; Saunders, Alexander; Spaulding, Randy; Wang, Zhehui; Waters, Laurie; Wysocki, Frederick

2010-01-01

Energetic proton beams provide an attractive alternative when compared to electromagnetic and neutron beams for active interrogation of nuclear threats because they have large fission cross sections, long mean free paths and high penetration, and they can be manipulated with magnetic optics. We have measured time-dependent cross sections and neutron yields for delayed neutrons and gamma rays using 800 MeV and 4 GeV proton beams with a set of bare and shielded targets. The results show significant signals from both unshielded and shielded nuclear materials. Measurements of neutron energies yield suggest a signature unique to fissile material. Results are presented in this paper.

Pressure Dependent Decomposition Kinetics of the Energetic Material HMX up to 3.6 GPa

Energy Technology Data Exchange (ETDEWEB)

Glascoe, E A; Zaug, J M; Burnham, A K

2009-05-29

The effect of pressure on the thermal decomposition rate of the energetic material HMX was studied. HMX was precompressed in a diamond anvil cell (DAC) and heated at various rates. The parent species population was monitored as a function of time and temperature using Fourier transform infrared (FTIR) spectroscopy. Decomposition rates were determined by fitting the fraction reacted to the extended-Prout-Tompkins nucleation-growth model and the Friedman isoconversional method. The results of these experiments and analysis indicate that pressure accelerates the decomposition at low to moderate pressures (i.e. between ambient pressure and 1 GPa) and decelerates the decomposition at higher pressures. The decomposition acceleration is attributed to pressure enhanced autocatalysis whereas the deceleration at high pressures is attributed pressure inhibiting bond homolysis step(s), which would result in an increase in volume. These results indicate that both {beta} and {delta} phase HMX are sensitive to pressure in the thermally induced decomposition kinetics.

Atendimento e seguimento clínico especializado de profissionais de enfermagem acidentados com material biológico Atención y seguimiento clínico especializado de profesionales de enfermería accidentados con material biológico Care and specialized clinical follow-up of nursing professionals who have been victims of accidents with biological material

Directory of Open Access Journals (Sweden)

Flaviana Regina Pimenta

2013-02-01

Full Text Available O presente trabalho trata-se de estudo de corte transversal, com objetivo de avaliar a conduta dos profissionais de enfermagem vítimas de acidentes com material biológico, do Hospital das Clínicas da Faculdade de Medicina de Ribeirão Preto da Universidade de São Paulo, no estado de São Paulo, referente ao atendimento e ao seguimento clínico especializado. A população foi composta por 1.215 profissionais de enfermagem, entrevistados entre os anos de 2010 e 2011, dos quais 636 (52,3% sofreram acidentes com material biológico e 182 (28,6% não procuraram atendimento no serviço especializado. O motivo mais frequentemente relatado foi atribuir pouco risco ao acidente. Assim, acredita-se que os motivos alegados pelos profissionais para não procurarem o atendimento, para não completarem a terapêutica e nem o seguimento clínico podem contribuir para a proposição de estratégias capazes de aumentar a adesão às medidas profiláticas após exposição ocupacional a material biológico.Estudio de corte transversal, apuntando a evaluar la conducta de profesionales de enfermería víctimas de accidentes con material biológico, del Hospital de Clínicas de la Facultad de Medicina de Ribeirão Preto, Universidad de São Paulo, en el estado de São Paulo; referente a la atención y seguimiento clínico especializado. La población estuvo integrada por 1215 profesionales de enfermería, entrevistados entre 2010 y 2011, de los cuales 636 (52,3% sufrieron accidentes con material biológico y 182 (28,6% no solicitaron atención en el servicio especializado. El motivo relatado con mayor frecuencia fue atribuir escaso riesgo al accidente. De tal modo, se cree que los motivos alegados por los profesionales para no solicitar atención, para no completar la terapéutica ni el seguimiento clínico pueden ser facilitar la propuesta de estrategias capaces de aumentar su adhesión a las medidas profilácticas luego de exposición laboral a materiales biol

J.M.G. Le Clézio and Baruch Spinoza: Understanding and Accepting the ‘God’ of Material Reality

Directory of Open Access Journals (Sweden)

Keith Moser

2013-12-01

Full Text Available The Dutch philosopher Baruch Spinoza and the contemporary Franco-Mauritian author J.M.G. Le Clézio place great emphasis on the materiality of the human condition. For both of these extremely divergent thinkers, the path to existential redemption and spiritual edification is inseparable from the biotic network of life to which we are inextricably linked. Given that nothing exists in a cosmic vacuum in complete isolation from other material organisms, Spinoza and Le Clézio urge the modern subject to deconstruct seductive, anthropocentric ideology and to embrace reality. Indeed, understanding and accepting our own corporality in addition to exploring the complex relationship between ourselves and the cosmic forces that sustain us is perhaps the only true path to self-actualization that allows us to project meaning upon the absurdity of the universe.

Determination of Chloride Content in Cementitious Materials : From Fundamental Aspects to Application of Ag/AgCl Chloride Sensors

NARCIS (Netherlands)

Pargar, F.; Koleva, D.A.; van Breugel, K.

2017-01-01

This paper reports on the advantages and drawbacks of available test methods for the determination of chloride content in cementitious materials in general, and the application of Ag/AgCl chloride sensors in particular. The main factors that affect the reliability of a chloride sensor are presented.

Stress corrosion cracking in 17-4PH and 17-7PH stainless steels in NaCl and NaOH (20%) a 90 deg C

International Nuclear Information System (INIS)

Gaona-Tiburcio, C.; Almeraya-Calderon, F.; Martinez-Villafane, A.

2000-01-01

One of the problems that affects to the electric industry is the not programmed stoppages in the power plants, due to the failure of any main component: boiler, turbine and generator. In the turbine, the combined action of a corrosive agent (humid polluted vapor) and a mechanical effort, generally will result in Stress Corrosion Cracking (SCC). In this work the SCC susceptibility of the precipitation hardening stainless steels 17-4PH and 17-17PH, thoroughly used in steam turbine blades of power stations is analyzed. The specimens were tested in the presence of NaCl and NaOH(20%) to 90 deg C and different pH. The CERT test (Constant Extension Rate Test) was used, at 10''-6 s''-1, supplementing it with electrochemical noise, the aim was to identify the conditions of maximum susceptibility and the performance of the studied materials. The fractographic analysis revealed ductile and brittle fracture. Intergranular cracking, characteristic of the anodic dissolution mechanisms of the materials was observed. Nevertheless, the main mechanism responsible the failure was hydrogen embrittlement. (Author) 6 refs

Geometric and energetic considerations of surface fluctuations during ion transfer across the water-immiscible organic liquid interface

Energy Technology Data Exchange (ETDEWEB)

Karnes, John J.; Benjamin, Ilan, E-mail: benjamin@chemistry.ucsc.edu [Department of Chemistry and Biochemistry, University of California, Santa Cruz, California 95064 (United States)

2016-07-07

Molecular dynamics simulations and umbrella sampling free energy calculations are used to examine the thermodynamics, energetics, and structural fluctuations that accompany the transfer of a small hydrophilic ion (Cl{sup −}) across the water/nitrobenzene interface. By examining several constrained interface structures, we isolate the energetic costs of interfacial deformation and co-transfer of hydration waters during the ion transfer. The process is monitored using both energy-based solvation coordinates and a geometric coordinate recently introduced by Morita and co-workers to describe surface fluctuations. Our simulations show that these coordinates provide a complimentary description of the water surface fluctuations during the transfer and are necessary for elucidating the mechanism of the ion transfer.

Papers of 4. Scientific-Technical Seminar: Material Study for Electric Power Stations and Energetics; Referaty 4. Seminarium Naukowo-Techniczne: Badania Materialowe na Potrzeby Elektrowni i Przemyslu Energetycznego

Energy Technology Data Exchange (ETDEWEB)

NONE

1997-07-01

The research on the materials commonly used in electric power stations and energetics have been summarized in the course of the seminar. Especially a different kinds of steels have been investigated from the view point of their desirable mechanical and corrosion properties.

Energetic proton generation in ultra-intense laser-solid interactions

International Nuclear Information System (INIS)

Wilks, S.C.; Langdon, A.B.; Cowan, T.E.; Roth, M.; Singh, M.; Hatchett, S.; Key, M. H.; Pennington, D.; MacKinnon, A.; Snavely, R.A.

2001-01-01

An explanation for the energetic ions observed in the PetaWatt experiments is presented. In solid target experiments with focused intensities exceeding 10 20 W/cm 2 , high-energy electron generation, hard bremsstrahlung, and energetic protons have been observed on the backside of the target. In this report, an attempt is made to explain the physical process present that will explain the presence of these energetic protons, as well as explain the number, energy, and angular spread of the protons observed in experiment. In particular, we hypothesize that hot electrons produced on the front of the target are sent through to the back off the target, where they ionize the hydrogen layer there. These ions are then accelerated by the hot electron cloud, to tens of MeV energies in distances of order tens of μm, whereupon they end up being detected in the radiographic and spectrographic detectors

Energetic utilization and recycling of straw; Energetische und stoffliche Verwertung von Stroh

Energy Technology Data Exchange (ETDEWEB)

Schuech, Andrea; Engler, Nils; Weissbach, Gunter; Nelles, Michael [Rostock Univ. (Germany). Lehrstuhl Abfall- und Stoffstromwirtschaft

2013-10-01

Worldwide arising significant emissions caused by the burning of rice straw on the field. The combined energetic and material utilization of rice straw offers the production possibility of various usable bioenergy and the closing of nutrient cycles by the return of the conversion residues. Thereby the soil quality can be improved and an important contribution to climate protection and resource conservation be realized. In the German-Egyptian project CEMUWA, the options of material and energetic use of rice straw are investigated. It is used as substrate for plant cultivation and for the production of ethanol, butanol and biogas. In this paper first results are presented. (orig.)

Volatility of components of saturated vapours of UCl4-CsCl and UCl4-LiCl molten mixtures

International Nuclear Information System (INIS)

Smirnov, M.V.; Kudyakov, V.Ya.; Salyulev, A.B.; Komarov, V.E.; Posokhin, Yu.V.; Afonichkin, V.K.

1979-01-01

The flow method has been used for measuring the volatility of the components from UCl 4 -CsCl and UCl 4 -LiCl melted mixtures containing 2.0, 5.0, 12.0, 25.0, 33.0, 50.0, 67.0, and 83.0 mol.% of UCl 4 within the temperature ranges of 903-1188 K and 740-1200 K, respectively. The chemical composition of saturated vapours above the melted salts has been determined. The melted mixtures in question exhibit negative deviation from ideal behaviour. Made was the conclusion about the presence in a vapour phase, along with monomeric UCl 4 , LiCl, CsCl and Li 2 Cl 2 , Cs 2 Cl 2 dimers of double compounds of the MeUCl 5 most probable composition. Their absolute contribution into a total pressure above the UCl 4 -CsCl melted mixtures is considerably smaller than above the UCl 4 -LiCl mixtures

Synthesis of a new energetic nitrate ester

Energy Technology Data Exchange (ETDEWEB)

Chavez, David E [Los Alamos National Laboratory

2008-01-01

Nitrate esters have been known as useful energetic materials since the discovery of nitroglycerin by Ascanio Sobrero in 1846. The development of methods to increase the safety and utility of nitroglycerin by Alfred Nobel led to the revolutionary improvement in the utility of nitroglycerin in explosive applications in the form of dynamite. Since then, many nitrate esters have been prepared and incorporated into military applications such as double-based propellants, detonators and as energetic plasticizers. Nitrate esters have also been shown to have vasodilatory effects in humans and thus have been studied and used for treatments of ailments such as angina. The mechanism of the biological response towards nitrate esters has been elucidated recently. Interestingly, many of the nitrate esters used for military purposes are liquids (ethylene glycol dinitrate, propylene glycol dinitrate, etc). Pentaerythritol tetranitrate (PETN) is one of the only solid nitrate esters, besides nitrocellulose, that is used in any application. Unfortunately, PETN melting point is above 100 {sup o}C, and thus must be pressed as a solid for detonator applications. A more practical material would be a melt-castable explosive, for potential simplification of manufacturing processes. Herein we describe the synthesis of a new energetic nitrate ester (1) that is a solid at ambient temperatures, has a melting point of 85-86 {sup o}C and has the highest density of any known nitrate ester composed only of carbon, hydrogen, nitrogen and oxygen. We also describe the chemical, thermal and sensitivity properties of 1 as well as some preliminary explosive performance data.

Recycled tetrahedron-like CuCl from waste Cu scraps for lithium ion battery anode.

Science.gov (United States)

Hou, Hongying; Yao, Yuan; Liu, Song; Duan, Jixiang; Liao, Qishu; Yu, Chengyi; Li, Dongdong; Dai, Zhipeng

2017-07-01

The wide applications of metal Cu inevitably resulted in a large quantity of waste Cu materials. In order to recover the useful Cu under the mild conditions and reduce the environmental emission, waste Cu scraps were recycled in the form of CuCl powders with high economic value added (EVA) via the facile hydrothermal route. The recycled CuCl powders were characterized in terms of scanning electron microscopy (SEM), energy dispersive X-ray spectroscopy (EDX) and X-ray diffraction (XRD). The results suggested that the recycled CuCl powders consisted of many regular tetrahedron-like micro-particles. Furthermore, in order to reduce the cost of lithium ion battery (LIB) anode and build the connection of waste Cu scraps and LIB, the recycled CuCl powders were evaluated as the anode active material of LIB. As expected, the reversible discharge capacity was about 171.8mAh/g at 2.0C even after 50 cycles, implying the satisfactory cycle stability. Clearly, the satisfactory results may open a new avenue to develop the circular economy and the sustainable energy industry, which would be very important in terms of both the resource recovery and the environmental protection. Copyright © 2017. Published by Elsevier Ltd.

Transition-metal chlorides as conversion cathode materials for Li-ion batteries

International Nuclear Information System (INIS)

Li Ting; Chen, Zhong X.; Cao, Yu L.; Ai, Xin P.; Yang, Han X.

2012-01-01

Insoluble AgCl and soluble CuCl 2 were selected and investigated as model compounds of transition-metal chlorides for electrochemical conversion cathode materials. The experimental results demonstrated that the AgCl nanocrystals can convert reversibly to metallic Ag with nearly full utilization of its one-electron redox capacity (187 mAh g −1 ). Similarly, the CuCl 2 -filled mesoporous carbon can realize a reversible two-electron transfer reaction, giving a very high reversible capacity of 466 mAh g −1 after 20 cycles. These data imply that the metal chlorides can undergo complete electrochemical conversion utilizing their full oxidation states for electrical energy storage as previously reported metal fluorides, possibly being used as high capacity cathode materials for Li-ion batteries.

Disposal of energetic materials by alkaline pressure hydrolysis and combined techniques

Energy Technology Data Exchange (ETDEWEB)

Bunte, G.; Krause, H.H.; Hirth, T. [Fraunhofer-Institut fuer Chemische Technologie (ICT), Pfinztal-Berghausen (Germany)

1997-07-01

Due to the reduction of armament and especially due to the German reunification we are met by objective of the diposal of energetic materials. Environmentally friendly disposal methods available for the different propellants, explosives and pyrotechnics are urgently needed. The main component of gun and rocket propellants is the energetic polymer nitrocellulose. One method to dispose nitrocellulose containing propellants is the combination of rapid chemical destruction by pressure hydrolysis and the biological degradation of the reaction mixture. The study describes the results of pressure hydrolysis of different gun and rocket propellants. Under alkaline conditions (propellant to NaOH ratio 2.3:1; reaction temperature 150 C; pressure below 30 bar) biological degradable reaction products were formed. The main products in the liquid phase were simple mono- and dicarboxylic acids. Dependent on the reaction conditions 30-50% of the nitrogen content of the propellants was transformed to nitrite and nitrate. The gaseous nitrogen containing products were N{sub 2} (16-46%), N{sub 2}O (2-23%), NO{sub x} (0-5%). Overall 40%-60% of the propellant nitrogen was transformed to gaseous products. In the solid residues a nitrogen content between 2% and 9% was found. The residues were mostly due to additives used in propellant manufacturing. In the case of nitrocellulose pressure hydrolysis below 30 bar and reaction temperature about 150 C are sufficient. (orig.) [Deutsch] Nicht zuletzt aufgrund der in den letzten Jahren erfolgten Abruestungsmassnahmen sowie auch der Wiedervereinigung beider deutscher Staaten ergab sich die Problematik der Entsorgung von energetischen Materialien. Alternativ zur Verbrennung besteht Bedarf an der Entwicklung von Entsorgungsverfahren, die eine umweltfreundliche Entsorgung von Treibladungspulvern, Raketenfesttreibstoffen oder pyrotechnischen Komponenten ermoeglichen. Eine interessante Methode zur Beseitigung von auf Nitrocellulose basierenden

Unconventional spin dynamics in the honeycomb-lattice material α -RuCl3 : High-field electron spin resonance studies

Science.gov (United States)

Ponomaryov, A. N.; Schulze, E.; Wosnitza, J.; Lampen-Kelley, P.; Banerjee, A.; Yan, J.-Q.; Bridges, C. A.; Mandrus, D. G.; Nagler, S. E.; Kolezhuk, A. K.; Zvyagin, S. A.

2017-12-01

We present high-field electron spin resonance (ESR) studies of the honeycomb-lattice material α -RuCl3 , a prime candidate to exhibit Kitaev physics. Two modes of antiferromagnetic resonance were detected in the zigzag ordered phase, with magnetic field applied in the a b plane. A very rich excitation spectrum was observed in the field-induced quantum paramagnetic phase. The obtained data are compared with the results of recent numerical calculations, strongly suggesting a very unconventional multiparticle character of the spin dynamics in α -RuCl3 . The frequency-field diagram of the lowest-energy ESR mode is found consistent with the behavior of the field-induced energy gap, revealed by thermodynamic measurements.

Building energetic material from novel salix leaf-like CuO and nano-Al through electrophoretic deposition

Energy Technology Data Exchange (ETDEWEB)

Yin, Yan Jun; Li, Xueming [College of Chemistry and Chemical Engineering, Chongqing University, Chongqing (China)

2016-11-15

In this study, an energetic material was prepared by depositing nano-Al on CuO arrays via electrophoretic deposition (EPD), which offers a feasible route for nano-Al integration. The morphology and structure of the CuO arrays and Al/CuO composites were characterized by scanning electron microscopy and X-ray diffraction. The CuO arrays were homogenously salix leaf-like structure with a width of ⁓150 to 200 nm. The energy density of Al/CuO composites was approximate to 1454.5 J/g by integrating the differential scanning calorimetry (DSC) plot and the combustion performance was recorded by a high-speed camera. Moreover, the combustion flames were violent and the whole reaction process only lasted 72.2 ms, indicating that the energy of the Al/CuO nanothermite can be released effectively.

Electrochemical noise transient analysis for 316 and Duplex 2205 stainless steels in NaCl and FeCl; Analisis de los transitorios de ruido electroquimico para aceros inoxidables 316 Y - DUPLEX 2205 en NaCl Y FeCl

Energy Technology Data Exchange (ETDEWEB)

Almeraya-Calderaon, F.; Estupinan, F.; Zambrano, P.; Martinez-Villafane, A.; Borunda, A.; Colas, R.; Gaona-Tiburcio, C.

2012-11-01

This work shows the results obtained from electrochemical noise measurements for different materials exhibiting pitting corrosion. The transients presented in the potential and current time, correlates with the scanning electron microscopy (SEM) surface analysis. Electrochemical measurements were made at different exposure times to obtain the correlation. The materials used were stainless steel austenitic 316 and duplex 2205, immersed in ferric chloride (FeCl3) and sodium chloride (NaCl) electrolytes. SEM analysis shows that the transients observed in the time series, really correspond to the activity of pit nucleation developed over the surface of the electrodes. (Author) 31 refs.

Three-dimensional Mesoscale Simulations of Detonation Initiation in Energetic Materials with Density-based Kinetics

Science.gov (United States)

Jackson, Thomas; Jost, A. M.; Zhang, Ju; Sridharan, P.; Amadio, G.

2017-06-01

In this work we present three-dimensional mesoscale simulations of detonation initiation in energetic materials. We solve the reactive Euler equations, with the energy equation augmented by a power deposition term. The reaction rate at the mesoscale is modelled using a density-based kinetics scheme, adapted from standard Ignition and Growth models. The deposition term is based on previous results of simulations of pore collapse at the microscale, modelled at the mesoscale as hot-spots. We carry out three-dimensional mesoscale simulations of random packs of HMX crystals in a binder, and show that the transition between no-detonation and detonation depends on the number density of the hot-spots, the initial radius of the hot-spot, the post-shock pressure of an imposed shock, and the amplitude of the power deposition term. The trends of transition at lower pressure of the imposed shock for larger number density of pore observed in experiments is reproduced. Initial attempts to improve the agreement between the simulation and experiments through calibration of various parameters will also be made.

Efficient Construction of Energetic Materials via Nonmetallic Catalytic Carbon-Carbon Cleavage/Oxime-Release-Coupling Reactions.

Science.gov (United States)

Zhao, Gang; He, Chunlin; Yin, Ping; Imler, Gregory H; Parrish, Damon A; Shreeve, Jean'ne M

2018-03-14

The exploitation of C-C activation to facilitate chemical reactions is well-known in organic chemistry. Traditional strategies in homogeneous media rely upon catalyst-activated or metal-mediated C-C bonds leading to the design of new processes for applications in organic chemistry. However, activation of a C-C bond, compared with C-H bond activation, is a more challenging process and an underdeveloped area because thermodynamics does not favor insertion into a C-C bond in solution. Carbon-carbon bond cleavage through loss of an oxime moiety has not been reported. In this paper, a new observation of self-coupling via C-C bond cleavage with concomitant loss of oxime in the absence of metals (either metal-complex mediation or catalysis) results in dihydroxylammonium 5,5-bistetrazole-1,10-diolate (TKX-50) as well as N, N'-([3,3'-bi(1,2,4-oxadiazole)]-5,5'-diyl)dinitramine, a potential candidate for a new generation of energetic materials.

Electrical initiation of an energetic nanolaminate film

Science.gov (United States)

Tringe, Joseph W.; Gash, Alexander E.; Barbee, Jr., Troy W.

2010-03-30

A heating apparatus comprising an energetic nanolaminate film that produces heat when initiated, a power source that provides an electric current, and a control that initiates the energetic nanolaminate film by directing the electric current to the energetic nanolaminate film and joule heating the energetic nanolaminate film to an initiation temperature. Also a method of heating comprising providing an energetic nanolaminate film that produces heat when initiated, and initiating the energetic nanolaminate film by directing an electric current to the energetic nanolaminate film and joule heating the energetic nanolaminate film to an initiation temperature.

46 CFR 50.20-30 - Alternative materials or methods of construction.

Science.gov (United States)

2010-10-01

... 46 Shipping 2 2010-10-01 2010-10-01 false Alternative materials or methods of construction. 50.20... ENGINEERING GENERAL PROVISIONS Plan Submittal and Approval § 50.20-30 Alternative materials or methods of construction. (a) When new or alternative procedures, designs, or methods of construction are submitted for...

Atmospheric production rate of {sup 36}Cl

Energy Technology Data Exchange (ETDEWEB)

Parrat, Y.; Hajdas, W.; Baltensperger, U.; Synal, H.A.; Kubik, P.W.; Gaeggeler, H.W. [Paul Scherrer Inst. (PSI), Villigen (Switzerland); Suter, M. [Eidgenoessische Technische Hochschule, Zurich (Switzerland)

1997-09-01

Using experimental cross sections, a new calculation of the atmospheric production rate of {sup 36}Cl was carried out. A mean production rate of 20 atoms m{sup -2}s{sup -1} was obtained, which is lower than mean {sup 36}Cl deposition rates. (author) 2 figs., 7 refs.

Effect of variable doses of ultraviolet radiation (253.7 nm) on thermoluminescence NaCl:Ca(T) material

International Nuclear Information System (INIS)

Nehate, A.K.; Joshi, T.R.; Kathuria, S.P.; Joshi, R.V.

1986-01-01

This paper studies the thermoluminescence (TL) glow curves of NaCl:Ca(T) phosphors to various doses of 253.7-nm ultraviolet (UV) radiation at room temperature. TLD grade NaCl:Ca(T) material was obtained by crystallization from solution and was subsequently annealed at 750 degrees C for 2 h, followed by sudden quenching. We undertook measurement of the effect of variable UV radiation doses (10(2) to 10(6) J m-2) on the TL behaviour of NaCl:Ca(T) phosphors. It was observed that the phosphor exhibits a dominant peak around 167 degrees C along with a weak peak at lower temperature. The high-temperature peak (Peak II) is found to grow linearly with the increase in UV dose in the range of 10(2) to 10(6) J m-2. Since the nature of the glow curves under the influence of different doses remains more or less identical, it is believed that the phosphor does not undergo radiation damage and displays high intrinsic TL around Peak II. Examination of the system for fundamental dosimetry requirements shows that it can be used in dosimetry work at 253.7 nm

About Russian nuclear energetic perspectives

International Nuclear Information System (INIS)

Laletin, N.I.

2003-01-01

My particular view about Russian nuclear energetics perspectives is presented. The nearest and the further perspectives are considered. The arguments are adduced that the most probable scenario of nuclear energetic development is its stabilization in the near future. Fur further development the arguments of supporters and opponents of nuclear energetics are analyzed. Three points of view are considered. The first point of view that there is not alternative for nuclear energetics. My notes are the following ones. a) I express a skeptic opinion about a statement of quick exhaustion of fossil organic fuel recourses and corresponding estimations are presented. b) It is expressed skeptic opinion about the statement that nuclear energetics can have a visual influence on ''steam effect''. c) I agree that nuclear energetics is the most ecological technology for normal work but however we can't disregard possibilities of catastrophic accidents. The second point of view that the use of nuclear energetics can't have the justification. I adduce the arguments contrary to this statement. The third point of view that nuclear energetics is a usual technology and the only criteria for discussions about what dimension and where one ought develop it is total cost of its unit. Expressed an opinion that the deceived for the choose of a way the skill of the estimate correctly and optimized so named the external parts of the unit energy costs for different energy technologies. (author)

75 FR 37994 - Airworthiness Directives; Bombardier, Inc. Model CL-600-1A11 (CL-600), CL-600-2A12 (CL-601), CL...

Science.gov (United States)

2010-07-01

... provides data for replacement of the accumulators. The commenter requests that stronger language be... numbers 1004 through 1085 inclusive; (2) Bombardier, Inc. CL-600-2A12 (CL-601) airplanes, serial numbers 3001 through 3066 inclusive; and (3) Bombardier, Inc. CL-600-2B16 (CL-601-3A, CL-601-3R, and CL- 604...

W18O49 nanorods decorated with Ag/AgCl nanoparticles as highly-sensitive gas-sensing material and visible-light-driven photocatalyst

International Nuclear Information System (INIS)

Sun Shibin; Chang Xueting; Dong Lihua; Zhang Yidong; Li Zhenjiang; Qiu Yanyan

2011-01-01

A novel gas-sensing material and photocatalyst was successfully obtained by decorating Ag/AgCl nanoparticles on the W 18 O 49 nanorods through a clean photochemical route. The as-prepared samples were characterized using combined techniques of X-ray diffractometry, electron microscopy, energy dispersive X-ray spectrometry, and X-ray photoelectron spectroscopy. Gas-sensing measurements indicate that the Ag/AgCl/W 18 O 49 NRs sensors exhibit superior reducing gas-sensing properties to those of bare W 18 O 49 NRs, and they are highly selective and sensitive to NH 3 , acetone, and H 2 S with short response and recovery times. The Ag/AgCl/W 18 O 49 NRs photocatlysts also possess higher photocatalytic performance than bare W 18 O 49 NRs for degradation of methyl orange under simulated sunlight irradiation. Possible mechanisms concerning the enhancement of gas-sensing and photocatalytic activities of the Ag/AgCl/W 18 O 49 NRs composite were proposed. - Graphical Abstract: The Ag/AgCl nanoparticles adhered well to the W 18 O 49 nanorod. The Ag could act as transfer center of the photoexcited carriers, prohibiting their recombinations in both W 18 O 49 and AgCl. Highlights: → Ag/AgCl/W 18 O 49 NRs were successfully obtained via a clean photochemical route. → The Ag/AgCl nanoparticles decorated on the W 18 O 49 NRs possessed cladding structure. → The Ag/AgCl/W 18 O 49 NRs exhibited excellent gas-sensing and photocatalytic properties.

Hole-transport material variation in fully vacuum deposited perovskite solar cells

Energy Technology Data Exchange (ETDEWEB)

Polander, Lauren E.; Pahner, Paul; Schwarze, Martin; Saalfrank, Matthias; Koerner, Christian; Leo, Karl, E-mail: karl.leo@iapp.de [Institut für Angewandte Photophysik, Technische Universität Dresden, 01069 Dresden (Germany)

2014-08-01

This work addresses the effect of energy level alignment between the hole-transporting material and the active layer in vacuum deposited, planar-heterojunction CH{sub 3}NH{sub 3}PbI{sub x−3}Cl{sub x} perovskite solar cells. Through a series of hole-transport materials, with conductivity values set using controlled p-doping of the layer, we correlate their ionization potentials with the open-circuit voltage of the device. With ionization potentials beyond 5.3 eV, a substantial decrease in both current density and voltage is observed, which highlights the delicate energetic balance between driving force for hole-extraction and maximizing the photovoltage. In contrast, when an optimal ionization potential match is found, the open-circuit voltage can be maximized, leading to power conversion efficiencies of up to 10.9%. These values are obtained with hole-transport materials that differ from the commonly used Spiro-MeO-TAD and correspond to a 40% performance increase versus this reference.

Thermal-spectrum recriticality energetics

International Nuclear Information System (INIS)

Schwinkendorf, K.N.

1993-12-01

Large computer codes have been created in the past to predict the energy release in hypothetical core disruptive accidents (CDA), postulated to occur in liquid metal reactors (LMR). These codes, such as SIMMER, are highly specific to LMR designs. More recent attention has focused on thermal-spectrum criticality accidents, such as for fuel storage basins and waste tanks containing fissile material. This paper resents results from recent one-dimensional kinetics simulations, performed for a recriticality accident in a thermal spectrum. Reactivity insertion rates generally are smaller than in LMR CDAs, and the energetics generally are more benign. Parametric variation of input was performed, including reactivity insertion and initial temperature

Charging induced emission of neutral atoms from NaCl nanocube corners

International Nuclear Information System (INIS)

Ceresoli, Davide; Zykova-Timan, Tatyana; Tosatti, Erio

2008-01-01

Detachment of neutral cations/anions from solid alkali halides can in principle be provoked by donating/subtracting electrons to the surface of alkali halide crystals, but generally constitutes a very endothermic process. However, the amount of energy required for emission is smaller for atoms located in less favorable positions, such as surface steps and kinks. For a corner ion in an alkali halide cube the binding is the weakest, so it should be easier to remove that atom, once it is neutralized. We carried out first principles density functional calculations and simulations of neutral and charged NaCl nanocubes, to establish the energetics of extraction of neutralized corner ions. Following hole donation (electron removal) we find that detachment of neutral Cl corner atoms will require a limited energy of about 0.8 eV. Conversely, following the donation of an excess electron to the cube, a neutral Na atom is extractable from the corner at the lower cost of about 0.6 eV. Since the cube electron affinity level (close to that a NaCl(100) surface state, which we also determine) is estimated to lie about 1.8 eV below vacuum, the overall energy balance upon donation to the nanocube of a zero-energy electron from vacuum will be exothermic. The atomic and electronic structure of the NaCl(100) surface, and of the nanocube Na and Cl corner vacancies are obtained and analyzed as a byproduct

Europa Lander Material Selection Considerations

Energy Technology Data Exchange (ETDEWEB)

Tappan, Alexander S. [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Heller, Mellisa [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

2017-01-10

Energetic materials (EMs, explosives, pyrotechnics, propellants) provide high-power output of high temperature reaction products. These products can be solid, liquid, or gaseous during reaction or after the products have equilibrated with the surroundings. For example, high explosives typically consist of carbon, hydrogen, nitrogen, and oxygen bonded within a single molecule, and produce almost exclusively gaseous products. Conversely, intermetallics consist of physical mixtures of metals and metalloids, and produce almost exclusively condensed products. Other materials such as pyrotechnics and propellants have intermediate behavior. All energetic materials react in a self-propagating manner that after ignition, does not necessarily require energy input from the surroundings. The range of reaction velocities can range from mm/s for intermetallics, to km/s for high explosives. Energetic material selection depends on numerous requirements specific to the needs of a system. High explosives are used for applications where high pressure gases are necessary for pushing or fracturing materials (e.g., rock, metal) or creating shock waves or air blast. Propellants are used to produce moderate-pressure, high-temperature products without a shock wave. Pyrotechnics are used to produce numerous effects including: high-temperature products, gases, light, smoke, sound, and others. Thermites are used to produce heat, high-temperature products, materials, and other effects that require condensed products. Intermetallics are used to produce high-temperature condensed products and materials, with very little gas production. Numerous categories of energetic materials exist with overlapping definitions, effects, and properties.

Determination of 36Cl/Cl ratio in ground water using the accelerator mass spectrometry technique

International Nuclear Information System (INIS)

Sharma, Suman; Deodhar, A.S.; Saravana Kumar, U.; Surendran, P.; Shrivastava, A.; Gupta, A.K.; Nair, J.P.; Yadav, M.L.; Hemalatha, M.; Sparrow, H.; Mahata, K.; Thomas, R.G.; Bhagwat, P.V.; Kailas, S.; Kale, R.M.

2009-01-01

The Accelerator Mass Spectrometry (AMS) programme using the 14 MV Pelletron Accelerator at Mumbai has been initiated with major emphasis on the determination of 36 Cl in water samples, of interest to hydrology and environment. In order to carry out the AMS measurement, a beam chopper to cut down beam intensity by a factor of 20 has been developed and commissioned. A multi-anode gas -si detector has been built to separate 36 Cl from the interfering 36 S. A new TPS system has been procured to operate the machine in the GVM mode. Standard and blank samples from Prime lab, Purdue have been employed in these measurements to standardise the technique for 36 Cl/Cl ratio determination. The detector was calibrated using the stable 35,37 Cl ions. The background 36 Cl in the system has been measured using the blank sample from Purdue and it was estimated that the ratio of 36 Cl/Cl was of the order of 10 -13 in the present setup. Ground water samples collected from South India were converted to AgCl and put in the SNICS ion source for the AMS measurements. These ground water samples, with 14 C content estimated to be in the range of 1 to 4 pMC indicate that the samples may be more than 35,000 years old. Using the AMS technique we have determined the 36 Cl/Cl ratio values for these ground water samples. They are found to range between 2 to 5 x 10 -12 . Additional measurements are planned to determine the age of the water samples and to understand the reasons for the observed high values of 36 Cl in these samples. (author)

20. German materials flow congress; 20. Deutscher Materialfluss-Kongress

Energy Technology Data Exchange (ETDEWEB)

NONE

2011-07-01

Within the 20th German Material Flow Meeting of the VDI Wissensforum GmbH (Duesseldorf, Federal Republic of Germany) at 14th to 15th April, 2011 in Garching (Federal Republic of Germany) the following lectures were held: (1) From group logistics to service provider - The innovation process of Hermes Fulfilment GmbH (D. Urbanke); (2) Production structures of the future - Challenges for fabrics through the ages (M. Schenk); (3) Value-driven supply of materials for the implementation of a switching cabinet of great diesel engines (S. Meissner); (4) Material and optimisation of productions with APS - Real operation since January 2008 (M. Mayer); (5) Automation of the material flow in the production - Fully automatic supply of production using the multi-shuttle technology at Siemens site Amberg (M. Paehr); (6) Sustainable enhancement of the process efficiency at Demag Cranes Group (R. Harkort); (7) 'Activity-based logistics' Logistics at Strauss Innovation (A. Witte); (8) A new dimension in e-commerce: Handling of retours at the company Next (UK) - Tendencies and developments in E-Commerce - Handling of increasing quota of retours - A new intralogistic concept approach for handling retours - Green logistics at mail-order companies (V. Welsch); (9) Requirements concerning a tailor-made distribution logistics at office management wholesale trade (R. Barth); (10) New concepts for te distribution logistics - Trading Logistics Center Schweinfurt - The perfect combination of processes and technology for the delivery of an international free spare parts market (T. Nuss); (11) LEAN, BI, APS: Opposition or complementation (A. de Windt); (12) Next E-commerce Generations: How brand manufacturers generate new online sales channels via the utilisation of existing trading structures (M. Thomas); (13) From bus assembly to service provider for spare part logistics - Choice of location (U.J. Unger); (14) Design and implementation of a modular overall logistic system (M

Observation of enhanced radial transport of energetic ion due to energetic particle mode destabilized by helically-trapped energetic ion in the Large Helical Device

Science.gov (United States)

Ogawa, K.; Isobe, M.; Kawase, H.; Nishitani, T.; Seki, R.; Osakabe, M.; LHD Experiment Group

2018-04-01

A deuterium experiment was initiated to achieve higher-temperature and higher-density plasmas in March 2017 in the Large Helical Device (LHD). The central ion temperature notably increases compared with that in hydrogen experiments. However, an energetic particle mode called the helically-trapped energetic-ion-driven resistive interchange (EIC) mode is often excited by intensive perpendicular neutral beam injections on high ion-temperature discharges. The mode leads to significant decrease of the ion temperature or to limiting the sustainment of the high ion-temperature state. To understand the effect of EIC on the energetic ion confinement, the radial transport of energetic ions is studied by means of the neutron flux monitor and vertical neutron camera newly installed on the LHD. Decreases of the line-integrated neutron profile in core channels show that helically-trapped energetic ions are lost from the plasma.

Analysis of the energetic sector through the national energetic matrix

International Nuclear Information System (INIS)

Garzon Lozano, Enrique

2007-01-01

The author shows the results of the national energetic balance 1975-2005, through the energetic matrix of the country, giving an annual growth of 5.1% in this period of offer of primary energy, where the mineral coal participates with 9,6%, the hydraulic energy with 4,8%, natural gas with 4,2%, trash with 2,4% and petroleum with 2,2%, while the firewood fell in 0,5%

Positron lifetime study of copper irradiated by energetic protons or energetic neutrons

International Nuclear Information System (INIS)

Howell, R.H.

1979-03-01

Positron lifetime measurements of pure copper damaged by irradiation with energetic protons and neutrons are presented. Lifetime determinations of the bulk material and various traps were made, and the dependence of the trapping rate on dose and irradiation energy were investigated. The results from the neutron- and proton-irradiated samples point to the existence of traps with similar but distinct lifetime parameters, not varying greatly from values reported in deformation studies. Also, a trap with long lifetime is seen for some proton irradiations, but is never seen for the neutron irradiations. The trapping rate of the short-lifetime trap is a linear function of dose for proton-irradiated samples and nearly so for the neutron irradiation. 1 figure

Scenery for final use of energy by light vehicles in the next 20 years: implications for a strategy of energetic sustainable development; Cenarios de uso final de energia por veiculos leves no Brasil nos proximos 20 anos: implicacoes para uma estrategia de desenvolvimento energetico sustentavel

Energy Technology Data Exchange (ETDEWEB)

Machado, Giovani; Szklo, Alexandre Salem; Schaeffer, Roberto; Pereira Junior, Amaro Olimpio; Mendes, Francisco Eduardo; Aragao, Amanda Pereira; Simoes, Andre Felipe [Universidade Federal do Rio de Janeiro (UFRJ), RJ (Brazil). Coordenacao dos Programas de Pos-graduacao de Engenharia (COPPE). Programa de Planejamento Energetico]. E-mail: giovani@ppe.ufrj.br

2006-07-01

This article synthesizes the main projection results for final use of energy consumed by light transportation vehicles on the next 20 years in Brazil, and evaluates their implications for a strategy of energetic sustainable development in Brazil. Arising out from previous studies performed for the Petroleum Brazilian Institute, for he Brazilian Ministry of Mines and Energy and for the IAEA, this article considers two sceneries: reference (REF) which considers significant changes, beyond those already consolidated; alternative (ALT), which considers progressive changes in the modal of transportation, in the energy efficiency and a augmented participation of 'clean' energy sources. Both sceneries estimates potential growing of light vehicles fleet, gain of energetic efficiency and a participation of bio fuels and VNG in Brazil, and the rhythm of the implementation. The results show the the difference between the final use of energy by light vehicles in REF (44 MtEP) in 2023 and in ALT (40 MtEP in 2023) can reach almost 10% during the next 20 years.

Bioaccumulation of chemical warfare agents, energetic materials, and metals in deep-sea shrimp from discarded military munitions sites off Pearl Harbor

Science.gov (United States)

Koide, Shelby; Silva, Jeff A. K.; Dupra, Vilma; Edwards, Margo

2016-06-01

The bioaccumulation of munitions-related chemicals at former military deep-water disposal sites is poorly understood. This paper presents the results of human-food-item biota sampling to assess the potential for bioaccumulation of chemical warfare agents, energetic materials, arsenic, and additional munitions-related metals in deep-sea shrimp tissue samples collected during the Hawai'i Undersea Military Munitions Assessment (HUMMA) project to date. The HUMMA investigation area is located within a former munitions sea-disposal site located south of Pearl Harbor on the island of O'ahu, Hawai'i, designated site Hawaii-05 (HI-05) by the United States Department of Defense. Indigenous deep-sea shrimp (Heterocarpus ensifer) were caught adjacent to discarded military munitions (DMM) and at control sites where munitions were absent. Tissue analysis results showed that chemical warfare agents and their degradation products were not present within the edible portions of these samples at detectable concentrations, and energetic materials and their degradation products were detected in only a few samples at concentrations below the laboratory reporting limits. Likewise, arsenic, copper, and lead concentrations were below the United States Food and Drug Administration's permitted concentrations of metals in marine biota tissue (if defined), and their presence within these samples could not be attributed to the presence of DMM within the study area based on a comparative analysis of munitions-adjacent and control samples collected. Based on this current dataset, it can be concluded that DMM existing within the HUMMA study area is not contributing to the bioaccumulation of munitions-related chemicals for the biota species investigated to date.

Volatility of components of saturated vapours of UCl/sub 4/-CsCl and UCl/sub 4/-LiCl molten mixtures

Energy Technology Data Exchange (ETDEWEB)

Smirnov, M V; Kudyakov, V Ya; Salyulev, A B; Komarov, V E; Posokhin, Yu V; Afonichkin, V K

1979-01-01

The flow method has been used for measuring the volatility of the components from UCl/sub 4/-CsCl and UCl/sub 4/-LiCl melted mixtures containing 2.0, 5.0, 12.0, 25.0, 33.0, 50.0, 67.0, and 83.0 mol.% of UCl/sub 4/ within the temperature ranges of 903-1188 K and 740-1200 K, respectively. The chemical composition of saturated vapours above the melted salts has been determined. The melted mixtures in question exhibit negative deviation from ideal behaviour. Made was the conclusion about the presence in a vapour phase, along with monomeric UCl/sub 4/, LiCl, CsCl and Li/sub 2/Cl/sub 2/, Cs/sub 2/Cl/sub 2/ dimers of double compounds of the MeUCl/sub 5/ most probable composition. Their absolute contribution into a total pressure above the UCl/sub 4/-CsCl melted mixtures is considerably smaller than above the UCl/sub 4/ -LiCl mixtures.

Reversible conversion between AgCl and Ag in AgCl-doped RSiO{sub 3/2}-TiO{sub 2} films prepared by a sol-gel technique

Energy Technology Data Exchange (ETDEWEB)

Kawamura, Go, E-mail: gokawamura@ee.tut.ac.jp [Department of Electrical and Electronic Information Engineering, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Tsurumi, Yuuki [Department of Environmental and Life Sciences, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Muto, Hiroyuki [Department of Electrical and Electronic Information Engineering, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Department of Environmental and Life Sciences, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Sakai, Mototsugu; Inoue, Mitsuteru [Department of Electrical and Electronic Information Engineering, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Matsuda, Atsunori [Department of Electrical and Electronic Information Engineering, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan); Department of Environmental and Life Sciences, Toyohashi University of Technology, Toyohashi, Aichi 441-8580 (Japan)

2011-10-17

Highlights: {center_dot} The reversible redox behavior between AgCl and Ag in RSiO{sub 3/2}-TiO{sub 2} film is studied. {center_dot} TiO{sub 2} component induces Cl to remain in the film after conversion of AgCl to Ag. {center_dot} The survival of Cl is essential for reconversion of Ag to AgCl. {center_dot} The film shows potential to be applied as rewritable holographic material. - Abstract: The reversible redox behavior exhibited by AgCl-doped organosilsesquioxane-titania gel films is studied. Films prepared by the sol-gel method show reversible color changes with blue laser irradiation and subsequent heat treatment, which is based on the formation of Ag and AgCl nanoparticles, respectively. Two-beam interference exposure experiments reveal that the films have potential to be applied as rewritable holographic materials. A large titania content is essential for the conversion of Ag to AgCl because it induces the Cl to remain near the Ag nanoparticles during blue laser irradiation, allowing the Cl to react with neighboring Ag nanoparticles to reform AgCl upon subsequent heat treatment.

Energetics of dislocation transformations in hcp metals

International Nuclear Information System (INIS)

Wu, Zhaoxuan; Yin, Binglun; Curtin, W.A.

2016-01-01

Dislocation core structures of hcp metals are highly complex and differ significantly among the hcp family. Some dislocations undergo unconventional transformations that have significant effects on the material plastic flow. Here, the energetics of dislocation dissociations are analyzed in a general anisotropic linear elastic theory framework for transformations in which changes in the partial Burgers vectors are small. Quantitative analyses on various transformations are made using DFT-computed stacking fault energies and partial Burgers vectors. Specifically, possible transformations of the mixed, edge, and screw 〈c+a〉 and screw 〈a〉 dislocations in 6 hcp metals (Mg, Ti, Zr, Re, Zn, Cd) are studied. Climb dissociation of mixed or edge 〈c+a〉 dislocations to the Basal plane is energetically favorable in all 6 metals and thus only limited by thermal activation. The 〈c+a〉 screw dislocation is energetically preferable on Pyramidal I for Ti, Zr, and Re, and on Pyramidal II for Zn and Cd. In Mg, the energy difference between screw 〈c+a〉 on Pyramidal I and II planes is small, suggesting relatively easy cross-slip. For the screw 〈a〉, Basal dissociation is energetically favorable in Mg, Re, Zn and Cd, while Prism dissociation is strongly favorable in Ti and Zr. Only Ti, Zr and Re show a metastable state for dissociation on the Prism plane, and the energy difference between screw 〈a〉 on the Prism and Pyramidal I planes is relatively small in all systems, suggesting relatively easy cross-slip of 〈a〉 in Ti and Zr. The elastic analysis thus provides a single framework able to capture the controlling energetics for different dissociations and slip systems in hcp metals. When the calculated energy differences are very small, the results point to the need for detailed modeling of the atomistic core structure. Moreover, the analyses rationalize broad experimental observations on dominant slip systems and dislocation behaviours, and provide

Multi-body forces and the energetics of transition metals, alloys, and semiconductors

International Nuclear Information System (INIS)

Carlsson, A.E.

1992-01-01

Progress over the past year is divided into 3 areas: potential-energy functions for transition-metal aluminides; electronic structure and energetics of complex structures and quasicrystals; and ceramic materials (PdO, PtO)

Liquid-vapor equilibrium in LaCl3-LuCl3 and PrCl3-NdCl3 systems

International Nuclear Information System (INIS)

Nisel'son, L.A.; Lyzlov, Yu.N.; Solov'ev, S.I.

1978-01-01

The liquid-vapour equilibrium in the systems LaCl 3 -LuCl 3 and PrCl 3 -NdCl 3 was studied by the boiling-point method. It was established that the system LaCl 3 -LuCl 3 is near-ideal. In the PrCl 3 -NdCl 3 system, a considerable positive deviation from the ideal with the formation of an azeotrope was detected. The azeotrope has a ''smeared-out'' minimum, which falls on a mixture containing approximately 65 mol.% neodymium trichloride. The boiling point of this mixture at a pressure of 1 mm Hg is approximately 975 deg C. The relative volatility coefficients in both systems were studied by the Raleigh distillation method. The presence of the azeotrope in the system PrCl 3 -NdCl 3 is confirmed by the nature of the dependence of the relative volatility coefficient on the composition of the mixture

Heat capacity of Sr10(PO4)6Cl2 and Ca10(PO4)6Cl2 by DSC

International Nuclear Information System (INIS)

Venkata Krishnan, R.; Jena, Hrudananda; Govindan Kutty, K.V.; Nagarajan, K.

2008-01-01

Strontium and calcium chloroapatites were synthesized by wet chemical method, characterized by X-ray diffraction and are found to be phase pure materials. The measured room temperature lattice parameter of Ca 10 (PO 4 ) 6 Cl 2 is a = 9.523 A, c = 6.855 A and for Sr 10 (PO 4 ) 6 Cl 2 is a = 9.876 A, c = 7.188 A. Heat capacity measurements were carried out on Ca 10 (PO 4 ) 6 Cl 2 and Sr 10 (PO 4 ) 6 Cl 2 by DSC in the temperature range 298-800 K. The heat capacity values of Sr 10 (PO 4 ) 6 Cl 2 is higher at all temperatures than Ca 10 (PO 4 ) 6 Cl 2 . Enthalpy and entropy increments were computed. Heat capacity values of Ca 10 (PO 4 ) 6 Cl 2 and Sr 10 (PO 4 ) 6 Cl 2 at 298 K are 758 and 868 J K -1 mol -1 , respectively

Flare energetics

Science.gov (United States)

Wu, S. T.; Dejager, C.; Dennis, B. R.; Hudson, H. S.; Simnett, G. M.; Strong, K. T.; Bentley, R. D.; Bornmann, P. L.; Bruner, M. E.; Cargill, P. J.

1986-01-01

In this investigation of flare energetics, researchers sought to establish a comprehensive and self-consistent picture of the sources and transport of energy within a flare. To achieve this goal, they chose five flares in 1980 that were well observed with instruments on the Solar Maximum Mission, and with other space-borne and ground-based instruments. The events were chosen to represent various types of flares. Details of the observations available for them and the corresponding physical parameters derived from these data are presented. The flares were studied from two perspectives, the impulsive and gradual phases, and then the results were compared to obtain the overall picture of the energics of these flares. The role that modeling can play in estimating the total energy of a flare when the observationally determined parameters are used as the input to a numerical model is discussed. Finally, a critique of the current understanding of flare energetics and the methods used to determine various energetics terms is outlined, and possible future directions of research in this area are suggested.

Energetic balance from biodiesel production of oilseed radish (Raphanus sativus L.)

Energy Technology Data Exchange (ETDEWEB)

Siqueira, Rubens [Parana Agronomical Institute (IAPAR), Londrina, PR (Brazil)], E-mail: siqueira@iapar.br; Gamero, Carlos Antonio [Universidade Estadual Paulista (FCA/UNESP), Botucatu, SP (Brazil). Fac. de Ciencias Agronomicas; Boller, Walter [University of Passo Fundo (UPF), RS (Brazil). Agronomical and Veterinary College

2008-07-01

It was evaluated the energetic balance and the energetic efficiency of the oilseed radish (Raphanus sativus L.) crop under the no-tillage system. The energy input totalized 6,718 MJ ha{sup -1} where the industrial processing, the fertilizer and the herbicide had participation of 30.7; 23.0 and 20.2 %, respectively. The energy production was 56,650.94 MJ ha{sup -1} and the produced grains have represented 33.2 % of the total. The energetic demand for the production of one kg of biomass of the aerial part, one kg of oil and one kg of biodiesel were respectively 1,829; 19,000 and 27,422 kJ. There was a return of 8.44 for each energy unit used in the process. The net gain of energy was 49,932 MJ ha{sup -1} which is equivalent in energy to 1,295 L diesel oil. (author)

Toward a Modular Ionic Liquid Platform for the Custom Design of Energetic Materials: Understanding How the Dual Nature of Ionic Liquids Relates Key Physical Properties to Target Structures

Science.gov (United States)

2009-11-30

Separations to Advanced Materials to Pharmaceuticals: Energetic and API Examples from the Ionic Liquid Cookbook" Presented by R. D. Rogers, before the 2nd...3322 (s), 3219 (s), 3144 (s), 1687 (m), 1571 (s), 1516 (s), 1468 (m), 1435 (m), 1380 (s), 1277 (s), 1205 (s), 1139 (s), 1104 (w), 1043 (w), 1014 (s

The role of energetic ions from plasma in the creation of nanostructured materials and stable polymer surface treatments

International Nuclear Information System (INIS)

Bilek, M.M.M.; Newton-McGee, K.; McKenzie, D.R.; McCulloch, D.G.

2006-01-01

Plasma processes for the synthesis of new materials as thin films have enabled the production of a wide variety of new materials. These include meta-stable phases, which are not readily found in nature, and more recently, materials with structure on the nanoscale. Study of plasma synthesis processes at the fundamental level has revealed that ion energy, depositing flux and growth surface temperature are the critical parameters affecting the microstructure and the properties of the thin film materials formed. In this paper, we focus on the role of ion flux and impact energy in the creation of thin films with nanoscale structure in the form of multilayers. We describe three synthesis strategies, based on the extraction of ions from plasma sources and involving modulation of ion flux and ion energy. The microstructure, intrinsic stress and physical properties of the multilayered samples synthesized are studied and related back to the conditions at the growth surface during deposition. When energetic ions of a non-condensing species are used, it is possible to place active groups on the surfaces of materials such as polymers. These active groups can then be used as bonding sites in subsequent chemical attachment of proteins or other macromolecules. If the energy of the non-condensing ions is increased to a few keV then modified layers buried under the surface can be produced. Here we describe a method by which the aging effect, which is often observed in plasma surface modifications on polymers, can be reduced and even eliminated using high energy ion bombardment

A new 36Cl hydrological model and 36Cl systematics in the Jordan River/Dead Sea system

International Nuclear Information System (INIS)

Paul, M.; Fink, D.; Meirav, O.; Kaim, R.

1986-01-01

Accelerator mass spectrometry results of 36 Cl for the Jordan River/Dead Sea system show that the amount of chloride leached from rocks ranges from approx. 70% in source springs to >90% in water bodies downstream. Furthermore, the amount of water left after evaporation decreases from approx. 50% in the source springs to 20% in the intermediate Lake Kinneret. In the terminal Dead Sea, 99% of the stable chloride originates from ancient rocks and evaporite formations while approx. 80% of its 36 Cl content is of meteoric origin. Using 36 Cl measurements, the accumulation time of the Dead Sea salt is estimated to be 19,000-25,000 yr. (author)

Some new high energy materials and their formulations for specialized applications

Energy Technology Data Exchange (ETDEWEB)

Agrawal, Jai Prakash [Directorate of Materials, DRDO HQrs, ' B' Wing, Sena Bhavan, New Delhi - 110 011 (India)

2005-10-01

Energetic materials form an integral part of most weapon systems and a large number of new high-energy materials: thermally stable explosives, high-performance explosives, melt-castable explosives, insensitive high explosives and energetic binders have been reported in the literature in recent years. Some explosive formulations based on these new energetic materials are also vaguely reported. This paper examines these materials and their formulations from the point of view of stability, reliability, safety and specific applications. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

Dual scattering foil design for poly-energetic electron beams

International Nuclear Information System (INIS)

Kainz, K K; Antolak, J A; Almond, P R; Bloch, C D; Hogstrom, K R

2005-01-01

The laser wakefield acceleration (LWFA) mechanism can accelerate electrons to energies within the 6-20 MeV range desired for therapy application. However, the energy spectrum of LWFA-generated electrons is broad, on the order of tens of MeV. Using existing laser technology, the therapeutic beam might require a significant energy spread to achieve clinically acceptable dose rates. The purpose of this work was to test the assumption that a scattering foil system designed for a mono-energetic beam would be suitable for a poly-energetic beam with a significant energy spread. Dual scattering foil systems were designed for mono-energetic beams using an existing analytical formalism based on Gaussian multiple-Coulomb scattering theory. The design criterion was to create a flat beam that would be suitable for fields up to 25 x 25 cm 2 at 100 cm from the primary scattering foil. Radial planar fluence profiles for poly-energetic beams with energy spreads ranging from 0.5 MeV to 6.5 MeV were calculated using two methods: (a) analytically by summing beam profiles for a range of mono-energetic beams through the scattering foil system, and (b) by Monte Carlo using the EGS/BEAM code. The analytic calculations facilitated fine adjustments to the foil design, and the Monte Carlo calculations enabled us to verify the results of the analytic calculation and to determine the phase-space characteristics of the broadened beam. Results showed that the flatness of the scattered beam is fairly insensitive to the width of the input energy spectrum. Also, results showed that dose calculated by the analytical and Monte Carlo methods agreed very well in the central portion of the beam. Outside the useable field area, the differences between the analytical and Monte Carlo results were small but significant, possibly due to the small angle approximation. However, these did not affect the conclusion that a scattering foil system designed for a mono-energetic beam will be suitable for a poly-energetic

36Cl measurements of Hiroshima concrete samples

International Nuclear Information System (INIS)

Matsuhiro, T.; Nagashima, Y.; Seki, R.; Takahashi, T.

2002-01-01

The 36 Cl AMS studies are reported. A new steps of procedure of a sample preparation is developed and a tremendous reduction of sulphur background has been achieved. The 36 Cl contents of two atomic bombed concrete samples, old Hiroshima Bank one and Gokoku Shrine one, have been measured as a function of 36 Cl to Cl ratio by the Tsukuba AMS system. The 36 Cl to Cl ratio of the old Hiroshima Bank sample shows very nice agreement with the result of γ measurement of 152 Eu. Otherwise, the ratio is about 20% smaller than an estimation by the DS86 dosimetry system. A result of the Gokoku Shrine sample is also smaller than a depth profile estimation by the same DS86. It might be clear that the DS86 has a tendency of overestimation. It seems that a calculation method and/or the parameters used in the calculation are requested to be improved. (author)

Coordination Architectures of energetic Cd (II) coordination polymers constructed by the bifunctional substituted-tetrazole-carboxylate ligands

Energy Technology Data Exchange (ETDEWEB)

Shen, Lei; Bai, Yu; Min, Yu-Ting; Jia, Tian-Tian; Wu, Qi; Wang, Jing; Geng, Fei; Cheng, Hong-Jian [Department of Chemistry & Materials Engineering, Jiangsu Key Laboratory of Advanced Functional Materials, Changshu Institute of Technology, Changshu 215500 (China); Zhu, Dun-Ru [College of Chemical Engineering, State Key Laboratory of Materials-oriented Chemical Engineering, Nanjing Tech University, Nanjing 210009 (China); Yang, Jie, E-mail: jieyang@cslg.edu.cn [Department of Chemistry & Materials Engineering, Jiangsu Key Laboratory of Advanced Functional Materials, Changshu Institute of Technology, Changshu 215500 (China); Yang, Gao-Wen, E-mail: ygwsx@126.com [Department of Chemistry & Materials Engineering, Jiangsu Key Laboratory of Advanced Functional Materials, Changshu Institute of Technology, Changshu 215500 (China)

2016-12-15

Three different tetrazole-carboxylate ligands, monotetrazole-carboxylate H{sub 2}tza (H{sub 2}tza=1,5-tetrazole-diacetic acid), Hpztza (Hpztza=5-(2-pyrazinyl)tetrazole-2(1-methyl)acetic acid), ditetrazole-carboxylate H{sub 2}tzpha (H{sub 2}tzpha=1,3-di(tetrazole-5-yl)benzene-N2,N2′-diacetic acid) have been chosen to react with CdCl{sub 2}·6H{sub 2}O, resulting in the formation of three new compounds [Cd{sub 2}(tza){sub 2}] (1), [Cd(pztza){sub 2}] (2) and [Cd(tzpha)(CH{sub 3}OH){sub 2}] (3). The coordinate sites of the three ligands are major influenced by the different substituted group of tetrazole ring. These compounds have been characterized by elemental analysis, IR and single crystal X-ray diffraction. Compound 1 displays a complex 3D structure; compound 2 shows a 3D network and compound 3 features a 2D layer network. Furthermore, the luminescence properties investigated at room temperature in the solid state showed excellent ligand-centered luminescence. The obvious enhancement in luminescence makes these compounds potential materials for optical use. The differential scanning calorimetry (DSC) and thermogravimetric-differential thermogravimetric (TG-DTG) analyses were applied to evaluate the thermal decomposition behavior of such compounds, showing that compounds 2 and 3 can be used as potential energetic materials. The relevant thermodynamic parameters ΔH, ΔS and ΔG were calculated as well. - Graphical abstract: H{sub 2}tza, Hpztza and H{sub 2}tzpha have been prepared. Three novel Cd (II)compounds were synthesized by reactions of CdCl{sub 2}·6H{sub 2}O, namely three dimensional [Cd{sub 2}(tza){sub 2}] (1), three dimensional [Cd(pztza){sub 2}] (2), and two dimensional [Cd(tzpha)(CH{sub 3}O){sub 2}] (3). The luminescences were investigated. Furthermore, the DSC show compounds 1 and 3 can be used as potential explosive materials.

Yttria-stabilized zirconia as membrane material for electrolytic deoxidation of CaO-CaCl{sub 2} melts

Energy Technology Data Exchange (ETDEWEB)

Martin, A.; Poignet, J. C.; Fouletier, J. [Univ Grenoble, LEPMI, CNRS, INPG, UJF, F-38402 St Martin Dheres (France); Allibert, M. [LPSC, F-38026 Grenoble 1 (France); Lambertin, D. [SPDE, CEA Marcoule, F-30207 Bagnols Sur Ceze (France); Bourges, G. [SRPU, CEA Valduc, F-21120 Is Sur Tille (France)

2010-07-01

This article is devoted to the study of the stability of an yttria-stabilized zirconia membrane used in the electrolysis of molten CaCl{sub 2}-CaO mixtures at 850 degrees C. Intentiostatic and potentiostatic electrolysis were carried for periods ranging from 10 to 20 h. Post-mortem composition profiles across the zirconia membrane were determined using Raman spectroscopy and microprobe analysis. The membrane degradation was analyzed in terms of synergetic parameters, i. e., chemical, electrochemical, and thermomechanical effects. (authors)

Intrinsic thermoluminescence of NaCl:Tl in UV dosimetry

International Nuclear Information System (INIS)

Barghare, S.P.; Joshi, R.V.; Joshi, T.R.; Kathuria, S.P.

1982-01-01

NaCl:Tl(T) phosphor is found to have high intrinsic thermoluminescence (TL) sensitivity to 253.7 nm UV-radiation. The dosimetric glow peak II grows sublinearly with increase in UV dose in the range 10 3 to 10 6 JM -2 . The other requirements of an efficient dosimeter material such as high storage stability, matching of the spectral response of detector tube and TL-emission from phosphor, reproducibility, desirable size and shape, easy availability in powder, pellet and crystal forms at cheaper rates, and repeated re-usability of the same phosphor without much difficulty, etc., are additional factors which strengthen the claim of NaCl:Tl(T) phosphor as UV dosimetric material. It is proposed that present NaCl:Tl(T) material is suitable TL-phosphor for UV dosimetry in the range 10 3 to 10 6 JM -2 . (author)

Reduction behaviors of Zr for LiCl-KCl-ZrCl4 and LiCl-KCl-ZrCl4-CdCl2

International Nuclear Information System (INIS)

Kim, Si Hyung; Yoon, Jongho; Kim, Gha Young; Kim, Tack Jin; Shim, Joon Bo; Kim, Kwang Rag; Jung, Jae Hoo; Ahn, Do Hee; Paek, Seungwoo

2013-01-01

The reduction potentials of most of the zirconium ions on the solid cathode are smaller (about 0.4V) than that of uranium, and thus zirconium can be recovered prior to uranium during the reduction stage. In the case of a liquid cadmium cathode, which is one of the major cathodes, the reduction potential can be changed because zirconium reacts with the liquid cadmium. Up to now, it has not been well known what the reduction potential of Zr was on the liquid Cd cathode. According to the Cd-Zr phase diagram, there are four intermetallic compounds between cadmium and zirconium. It is easier to use the solid cathode than the liquid cadmium cathode in LiCl-KCl-ZrCl 4 containing CdCl 2 to identify the formation of the Cd-Zr phase. In this study, the reduction behaviors of zirconium were compared in the LiCl-KCl-ZrCl 4 and LiCl-KCl-ZrCl 4 -CdCl 2 solutions when using a solid cathode. The reduction behavior of Zr at a solid W cathode and a Cd-coated W cathode was compared in a LiCl-KCl-ZrCl 4 solution at 500 .deg. C. It was observed from the results using a solid W cathode that Zr 4+ ions were gradually oxidized to Zr 2+ , Zr, and ZrCl during the reduction sweep, but the final oxidation peak of Zr 2+ to Zr 4+ seemed to be unclear during the oxidation sweep. In the case of the Cd-coated W electrode, only a Cd 2 Zr phase was formed at 500 .deg. C, which seemed to be related to the melting point of Cd-Zr intermetallics. Through additional studies at different temperatures, the formation behavior will be studied

Catalysis of the reduction of Tl+ and of CH2Cl2 by colloidal silver in aqueous solution

International Nuclear Information System (INIS)

Henglein, A.

1979-01-01

(CH 3 ) 2 COH radicals (1-hydroxy-1-methylethyl) do not reduce Tl + or CH 2 Cl 2 in homogeneous aqueous solution. In the presence of 2.5 x 10 -4 g atom/L of colloidal silver, Tl + is reduced to yield colloidal thallium, and CH 2 Cl 2 to yield Cl - plus CH 3 Cl. These reactions occur in competition with the silver-catalyzed reduction of water. Tl + is reduced in a one-electron transfer reaction and CH 2 Cl 2 in a two-electron transfer process. The effects are understood in terms of the colloidal particles acting as a pool for electrons that is continuously charged by the organic radicals and discharged by water or dissolved substrates. The specific rate for the CH 2 Cl 2 reduction at the silver pool is 4.3 x 10 3 times greater than that of the water reduction. Electrochemical considerations are carried out to estimate a stationary potential of -0.62 V (vs the standard hydrogen electrode) for the electron pool and to discuss the energetics of the observed reactions and the possible role of adsorbed hydrogen atoms. Colloidal silver and organic radicals were radiolytically produced. 7 figures

10 CFR 20.2201 - Reports of theft or loss of licensed material.

Science.gov (United States)

2010-01-01

... 10 Energy 1 2010-01-01 2010-01-01 false Reports of theft or loss of licensed material. 20.2201... § 20.2201 Reports of theft or loss of licensed material. (a) Telephone reports. (1) Each licensee shall... or theft occurred; and (iii) A statement of disposition, or probable disposition, of the licensed...

Climate protection, natural resources management and soil improvement by combined Energetic and Material Utilization of lignocellulosic agricultural WAstes and residues (CEMUWA); Klimaschutz, Naturressourcenschutz und Bodenverbesserung durch kombinierte energetische und stoffliche Verwertung lignozelluloser landwirtschaftlicher Abfaelle und Reststoffe

Energy Technology Data Exchange (ETDEWEB)

Schuech, Andrea; Nelles, Michael; Tscherpel, Burckhard; El Behery, Ahmed; Menanz, Rania; Bahl, Hubert; Scheel, Michael; Nipkow, Mareen

2015-07-01

The project Climate protection, natural resources management and soil improvement by combined Energetic and Material Utilization of lignocellulosic agricultural WAstes and residues (CEMUWA) was implemented with long-term partners from Egypt and Germany leaded by the Department Waste Management and Material Flow from September 2011 until October 2013. Aim of the project was the development of technologies for the utilization of agricultural wastes and residues at the example of rice straw, with the focus on the energetic and material use. In the long term a contribution to climate protection and natural resource management could be reached. The focus was on investigations in the field of biogas, ethanol and butanol production including pretreatment as well as the material use in horticulture. The results show that the biogas and ethanol production with adapted pretreatments of rice straws is possible. The technical adaptation of a biogas plant (eo-digestion) would be associated with about 20% higher investment costs and higher operating costs with an approximately 15% higher energy demand. In Germany, however, this may still economically by the substitution of expensive or difficult available energy crops (reduction of substrate costs by 30 to 35% for a 600 kWel-BGP using maize silage). The investigated solutions for material use in Egypt showed good results, which in some cases exceeded the expectations. By the use of rice straw imported peat substrates could be substitute or irrigation water saved, what is ecologically and economically useful. The production of ethanol from rice straw was implemented on laboratory scale and preconditions for investigations in semi-industrial and partly pilot scale were created. The bilateral project'' was funded in the framework of the German-Egypt-Research-Fond (GERF) by the German Federal Ministry of Education and Research (BMBF) and the Egyptian Science and Technology Development Fund in Egypt (STDF). The total budget

?????????? ?????, ?????????? ??????????? ?? ?????????? ?????????? ????? ? ?????? ???????? ZnCl2 +NH4Cl

OpenAIRE

Kuntyi, Orest; Zozulya, Galyna

2010-01-01

Zinc cementation by magnesium from ZnCl2 + NH4Cl aqueous solutions has been investigated. The amount of magnesium has been established as 0.8?2.0 g per 1 g of conditioned zinc to obtain recovery degree ? 99 %. At low concentrations of Zn2+ ions (0.025?0.1 M ZnCl2) dispersed deposit is formed with nanoparticles of reduced metal; at high concentrations (0.25?0.5 M) coarse-crystalline and fern-shaped deposit is formed. ?????????? ?????????? ????? ??????? ? ?????? ???????? ZnCl2 + NH4Cl. ????????...

Musical Tasks and Energetic Arousal.

Science.gov (United States)

Lim, Hayoung A; Watson, Angela L

2018-03-08

Music is widely recognized as a motivating stimulus. Investigators have examined the use of music to improve a variety of motivation-related outcomes; however, these studies have focused primarily on passive music listening rather than active participation in musical activities. To examine the influence of participation in musical tasks and unique participant characteristics on energetic arousal. We used a one-way Welch's ANOVA to examine the influence of musical participation (i.e., a non-musical control and four different musical task conditions) upon energetic arousal. In addition, ancillary analyses of participant characteristics including personality, age, gender, sleep, musical training, caffeine, nicotine, and alcohol revealed their possible influence upon pretest and posttest energetic arousal scores. Musical participation yielded a significant relationship with energetic arousal, F(4, 55.62) = 44.38, p = .000, estimated ω2 = 0.60. Games-Howell post hoc pairwise comparisons revealed statistically significant differences between five conditions. Descriptive statistics revealed expected differences between introverts' and extraverts' energetic arousal scores at the pretest, F(1, 115) = 6.80, p = .010, partial η2= .06; however, mean differences failed to reach significance at the posttest following musical task participation. No other measured participant characteristics yielded meaningful results. Passive tasks (i.e., listening to a story or song) were related to decreased energetic arousal, while active musical tasks (i.e., singing, rhythm tapping, and keyboard playing) were related to increased energetic arousal. Musical task participation appeared to have a differential effect for individuals with certain personality traits (i.e., extroverts and introverts).

Synthesis of Co-Al-Cl LDH by cathodic material reprocessing from cellular phone batteries

Energy Technology Data Exchange (ETDEWEB)

Amaral, Fabio Augusto do; Machado, Erica Oliveira; Freitas, Leonardo Luis de; Santana, Laiane Kalita; Canobre, Sheila Cristina, E-mail: fabioamaral@yahoo.com.br, E-mail: fabioamaral@iqufu.ufu.br [Universidade Federal de Uberlandia (UFU/LAETE), (Brazil). Inst. de Quimica. Lab. de Armazenamento de Energia e Tratamento de Efluente

2014-08-15

The aim of this paper was the recovering of the cathodic material from discarded lithium ion batteries for obtainment of the lamellar double hydroxides (LDHs) by the co-precipitation method at variable pH in HCl and H{sub 2}O{sub 2} 1:1 (v/v) acid solution containing Co and Al (extracted from cathodic material composed of LiCoO{sub 2} and aluminum foil). These metals were precipitated in LiOH at pH 9 or 11, or NH{sub 4}OH at pH 9 and submitted to the hydrothermal treatment (HT) to improve the structural organization of the LDHs lamellae. After precipitation, the resulting solids were structurally characterized by XRD for phase identification and calculation of the unit cell parameter, thermally by TGA for the identification of the mass loss and morphologically by SEM. The sample obtained by precipitation with LiOH at pH 11 / hydrothermal treatment showed diffraction peaks similar to hydrotalcite, morphological and thermal characteristics similar to the pattern Co-Al-Cl LDH obtained by co-precipitation at constant pH 8. (author)

Explosibility of Energetic Material Dusts

Science.gov (United States)

1981-01-01

Leri st ics of hail powder and M-I 78 20 S,11,II11 in1l at 16adford Army Ammmnition Plant 79 2 ;’/ Salp Ii n.g it Ini ana Army Am;wiunition Plant I 2... travel only a short distance. Another mode of dispersion is diffusion, which is relatively slow. The third and primary mode of dispersion is transport by

Flexible electromagnetic wave sensor operating at GHz frequencies for instantaneous concentration measurements of NaCl, KCl, MnCl2 and CuCl solutions

International Nuclear Information System (INIS)

Korostynska, O; Ortoneda-Pedrola, M; Mason, A; Al-Shamma'a, A I

2014-01-01

A novel electromagnetic wave sensor operating at GHz frequencies for real-time chlorides concentration analysis is reported. The sensor response to deionized water, NaCl, KCl, MnCl 2  and CuCl solutions at various concentrations was tested. The sensing element, in the form of a silver pattern antenna that emits an electromagnetic field, was printed on a polyimide flexible laminate substrate to form a sensor to suit a broad range of applications, where a sensor could be placed in water reservoirs or fluid-carrying pipes for continuous analysis. The developed system confirmed the viability of using microwaves for real-time chloride solutions monitoring as the reflected signals represented by S 11  parameters were unique with clearly observed shifts in the resonant frequencies and amplitude changes when placed in direct contact with 20 µl of each solution. (paper)

36Cl in shallow, perched aquifers from central Indiana

Science.gov (United States)

Vogt, S.; Elmore, D.; Fritz, S. J.

1994-06-01

36Cl/Cl ratios and chloride concentrations were measured in several shallow, perched aquifers situated within glacial till in west-central Indiana (USA). Most of these aquifers show 36Cl/Cl ratios which have to be attributed to admixed 36Cl from nuclear weapons tests in the 1950s and 1960s. Two wells from Purdue's Horticultural Farm tap perched aquifers uninfluenced by anthropogenic sources of chloride, and their 36Cl/Cl ratios are comparable with ratios measured in modern, local precipitation. As such, the chloride contents of these wells (1 to 3 ppm) reflect evaporative concentration of the precipitation's chloride contents (averaging 0.17 ppm) in the vadose zone. Since one of these two wells (HA-2a) does not contain any detectable tritium, we conclude that recent pre-bomb 36Cl/Cl ratios and 36Cl deposition in precipitation are quite similar to those in modern precipitation. We attribute the slight 36Cl excess of about 20% in both of these wells largely to 36Cl deposition associated with dry fall-out. As much as 2 × 10 4 at. 36Cl/cm 2 might reach the surface via dry fall-out annually.

Energetic rationale for an unexpected and abrupt reversal of guanidinium chloride-induced unfolding of peptide deformylase.

Science.gov (United States)

Berg, Alexander K; Manokaran, Sumathra; Eiler, Daniel; Kooren, Joel; Mallik, Sanku; Srivastava, D K

2008-01-01

Peptide deformylase (PDF) catalyzes the removal of formyl group from the N-terminal methionine residues of nascent proteins in prokaryotes, and this enzyme is a high priority target for antibiotic design. In pursuit of delineating the structural-functional features of Escherichia coli PDF (EcPDF), we investigated the mechanistic pathway for the guanidinium chloride (GdmCl)-induced unfolding of the enzyme by monitoring the secondary structural changes via CD spectroscopy. The experimental data revealed that EcPDF is a highly stable enzyme, and it undergoes slow denaturation in the presence of varying concentrations of GdmCl. The most interesting aspect of these studies has been the abrupt reversal of the unfolding pathway at low to moderate concentrations of the denaturant, but not at high concentration. An energetic rationale for such an unprecedented feature in protein chemistry is offered.

Composition of heavy ions in solar energetic particle events

International Nuclear Information System (INIS)

Fan, C.Y.; Gloeckler, G.

1983-01-01

The elemental, charge state, and isotopic composition of approximately 1 to 20 MeV per nucleon ions in solar energetic particle (SEP) events was determined and current understanding of the nature of solar and interplanetary processes which may explain the observations are outlined. The composition within individual SEP events may vary both with time and energy, and will in general be different from that in other SEP events. Average values of relative abundances measured in a large number of SEP events, however are found to be roughly energy independent in the approximately 1 to approximately 20 MeV per nucleon range, and show a systematic deviation from photospheric abundances which seem to be organized in terms of the first ionization potential of the ion. Direct measurements of the charge states of SEPs have revealed the surprisingly common presence of energetic He(+) along with heavy ions with typical coronal ionization states. High resolution measurements of isotopic abundance ratios in a small number of SEP events show these to be consistent with the universal composition except for the puzzling overabundance of the SEP Ne-22 relative to this isotopes ratio in the solar wind

Near-Resonant Thermomechanics of Energetic and Mock Energetic Composite Materials

Science.gov (United States)

2016-11-01

record frequency responses and operational deflection shapes. Simultaneously, a FLIR A325 infrared camera was used to capture the temperature...distribution of the top surface of the plate using infrared thermography. The experimental setup is depicted in Figure 4. The results obtained from this and...the inelastic behavior of many materials like metals [12,13], concrete [14], soils [15], metal matrix composites [16], filled rubber [17], Asphalt

Manipulating Single Microdroplets of NaCl Solutions

DEFF Research Database (Denmark)

Utoft, Anders; Kinoshita, Koji; Bitterfield, Deborah

2018-01-01

fraction of S = 1.9, the saturation concentration of NaCl in aqueous solution as measured with nanograms of material (5.5 ± 0.1 M), the diffusion coefficient for water in octanol, D = (1.96 ± 0.10) × 10−6 cm2/s, and the effect of the solvent’s activity on dissolution kinetics. It is further shown...... growth are affected by changing the bathing medium from octanol to decane. A much slower loss of water-solvent and concomitant slower up-concentration of the NaCl solute resulted in a lower tendency to nucleate and slower crystal growth because much less excess material was available at the onset...... of nucleation in the decane system as compared to the octanol system. Thus, the crystal structure is reported to be dendritic for NaCl solution microdroplets dissolving rapidly and nucleating violently in octanol, while they are formed as single cubic crystals in a gentler way for solution-dissolution in decane...

Características clínicas gingivales de pacientes portadores de prótesis fija tratados en una clínica dental docente

OpenAIRE

Huivín-Rodríguez, Rosa Raquel; Gonzáles-Pinedo, Gian Marco; Chávez-Reátegui, Beatriz Del Carmen; Manrique-Chávez, Jorge Enrique

2015-01-01

Objetivo: Identificar las características clínicas gingivales de las piezas portadoras de prótesis fijas (PF) de pacientes que acudieron a la Clínica Dental Docente de la Universidad Peruana Cayetano Heredia, para ser atendidos por alumnos de pregrado, el año 2012. Material y métodos: Estudio de diseño retrospectivo con un universo conformado por historias clínicas de pacientes portadores de prótesis fijas. Resultados: De las 196 historias clínicas evaluadas, se encontraron: 250 prótesis fija...

Kinetic isotope effects in the gas phase reactions of OH and Cl with CH3Cl, CD3Cl, and 13CH3Cl

Directory of Open Access Journals (Sweden)

A. A. Gola

2005-01-01

Full Text Available The kinetic isotope effects in the reactions of CH3Cl, 13CH3Cl and CD3Cl with OH radicals and Cl atoms were studied in relative rate experiments at 298±2 K and 1013±10 mbar. The reactions were carried out in a smog chamber using long path FTIR detection and the spectroscopic data analyzed employing a non-linear least squares spectral fitting method using measured high-resolution infrared spectra as well as absorption cross sections from the HITRAN database. The reaction rates of 13CH3Cl and CD3Cl with OH and Cl were determined relative to CH3Cl as: kOH+CH3ClkOH+CH3Cl/kOH+13CH3Cl}kOH+13CH3Cl=1.059±0.008, kOH+CH3ClkOH+CH3Cl/kOH+CD3ClkOH+CD3Cl=3.9±0.4, kCl+CH3ClkCl+CH3Cl/kCl+13CH3ClkCl+13CH3Cl =1.070±0.010 and kCl+CH3ClkCl+CH3Cl/kCl+CD3ClkCl+CD3Cl=4.91±0.07. The uncertainties given are 2σ from the statistical analyses and do not include possible systematic errors. The unexpectedly large 13C kinetic isotope effect in the OH reaction of CH3Cl has important implications for the global emission inventory of CH3Cl.

[Methodologies of publications in the Revista de Investigación Clínica during the last 20 years].

Science.gov (United States)

López-Jiménez, F; Borovoy, J

1997-01-01

To characterize the clinical research methods published in the Revista de Investigación Clínica for the past 20 years. Comparative study of methods used in the RIC articles published in 3-years periods representing three decades (1972-74, 1982-84, 1992-94). Out of 273 original papers, 218 (80%) were of clinical research. There was an increased percentage of longitudinal vs cross-sectional studies, with cohort and randomized clinical trials showing the largest increase. The total number of research manuscripts also increased. The clinical research methods of the papers in the RIC have shown an increased rate of designs with a higher scientific value.

Temperature dependence of thermal pressure for NaCl

Science.gov (United States)

Singh, Chandra K.; Pande, Brijesh K.; Pandey, Anjani K.

2018-05-01

Engineering applications of the materials can be explored upto the desired limit of accuracy with the better knowledge of its mechanical and thermal properties such as ductility, brittleness and Thermal Pressure. For the resistance to fracture (K) and plastic deformation (G) the ratio K/G is treated as an indication of ductile or brittle character of solids. In the present work we have tested the condition of ductility and brittleness with the calculated values of K/G for the NaCl. It is concluded that the nature of NaCl can be predicted upto high temperature simply with the knowledge of its elastic stiffness constant only. Thermoelastic properties of materials at high temperature is directly related to thermal pressure and volume expansion of the materials. An expression for the temperature dependence of thermal pressure is formulated using basic thermodynamic identities. It is observed that thermal pressure ΔPth calculated for NaCl by using Kushwah formulation is in good agreement with the experimental values also the thermal pressure increases with the increase in temperature.

Double-pulse standoff laser-induced breakdown spectroscopy for versatile hazardous materials detection

Energy Technology Data Exchange (ETDEWEB)

Gottfried, Jennifer L. [U.S. Army Research Laboratory, AMSRD-ARL-WM-BD, Aberdeen Proving Ground, MD, 21005-5069 (United States)], E-mail: jennifer.gottfried@arl.army.mil; De Lucia, Frank C.; Munson, Chase A.; Miziolek, Andrzej W. [U.S. Army Research Laboratory, AMSRD-ARL-WM-BD, Aberdeen Proving Ground, MD, 21005-5069 (United States)

2007-12-15

We have developed a double-pulse standoff laser-induced breakdown spectroscopy (ST-LIBS) system capable of detecting a variety of hazardous materials at tens of meters. The use of a double-pulse laser improves the sensitivity and selectivity of ST-LIBS, especially for the detection of energetic materials. In addition to various metallic and plastic materials, the system has been used to detect bulk explosives RDX and Composition-B, explosive residues, biological species such as the anthrax surrogate Bacillus subtilis, and chemical warfare simulants at 20 m. We have also demonstrated the discrimination of explosive residues from various interferents on an aluminum substrate.

Irreversible dilation of NaCl contaminated lime-cement mortar due to crystallization cycles

International Nuclear Information System (INIS)

Lubelli, B.; Hees, R.P.J. van; Huinink, H.P.; Groot, C.J.W.P.

2006-01-01

The mechanism of damage occurring in NaCl contaminated materials has not been clarified yet. Apart from crystallization pressure, other hypotheses have been proposed to explain the cause of decay. Irreversible dilation has been observed in a few cases but has never been studied in a more systematic way. The aim of the research is to contribute to the modeling of this phenomenon. In the present paper the effect of NaCl on the hydric and hygric behavior of a lime-cement mortar is extensively studied. The results indicate that NaCl influences the hydric and hygric dilation behavior of the material. The material contaminated with NaCl shrinks during dissolution and dilates during crystallization of the salt. This dilation is irreversible and sufficient to damage the material after few dissolution/crystallization cycles. This behavior is not restricted to NaCl, but is observed in the presence of other salts as well (NaNO 3 and KCl). Outcomes of electron microscopy studies suggest that salts causing irreversible dilation tend to crystallize as layers on the pore wall

Physico-mathematical model of motor vehicle of divided weight with unifying energetic element

Directory of Open Access Journals (Sweden)

Leonid M. Petrov

2015-12-01

Full Text Available The traction characteristics are important for ensuring of motor vehicle work process. In providing the traction characteristics the average velocity of mobile energetic transport grows, energy costs for work process execution are uprating and operation costs are reducing. The implementation of traction characteristics is performed by transmission of mobile energetic transport. Aim: The aim of the work is improvement of torque transfer technology from the engine to the wheel driving forces through the establishment of new construction of divided weight vehicle transmission. Materials and Methods: Consider a motor vehicle of divided weight with unifying energetic element which performs rotary motions relative to the vehicle frame. Results: It was shown that, the momentum which creates the rotational motion depends on the module and the direction of rotation speed of the unifying energetic element. For the first time, the technology and design of vehicle transmission which differs from previous designs by significant simplifying of the torque transmission from the engine to driving wheels at increased value of efficiency coefficient were proposed.

Electronic absorption bands of HoCl3 and SmCl3 complexes in alcohols

International Nuclear Information System (INIS)

Ramesh Babu, V.; Buddhudu, S.; Rangarajan, V.N.

1987-01-01

The normal absorption and second derivative spectra of ten alcoholic complexes of HoCl 3 and SmCl 3 were recorded. From the observed bands, energies and intensity values were measured. To fit in these measured values with the theoretical values, a set of spectroscopic parameters namely, Judd-Ofelt (T 2 , T 4 , T 6 ), intensity (Ω 2 , Ω 4 , Ω 6 ) had been computed. A good fit of intensities was obtained between the experimental and theoretical data. The environmental influences on the intensities of the hypersensitive transitions of Sm(III) and Ho(III) ions were found to be noteworthy. (author). 7 tables, 20 refs

Effect of NaCl treatments on glucosinolate metabolism in broccoli sprouts*

Science.gov (United States)

Guo, Rong-fang; Yuan, Gao-feng; Wang, Qiao-mei

2013-01-01

To understand the regulation mechanism of NaCl on glucosinolate metabolism in broccoli sprouts, the germination rate, fresh weight, contents of glucosinolates and sulforaphane, as well as myrosinase activity of broccoli sprouts germinated under 0, 20, 40, 60, 80, and 100 mmol/L of NaCl were investigated in our experiment. The results showed that glucoerucin, glucobrassicin, and 4-hydroxy glucobrassicin in 7-d-old broccoli sprouts were significantly enhanced and the activity of myrosinase was inhibited by 100 mmol/L of NaCl. However, the total glucosinolate content in 7-d-old broccoli sprouts was markedly decreased although the fresh weight was significantly increased after treatment with NaCl at relatively low concentrations (20, 40, and 60 mmol/L). NaCl treatment at the concentration of 60 mmol/L for 5 d maintained higher biomass and comparatively higher content of glucosinolates in sprouts of broccoli with decreased myrosinase activity. A relatively high level of NaCl treatment (100 mmol/L) significantly increased the content of sulforaphane in 7-d-old broccoli sprouts compared with the control. These results indicate that broccoli sprouts grown under a suitable concentration of NaCl could be desirable for human nutrition. PMID:23365011

Environmental Screening of Electrode Materials for a Rechargeable Aluminum Battery with an AlCl3/EMIMCl Electrolyte

Directory of Open Access Journals (Sweden)

Linda Ager-Wick Ellingsen

2018-06-01

Full Text Available Recently, rechargeable aluminum batteries have received much attention due to their low cost, easy operation, and high safety. As the research into rechargeable aluminum batteries with a room-temperature ionic liquid electrolyte is relatively new, research efforts have focused on finding suitable electrode materials. An understanding of the environmental aspects of electrode materials is essential to make informed and conscious decisions in aluminum battery development. The purpose of this study was to evaluate and compare the relative environmental performance of electrode material candidates for rechargeable aluminum batteries with an AlCl3/EMIMCl (1-ethyl-3-methylimidazolium chloride room-temperature ionic liquid electrolyte. To this end, we used a lifecycle environmental screening framework to evaluate 12 candidate electrode materials. We found that all of the studied materials are associated with one or more drawbacks and therefore do not represent a “silver bullet” for the aluminum battery. Even so, some materials appeared more promising than others did. We also found that aluminum battery technology is likely to face some of the same environmental challenges as Li-ion technology but also offers an opportunity to avoid others. The insights provided here can aid aluminum battery development in an environmentally sustainable direction.

Status, problems and perspectives of the education on nuclear energetics and nuclear safety within the Technical University of Sofia

International Nuclear Information System (INIS)

Lakov, M.; Bonev, B.; Stoyanov, S.; Velev, V.

2004-01-01

Education on nuclear energetic within the Technical University of Sofia is conducted since 1966 within the framework of the specialty 'Thermal energetic' at that time, and since 1973, within the specialty 'Thermal and nuclear energetic'. In 1986 is opened a college on nuclear energetic teaching on specialty 'Nuclear Energetic' and 'Automation in Energetic'. Since 1998 the department 'Thermal and nuclear energetic' is the only one within the Republic of Bulgaria having the legal rights to train 'engineers-bachelors' and 'engineers-master of science' on 'Thermal and nuclear energetic', as well as doctors - engineers of the same specialty. The bachelor course is graduated from between 40 and 60 students annually. The training within the bachelor level is 4 years and finishes by defending diploma thesis. Part of the graduated bachelors (between 20 and 30 students) are closely specialized in the area of Nuclear Energetic. The specialization is trained through preparation of diploma thesis within the nuclear area. The master course has 3 semesters including preparation of diploma thesis. Within the master level are prepared 25 students annually. Within the sub-division 'Nuclear Energetic' are promulgated between 2 and 4 competitions for preparation of doctoral thesis annually. At the moment 7 students are preparing doctoral thesis. Graduated engineers on 'Nuclear Energetic' are engaged as operative personnel mainly in Kozloduy NPP. The rest of them are engaged within the engineering and scientific organizations, connected to nuclear energetic

Energetic Surface Smoothing of Complex Metal-Oxide Thin Films

International Nuclear Information System (INIS)

Willmott, P.R.; Herger, R.; Schlepuetz, C.M.; Martoccia, D.; Patterson, B.D.

2006-01-01

A novel energetic smoothing mechanism in the growth of complex metal-oxide thin films is reported from in situ kinetic studies of pulsed laser deposition of La 1-x Sr x MnO 3 on SrTiO 3 , using x-ray reflectivity. Below 50% monolayer coverage, prompt insertion of energetic impinging species into small-diameter islands causes them to break up to form daughter islands. This smoothing mechanism therefore inhibits the formation of large-diameter 2D islands and the seeding of 3D growth. Above 50% coverage, islands begin to coalesce and their breakup is thereby suppressed. The energy of the incident flux is instead rechanneled into enhanced surface diffusion, which leads to an increase in the effective surface temperature of ΔT≅500 K. These results have important implications on optimal conditions for nanoscale device fabrication using these materials

Geodesic acoustic mode driven by energetic particles with bump-on-tail distribution

Science.gov (United States)

Ren, Haijun; Wang, Hao

2018-04-01

Energetic-particle-driven geodesic acoustic mode (EGAM) is analytically investigated by adopting the bump-on-tail distribution for energetic particles (EPs), which is created by the fact that the charge exchange time (τcx ) is sufficiently shorter than the slowing down time (τsl ). The dispersion relation is derived in the use of gyro-kinetic equations. Due to the finite ratio of the critical energy and the initial energy of EPs, defined as τc , the dispersion relation is numerically evaluated and the effect of finite τc is examined. Following relative simulation and experimental work, we specifically considered two cases: τsl/τcx = 3.4 and τsl/τcx = 20.4 . The pitch angle is shown to significantly enhance the growth rate and meanwhile, the real frequency is dramatically decreased with increasing pitch angle. The excitation of high-frequency EGAM is found, and this is consistent with both the experiment and the simulation. The number density effect of energetic particles, represented by \

Mammalian energetics. Flexible energetics of cheetah hunting strategies provide resistance against kleptoparasitism.

Science.gov (United States)

Scantlebury, David M; Mills, Michael G L; Wilson, Rory P; Wilson, John W; Mills, Margaret E J; Durant, Sarah M; Bennett, Nigel C; Bradford, Peter; Marks, Nikki J; Speakman, John R

2014-10-03

Population viability is driven by individual survival, which in turn depends on individuals balancing energy budgets. As carnivores may function close to maximum sustained power outputs, decreased food availability or increased activity may render some populations energetically vulnerable. Prey theft may compromise energetic budgets of mesopredators, such as cheetahs and wild dogs, which are susceptible to competition from larger carnivores. We show that daily energy expenditure (DEE) of cheetahs was similar to size-based predictions and positively related to distance traveled. Theft at 25% only requires cheetahs to hunt for an extra 1.1 hour per day, increasing DEE by just 12%. Therefore, not all mesopredators are energetically constrained by direct competition. Other factors that increase DEE, such as those that increase travel, may be more important for population viability. Copyright © 2014, American Association for the Advancement of Science.

An oil-in-water self-assembly synthesis, characterization and photocatalytic properties of nano Ag@AgCl surface-sensitized K2Ti4O9

International Nuclear Information System (INIS)

Liang, Yinghua; Lin, Shuanglong; Liu, Li; Hu, Jinshan; Cui, Wenquan

2014-01-01

Highlights: • The plasmatic Ag@AgCl surface-sensitized K 2 Ti 4 O 9 composite photocatalysts. • Ag@AgCl greatly increased visible light absorption for K 2 Ti 4 O 9 . • The photocatalysts exhibited enhanced photocatalytic dye degradation. - Abstract: Nano-sized plasmonic Ag@AgCl surface-sensitized K 2 Ti 4 O 9 composite photocatalysts (hereafter designated as Ag@AgCl/K 2 Ti 4 O 9 ) was synthesized via a facile oil-in-water self-assembly method. The photocatalytic activity of the prepared materials for RhB (Rhodamine B) degradation was examined under visible light irradiation. The results reveal that the size of Ag@AgCl, which evenly dispersed on the surface of K 2 Ti 4 O 9 , distributes about 20–50 nm. The UV–vis diffuse reflectance spectra indicate that Ag@AgCl/K 2 Ti 4 O 9 samples have a significantly enhanced optical absorption in 380–700 nm. The photocatalytic activities of the Ag@AgCl/K 2 Ti 4 O 9 samples increase first and then decrease with increasing amount of loading Ag@AgCl and the Ag@AgCl(20 wt.%)/K 2 Ti 4 O 9 sample exhibits the best photocatalytic activity and 94.47% RhB was degraded after irradiation for 2 h. Additionally, studies performed using radical scavengers indicated that O 2 · − and Cl 0 acted as the main reactive species. The electronic interaction was systematically studied and confirmed by the photo-electrochemical measurements

Molten salt corrosion behavior of structural materials in LiCl-KCl-UCl3 by thermogravimetric study

Science.gov (United States)

Rao, Ch Jagadeeswara; Ningshen, S.; Mallika, C.; Mudali, U. Kamachi

2018-04-01

The corrosion resistance of structural materials has been recognized as a key issue in the various unit operations such as salt purification, electrorefining, cathode processing and injection casting in the pyrochemical reprocessing of spent metallic nuclear fuels. In the present work, the corrosion behavior of the candidate materials of stainless steel (SS) 410, 2.25Cr-1Mo and 9Cr-1Mo steels was investigated in molten LiCl-KCl-UCl3 salt by thermogravimetric analysis under inert and reactive atmospheres at 500 and 600 °C, for 6 h duration. Insignificant weight gain (less than 1 mg/cm2) in the inert atmosphere and marginal weight gain (maximum 5 mg/cm2) in the reactive atmosphere were observed at both the temperatures. Chromium depletion rates and formation of Cr-rich corrosion products increased with increasing temperature of exposure in both inert and reactive atmospheres as evidenced by SEM and EDS analysis. The corrosion attack by LiCl-KCl-UCl3 molten salt, under reactive atmosphere for 6 h duration was more in the case of SS410 than 9Cr-1Mo steel followed by 2.25Cr-1Mo steel at 500 °C and the corrosion attack at 600 °C followed the order: 9Cr-1Mo steel >2.25Cr-1Mo steel > SS410. Outward diffusion of the minor alloying element, Mo was observed in 9Cr-1Mo and 2.25Cr-1Mo steels at both temperatures under reactive atmosphere. Laser Raman spectral analysis of the molten salt corrosion tested alloys under a reactive atmosphere at 500 and 600 °C for 6 h revealed the formation of unprotected Fe3O4 and α-as well as γ-Fe2O3. The results of the present study facilitate the selection of structural materials for applications in the corrosive molten salt environment at high temperatures.

Rigid, non-porous and tunable hybrid p-aminobenzoate/TiO2 materials: Toward a fine structural determination of the immobilized RhCl(Ph3)3 complex

KAUST Repository

Espinas, Jeff

2015-05-01

By exchange of ligands, Wilkinson complex RhCl(PPh3)3 are immobilized on p-aminobenzoate/TiO2 with different organic loading (6, 11 and 16%). This new hybrid material exhibit a linear correlation between the ligand content of the starting TiO2 and the rhodium loading, showing the accessibility of all surfaces amines fonctions on the non-porous parent materials. 1H, 13C, and 1D, 2D INAQUEDATE refocused and J-resolved 31P solid-state NMR confirm the well-defined structure [(≡TiO)2(n{right tail}2-O2C-C6H4-NH2)RhCl-cis-(PPh3)2]. New immobilized catalysts show interesting activity in cyclohexene hydroformylation.

Rigid, non-porous and tunable hybrid p-aminobenzoate/TiO2 materials: Toward a fine structural determination of the immobilized RhCl(Ph3)3 complex

KAUST Repository

Espinas, Jeff; Rahal, Raed; Abou-Hamad, Edy; El Eter, Mohamad; Basset, Jean-Marie

2015-01-01

By exchange of ligands, Wilkinson complex RhCl(PPh3)3 are immobilized on p-aminobenzoate/TiO2 with different organic loading (6, 11 and 16%). This new hybrid material exhibit a linear correlation between the ligand content of the starting TiO2 and the rhodium loading, showing the accessibility of all surfaces amines fonctions on the non-porous parent materials. 1H, 13C, and 1D, 2D INAQUEDATE refocused and J-resolved 31P solid-state NMR confirm the well-defined structure [(≡TiO)2(n{right tail}2-O2C-C6H4-NH2)RhCl-cis-(PPh3)2]. New immobilized catalysts show interesting activity in cyclohexene hydroformylation.

EB surface sterilization of food material

International Nuclear Information System (INIS)

Kaneko, H.; Mizutani, A.; Kato, K.; Nishikimi, T.; Taniguchi, S.

2001-01-01

In this paper, we introduce a food irradiation with low energetic, lower than 300keV, electrons (so-called SOFT ELECTRON) as a rather new method of food sterilization. It is also a physical sterilization method, and free from the problems mentioned above. Low energetic electrons have small penetration power (50-200micron) through raw materials, and by selecting a proper energy of electrons we can sterilize only the surfaces or skins of target materials

Energetic model of metal hardening

Directory of Open Access Journals (Sweden)

Ignatova O.N.

2011-01-01

Full Text Available Based on Bailey hypothesis on the link between strain hardening and elastic lattice defect energy this paper suggests a shear strength energetic model that takes into consideration plastic strain intensity and rate as well as softening related to temperature annealing and dislocation annihilation. Metal strain hardening was demonstrated to be determined only by elastic strain energy related to the energy of accumulated defects. It is anticipated that accumulation of the elastic energy of defects is governed by plastic work. The suggested model has a reasonable agreement with the available experimental data for copper up to P = 70 GPa , for aluminum up to P = 10 GPa and for tantalum up to P = 20 GPa.

Narrow and broad solitons in the antiferromagnetic chains of CsCoCl3 and TMMC

International Nuclear Information System (INIS)

Boucher, J.P.; Regnault, L.P.; Pires, A.; Rossat-Mignod, J.; Henry, Y.; Bouillot, J.; Stirling, W.G.; Renard, J.P.

1984-06-01

The two quasi one-dimensional (1D) compounds CsCoCl 3 and (CH 3 ) 4 NMnCl 3 (TMMC) are almost ideal systems in which to study soliton excitations. Both they have antiferromagnetic (AF) couplings in the chains and at low temperature they exhibit an Ising symmetry favourable for the occurence of solitons. This symmetry is an intrinsic property of CsCoCl 3 while in TMMC it is only achieved by the application of an external magnetic field H perpendicular to the chains. In the lD short range order regime two energetically equivalent configurations are expected for the spins. Solitons can be seen as Bloch walls separating ordered domains and allowing the spins to pass from one configuration to the other. In the case of a ''strong'' Ising symmetry (CsCoCl 3 ) the walls are reduced to one lattice unit (''narrow'' solitons) while in the case of a ''weak'' Ising symmetry (TMMC) the walls extend over several lattice units (10 to 30) (''broad'' solitons). To maintain a paramagnetic state, these walls move rapidly along the chains inducing characteristic fluctuations. The investigation of these two compounds, CsCoCl 3 and TMMC illustrates the advantage of antiferromagnets as the AF mode yields an accurate determination of the soliton regime. Narrow and broad solitons are observed to behave very similarly

Surface structure and reaction property of CuCl2-PdCl2 bimetallic catalyst in methanol oxycarbonylation: A DFT approach

International Nuclear Information System (INIS)

Meng, Qingsen; Wang, Shengping; Shen, Yongli; Yan, Bing; Wu, Yuanxin; Ma, Xinbin

2014-01-01

Surface structure of CuCl 2 -PdCl 2 bimetallic catalyst (Wacker-type catalyst) was built employing density functional theory (DFT) calculations, and the reaction mechanism of methanol oxycarbonylation over the CuCl 2 -PdCl 2 surfaces was also investigated. On the CuCl 2 -PdCl 2 surface, the active site for methanol oxidation was confirmed as Cu-Cl-Cu (Pd). Comparing with pure CuCl 2 surface, the introduction of Pd atom causes the electron repopulation on the surface and lowers the energy barrier for methanol oxidation, but the number of the active site decreases with the increasing of Pd doping volume. Agreed with previous experimental results, the Pd site is most favorable for the CO insertion, indicated by the lowest activation barrier for the formation of COOCH 3 on Pd atom. The lowest energy barrier for the formation of DMC appears when COOCH 3 species adsorbed on Pd atom and methoxyl adsorbed on Cu atoms, which is 0.42 eV. Finally, the reconstruction of the unsaturated surface is a spontaneous and exothermic process. Comparing with other surfaces, the rate-limiting step, methanol oxidation, on CuCl 2 -PdCl 2 surface with Pd/Cu = 1:17 has the lowest energy barrier, which is agreed with the experimental observation that PdCl 2 -CuCl 2 catalyst with Pd/Cu = 1:20 has the favorable activity. The adsorbed methoxyl will further lower the activation barrier of methanol oxidation, which is agreed with experimental observation that the Wacker-type catalysts have an induction period in the methanol oxidative carbonylation system.

Composition of heavy ions in solar energetic particle events

International Nuclear Information System (INIS)

Fan, C.Y.; Gloeckler, G.

1983-01-01

Recent advances in determining the elemental, charge state, and isotopic composition of approximatelt 1 to 20 MeV per nucleon ions in solar energetic particle (SEP) events and outline our current understanding of the nature of solar and interplanetary processes which may explain the observations. Average values of relative abundances measured in a large number of SEP events were found to be roughly energy independent in the approx. 1 to approx. 20 MeV per nucleon range, and showed a systematic deviation from photospheric abundances which seems to be organized in terms of the first ionization potential of the ion. Direct measurements of the charge states of SEPs revealed the surprisingly common presence of energetic He(+) along with heavy ion with typically coronal ionization states. High resolution measurements of isotopic abundance ratios in a small number of SEP events showed these to be consistent with the universal composition except for the puzzling overabundance of the SEP(22)Ne/(20)Ne relative to this isotopes ratio in the solar wind. The broad spectrum of observed elemental abundance variations, which in their extreme result in composition anomalies characteristic of (3)He rich, heavy ion rich and carbon poor SEP events, along with direct measurements of the ionization states of SEPs provided essential information on the physical characteristics of, and conditions in the source regions, as well as important constraints to possible models for SEP production

Defensive Metabolites from Antarctic Invertebrates: Does Energetic Content Interfere with Feeding Repellence?

Directory of Open Access Journals (Sweden)

Laura Núñez-Pons

2014-06-01

Full Text Available Many bioactive products from benthic invertebrates mediating ecological interactions have proved to reduce predation, but their mechanisms of action, and their molecular identities, are usually unknown. It was suggested, yet scarcely investigated, that nutritional quality interferes with defensive metabolites. This means that antifeedants would be less effective when combined with energetically rich prey, and that higher amounts of defensive compounds would be needed for predator avoidance. We evaluated the effects of five types of repellents obtained from Antarctic invertebrates, in combination with diets of different energetic values. The compounds came from soft corals, ascidians and hexactinellid sponges; they included wax esters, alkaloids, a meroterpenoid, a steroid, and the recently described organic acid, glassponsine. Feeding repellency was tested through preference assays by preparing diets (alginate pearls combining different energetic content and inorganic material. Experimental diets contained various concentrations of each repellent product, and were offered along with control compound-free pearls, to the Antarctic omnivore amphipod Cheirimedon femoratus. Meridianin alkaloids were the most active repellents, and wax esters were the least active when combined with foods of distinct energetic content. Our data show that levels of repellency vary for each compound, and that they perform differently when mixed with distinct assay foods. The natural products that interacted the most with energetic content were those occurring in nature at higher concentrations. The bioactivity of the remaining metabolites tested was found to depend on a threshold concentration, enough to elicit feeding repellence, independently from nutritional quality.

Defensive Metabolites from Antarctic Invertebrates: Does Energetic Content Interfere with Feeding Repellence?

Science.gov (United States)

Núñez-Pons, Laura; Avila, Conxita

2014-01-01

Many bioactive products from benthic invertebrates mediating ecological interactions have proved to reduce predation, but their mechanisms of action, and their molecular identities, are usually unknown. It was suggested, yet scarcely investigated, that nutritional quality interferes with defensive metabolites. This means that antifeedants would be less effective when combined with energetically rich prey, and that higher amounts of defensive compounds would be needed for predator avoidance. We evaluated the effects of five types of repellents obtained from Antarctic invertebrates, in combination with diets of different energetic values. The compounds came from soft corals, ascidians and hexactinellid sponges; they included wax esters, alkaloids, a meroterpenoid, a steroid, and the recently described organic acid, glassponsine. Feeding repellency was tested through preference assays by preparing diets (alginate pearls) combining different energetic content and inorganic material. Experimental diets contained various concentrations of each repellent product, and were offered along with control compound-free pearls, to the Antarctic omnivore amphipod Cheirimedon femoratus. Meridianin alkaloids were the most active repellents, and wax esters were the least active when combined with foods of distinct energetic content. Our data show that levels of repellency vary for each compound, and that they perform differently when mixed with distinct assay foods. The natural products that interacted the most with energetic content were those occurring in nature at higher concentrations. The bioactivity of the remaining metabolites tested was found to depend on a threshold concentration, enough to elicit feeding repellence, independently from nutritional quality. PMID:24962273

Distribution and Fate of Energetics on DoD Test and Training Ranges: Interim Report 3

National Research Council Canada - National Science Library

Pennington, Judith

2003-01-01

.... The objective of this project, initiated in FYOO and planned for completion in FYO5, was to determine the potential for environmental contamination from residues of energetic materials on ranges...

Esplacnología clínica

OpenAIRE

Sánchez Hernández, Fernando; Santos del Rey, Fernando

2008-01-01

Materiales de clase: 1.Tema 1.Asistencia 1; 2.Tema 2: Asistencia 2; 3. Tema 3: Reanimación cardiopulmonar; 4. Tema 4: Manejo C. RCP. Cohibir-fluidos-shock. Lesiones con riesgo inminente de muerte; 5. Tema 5: Manejo D. Exploración neurológica. Escala de Glasgow; 6. Tema 6: Ejercicio de Triage; 7. Tema 7: Casos clínicos reales; 8. Tema 8: Material de emergencias en atención primaria. Esta asignatura tiene como objetivo aplicar, mediante casos clínicos enfocados hacia Enfermería, criterios y ...

Lead-Free MA2CuCl(x)Br(4-x) Hybrid Perovskites.

Science.gov (United States)

Cortecchia, Daniele; Dewi, Herlina Arianita; Yin, Jun; Bruno, Annalisa; Chen, Shi; Baikie, Tom; Boix, Pablo P; Grätzel, Michael; Mhaisalkar, Subodh; Soci, Cesare; Mathews, Nripan

2016-02-01

Despite their extremely good performance in solar cells with efficiencies approaching 20% and the emerging application for light-emitting devices, organic-inorganic lead halide perovskites suffer from high content of toxic, polluting, and bioaccumulative Pb, which may eventually hamper their commercialization. Here, we present the synthesis of two-dimensional (2D) Cu-based hybrid perovskites and study their optoelectronic properties to investigate their potential application in solar cells and light-emitting devices, providing a new environmental-friendly alternative to Pb. The series (CH3NH3)2CuCl(x)Br(4-x) was studied in detail, with the role of Cl found to be essential for stabilization. By exploiting the additional Cu d-d transitions and appropriately tuning the Br/Cl ratio, which affects ligand-to-metal charge transfer transitions, the optical absorption in this series of compounds can be extended to the near-infrared for optimal spectral overlap with the solar irradiance. In situ formation of Cu(+) ions was found to be responsible for the green photoluminescence of this material set. Processing conditions for integrating Cu-based perovskites into photovoltaic device architectures, as well as the factors currently limiting photovoltaic performance, are discussed: among them, we identified the combination of low absorption coefficient and heavy mass of the holes as main limitations for the solar cell efficiency. To the best of our knowledge, this is the first demonstration of the potential of 2D copper perovskite as light harvesters and lays the foundation for further development of perovskite based on transition metals as alternative lead-free materials. Appropriate molecular design will be necessary to improve the material's properties and solar cell performance filling the gap with the state-of-the-art Pb-based perovskite devices.

Energetics of feeding, social behavior, and life history in non-human primates.

Science.gov (United States)

Emery Thompson, Melissa

2017-05-01

Energy is a variable of key importance to a wide range of research in primate behavioral ecology, life history, and conservation. However, obtaining detailed data on variation in energetic condition, and its biological consequences, has been a considerable challenge. In the past 20years, tremendous strides have been made towards non-invasive methods for monitoring the physiology of animals in their natural environment. These methods provide detailed, individualized data about energetic condition, as well as energy allocations to growth, reproduction, and somatic health. In doing so, they add much-needed resolution by which to move beyond correlative studies to research programs that can discriminate causes from effects and disaggregate multiple correlated features of the social and physical environment. In this review, I describe the conceptual and methodological approaches for studying primate energetics. I then discuss the core questions about primate feeding ecology, social behavior, and life history that can benefit from physiological studies, highlighting the ways in which recent research has done so. Among these are studies that test, and often refute, common assumptions about how feeding ecology shapes primate biology, and those that reveal proximate associations between energetics and reproductive strategies. Copyright © 2016 Elsevier Inc. All rights reserved.

Rural energetic development: cuban experience

International Nuclear Information System (INIS)

Aguilera Barciela, M.

1994-01-01

The development of electro energetic national system in Cuba has been directed to the following objectives: to brake the rural population's exodus toward the cities, electrification of dairy farm, interconnection to the system electro energetic of all the sugar central production, these improves the rural population's conditions life

Raman spectra of the system TeCl4-SbCl5

International Nuclear Information System (INIS)

Brockner, W.; Demiray, A.F.

1980-01-01

Raman spectra of the solid and molten TeCl 4 . SbCl 5 addition compound and of some TeCl 4 -SbCl 5 mixtures have been recorded. Two modifications of the crystalline TeCl 4 -SbCl 5 compound have been found. The structure of the melt can be described by the equilibrium TeCl 3 + + SbCl 6 - reversible TeCl 4 + SbCl 5 lying on the left side. Mixtures with other stoichiometry contain the 1:1 adduct only and excess TeCl 4 or SbCl 5 , respectively. Such melts are built up by the ionic species TeCl 3 + and SbCl 6 - also and TeCl 4 or SbCl 5 according to stoichiometry. (author)

A hydrochemical investigation using 36Cl/Cl in groundwaters

International Nuclear Information System (INIS)

Metcalfe, Richard

2003-03-01

This report describes 36 Cl studies which were undertaken during the H14 financial year. The results of this study suggest that, if 36 Cl data can be obtained for groundwaters at spatial scales comparable with, or smaller than, the spatial scales of the variability in in-situ 36 Cl production in the host rock, the data could potentially be useful for interpreting groundwater origins and flow paths. Four groundwater samples and one onsen water sample from the Tono area were collected for 36 Cl analysis. The groundwater samples came from boreholes MSB-2 and MSB-4 in the MIU Construction Site, whereas the onsen water was taken from Oniiwa Onsen (Komatsuya). In addition, a single sample from borehole HDB-1 at Horonobe was also sent for analysis. Supporting rock chemical data and wireline geophysical data have also been evaluated, to provide a basis for interpreting the 36 Cl data. Rock analyses and spectral gamma wireline data were used to estimate theoretical limiting equilibrium 36 Cl/Cl ratios in the rock. These have been compared with the compositions measured for groundwater samples, enabling a judgement to be made as to: whether the waters have resided for long enough in the rock to approach equilibrium (> c. 1.5 Ma); the spatial scales of mixing of the dissolved Cl in the groundwater. The estimates of in-situ 36 Cl/Cl production made with the newly available rock chemical data and wireline geophysical data have enabled 36 Cl data obtained previously from MIU-4, KNA-6 and DH-12 during H12 and H13 to be interpreted more confidently. In particular it seems that 36 Cl/Cl ratios measured previously in groundwater samples from MIU-4 are not in equilibrium with in-situ production in the granite. Furthermore, they imply that the Cl is homogenised, at least on the scale of the upper half of borehole. In contrast, the data from DH-12 imply that the Cl could be in equilibrium with in-situ 36 Cl production in the granite, which would be consistent with a relatively long

Heterogeneous compute in computer vision: OpenCL in OpenCV

Science.gov (United States)

Gasparakis, Harris

2014-02-01

We explore the relevance of Heterogeneous System Architecture (HSA) in Computer Vision, both as a long term vision, and as a near term emerging reality via the recently ratified OpenCL 2.0 Khronos standard. After a brief review of OpenCL 1.2 and 2.0, including HSA features such as Shared Virtual Memory (SVM) and platform atomics, we identify what genres of Computer Vision workloads stand to benefit by leveraging those features, and we suggest a new mental framework that replaces GPU compute with hybrid HSA APU compute. As a case in point, we discuss, in some detail, popular object recognition algorithms (part-based models), emphasizing the interplay and concurrent collaboration between the GPU and CPU. We conclude by describing how OpenCL has been incorporated in OpenCV, a popular open source computer vision library, emphasizing recent work on the Transparent API, to appear in OpenCV 3.0, which unifies the native CPU and OpenCL execution paths under a single API, allowing the same code to execute either on CPU or on a OpenCL enabled device, without even recompiling.

Temperature analysis of laser ignited metalized material using spectroscopic technique

Science.gov (United States)

Bassi, Ishaan; Sharma, Pallavi; Daipuriya, Ritu; Singh, Manpreet

2018-05-01

The temperature measurement of the laser ignited aluminized Nano energetic mixture using spectroscopy has a great scope in in analysing the material characteristic and combustion analysis. The spectroscopic analysis helps to do in depth study of combustion of materials which is difficult to do using standard pyrometric methods. Laser ignition was used because it consumes less energy as compared to electric ignition but ignited material dissipate the same energy as dissipated by electric ignition and also with the same impact. Here, the presented research is primarily focused on the temperature analysis of energetic material which comprises of explosive material mixed with nano-material and is ignited with the help of laser. Spectroscopy technique is used here to estimate the temperature during the ignition process. The Nano energetic mixture used in the research does not comprise of any material that is sensitive to high impact.

Energetic differences between bacterioplankton trophic groups and coral reef resistance.

Science.gov (United States)

McDole Somera, Tracey; Bailey, Barbara; Barott, Katie; Grasis, Juris; Hatay, Mark; Hilton, Brett J; Hisakawa, Nao; Nosrat, Bahador; Nulton, James; Silveira, Cynthia B; Sullivan, Chris; Brainard, Russell E; Rohwer, Forest

2016-04-27

Coral reefs are among the most productive and diverse marine ecosystems on the Earth. They are also particularly sensitive to changing energetic requirements by different trophic levels. Microbialization specifically refers to the increase in the energetic metabolic demands of microbes relative to macrobes and is significantly correlated with increasing human influence on coral reefs. In this study, metabolic theory of ecology is used to quantify the relative contributions of two broad bacterioplankton groups, autotrophs and heterotrophs, to energy flux on 27 Pacific coral reef ecosystems experiencing human impact to varying degrees. The effective activation energy required for photosynthesis is lower than the average energy of activation for the biochemical reactions of the Krebs cycle, and changes in the proportional abundance of these two groups can greatly affect rates of energy and materials cycling. We show that reef-water communities with a higher proportional abundance of microbial autotrophs expend more metabolic energy per gram of microbial biomass. Increased energy and materials flux through fast energy channels (i.e. water-column associated microbial autotrophs) may dampen the detrimental effects of increased heterotrophic loads (e.g. coral disease) on coral reef systems experiencing anthropogenic disturbance. © 2016 The Author(s).

Radiative forcing calculations for CH3Cl

International Nuclear Information System (INIS)

Grossman, A.S.; Grant, K.E.; Wuebbles, D.J.

1994-06-01

Methyl chloride, CH 3 Cl, is the major natural source of chlorine to the stratosphere. The production of CH 3 Cl is dominated by biological sources from the oceans and biomass burning. Production has a seasonal cycle which couples with the short lifetime of tropospheric CH 3 Cl to produce nonuniform global mixing. As an absorber of infrared radiation, CH 3 Cl is of interest for its potential affect on the tropospheric energy balance as well as for its chemical interactions. In this study, we estimate the radiative forcing and global warming potential (GWP) of CH 3 Cl. Our calculations use an infrared radiative transfer model based on the correlated k-distribution algorithm for band absorption. Global and annual average vertical profiles of temperature and trace gas concentration were assumed. The effects of clouds are modeled using three layers of global and annual average cloud optical properties. A radiative forcing value of 0.0053 W/m 2 ppbv was obtained for CH 3 Cl and is approximately linear in the background abundance. This value is about 2 percent of the forcing of CFC-11 and about 300 times the forcing of CO 2 , on a per molecule basis. The radiative forcing calculation for CH 3 Cl is used to estimate the global warming potential (GWP) of CH 3 Cl. The results give GWPs for CH 3 Cl of the order of 25 at a time of 20 years(CO 2 = 1). This result indicates that CH 3 Cl has the potential to be a major greenhouse gas if significant human related emissions were introduced into the atmosphere

The location of energetic compartments affects energetic communication in cardiomyocytes

Directory of Open Access Journals (Sweden)

Rikke eBirkedal

2014-09-01

Full Text Available The heart relies on accurate regulation of mitochondrial energy supply to match energy demand. The main regulators are Ca2+ and feedback of ADP and Pi. Regulation via feedback has intrigued for decades. First, the heart exhibits a remarkable metabolic stability. Second, diffusion of ADP and other molecules is restricted specifically in heart and red muscle, where a fast feedback is needed the most. To explain the regulation by feedback, compartmentalization must be taken into account. Experiments and theoretical approaches suggest that cardiomyocyte energetic compartmentalization is elaborate with barriers obstructing diffusion in the cytosol and at the level of the mitochondrial outer membrane (MOM. A recent study suggests the barriers are organized in a lattice with dimensions in agreement with those of intracellular structures. Here, we discuss the possible location of these barriers. The more plausible scenario includes a barrier at the level of MOM. Much research has focused on how the permeability of MOM itself is regulated, and the importance of the creatine kinase system to facilitate energetic communication. We hypothesize that at least part of the diffusion restriction at the MOM level is not by MOM itself, but due to the close physical association between the sarcoplasmic reticulum (SR and mitochondria. This will explain why animals with a disabled creatine kinase system exhibit rather mild phenotype modifications. Mitochondria are hubs of energetics, but also ROS production and signaling. The close association between SR and mitochondria may form a diffusion barrier to ADP added outside a permeabilised cardiomyocyte. But in vivo, it is the structural basis for the mitochondrial-SR coupling that is crucial for the regulation of mitochondrial Ca2+-transients to regulate energetics, and for avoiding Ca2+-overload and irreversible opening of the mitochondrial permeability transition pore.

Ab initio chemical kinetics for the ClOO + NO reaction: Effects of temperature and pressure on product branching formation

Science.gov (United States)

Raghunath, P.; Lin, M. C.

2012-07-01

The kinetics and mechanism for the reaction of ClOO with NO have been investigated by ab initio molecular orbital theory calculations based on the CCSD(T)/6-311+G(3df)//PW91PW91/6-311+G(3df) method, employed to evaluate the energetics for the construction of potential energy surfaces and prediction of reaction rate constants. The results show that the reaction can produce two key low energy products ClNO + 3O2 via the direct triplet abstraction path and ClO + NO2 via the association and decomposition mechanism through long-lived singlet pc-ClOONO and ClONO2 intermediates. The yield of ClNO + O2 (1△) from any of the singlet intermediates was found to be negligible because of their high barriers and tight transition states. As both key reactions initially occur barrierlessly, their rate constants were evaluated with a canonical variational approach in our transition state theory and Rice-Ramspergen-Kassel-Marcus/master equation calculations. The rate constants for ClNO + 3O2 and ClO + NO2 production from ClOO + NO can be given by 2.66 × 10-16 T1.91 exp(341/T) (200-700 K) and 1.48 × 10-24 T3.99 exp(1711/T) (200-600 K), respectively, independent of pressure below atmospheric pressure. The predicted total rate constant and the yields of ClNO and NO2 in the temperature range of 200-700 K at 10-760 Torr pressure are in close agreement with available experimental results.

Calidad metodológica de ensayos clínicos sobre periodoncia publicados en revistas ISI

Directory of Open Access Journals (Sweden)

Katherine Morales

Full Text Available Objetivo: Describir la calidad metodológica de los ensayos clínicos de periodoncia en revistas indexadas en el Institute for Scientific Information. Material y métodos: Estudio observacional descriptivo en el que se evaluaron los ensayos clínicos publicados entre Enero de 2008 y Diciembre de 2012, de las cuatro revistas de periodoncia indexadas a ISI, con mayor factor de impacto en los últimos 5 años según Journal Citation Reports. Se realizó una estrategia de búsqueda en PubMed para cada revista. Sólo los ensayos clínicos fueron seleccionados para el análisis cualitativo por medio de una escala de calidad metodológica. Los datos fueron analizados utilizando el paquete estadístico SPSS Statistics 20 para Windows (IBM., Chicago, USA. y presentados mediante estadística descriptiva. Resultados: De las revistas que cumplieron los criterios de selección, Journal of Clinical Periodontology, Journal of Periodontology, Journal of Periodontal Research e International Journal of Periodontics & Restorative Dentistry, se analizaron 387 ensayos clínicos. De los 24 puntos máximos obtenibles de la escala, la media alcanzada por los manuscritos evaluados fue de 17,45 puntos. Conclusión: La calidad metódológica de los ensayos clínicos en periodoncia, indexados en revistas ISI, fue deficiente.

Ignition and Reaction Analysis of High Loading Nano-Al/Fluoropolymer Energetic Composite Films

Science.gov (United States)

2014-01-01

A novel hybrid binder system for extrudable composite propellant,” International Journal of Energetic Materials and Chemical Propulsion, Vol. 11...Vol. 27, No. 5, 2002, pp. 262-266. 6 Wang, Y., Travas-Sejdic, J., Steiner, R., “Polymer gel electrolyte supported with microporous polyolefin

IRSL characteristics of NaCl and KCl relative to dosimeter

International Nuclear Information System (INIS)

Tanir, Guenes; Hicabi Boeluekdemir, M.; Catli, Serap; Tel, Eyyuep

2007-01-01

The aim of this work is to determine and compare the dosimetric properties of NaCl and KCl samples using infrared-stimulated luminescence (IRSL) technique. For a material to be used as dosimeter, both the IRSL temperature dependence and the radiation dose response have critical importance. In this work the IRSL characteristics from NaCl and KCl samples were experimentally investigated as a function of temperature and laboratory radiation doses. Dosimetric properties of NaCl and KCl samples were found significantly different. The IRSL signals displayed by NaCl were found to be more stable, reliable and agreeable than those of KCl

Reactions UF{sub 4} - ClF, UF{sub 4} - ClF{sub 3}, UF{sub 5} - ClF, UF{sub 5} - ClF{sub 3}; Reactions UF{sub 4} - ClF, UF{sub 4} - ClF{sub 3}, UF{sub 5} - ClF, UF{sub 5} - ClF{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Luce, M; Benoit, R; Hartmanshenn, O [Commissariat a l' Energie Atomique, Saclay (France). Centre d' Etudes Nucleaires

1968-07-01

The reaction between ClF{sub 3} and UF{sub 4} is partially explained by the study of the reactions of the three systems: UF{sub 4}-ClF, UF{sub 5}-ClF and UF{sub 5}-ClF{sub 3}. The analytical techniques used are: the micro-sublimation, the infra-red spectroscopy and the thermogravimetry. The origin of the by-products is indicated. (authors) [French] La reaction entre ClF{sub 3} et UF{sub 4} est partiellement expliquee grace a l'etude des reactions des trois systemes UF{sub 4}-ClF, UF{sub 5}-ClF et UF{sub 5}-ClF{sub 3}. Les techniques analytiques utilisees sont: la micro-sublimation, la spectroscopie infrarouge et la thermogravimetrie. L'origine des sous-produits est indiquee. (auteurs)

The Principle of Energetic Consistency

Science.gov (United States)

Cohn, Stephen E.

2009-01-01

A basic result in estimation theory is that the minimum variance estimate of the dynamical state, given the observations, is the conditional mean estimate. This result holds independently of the specifics of any dynamical or observation nonlinearity or stochasticity, requiring only that the probability density function of the state, conditioned on the observations, has two moments. For nonlinear dynamics that conserve a total energy, this general result implies the principle of energetic consistency: if the dynamical variables are taken to be the natural energy variables, then the sum of the total energy of the conditional mean and the trace of the conditional covariance matrix (the total variance) is constant between observations. Ensemble Kalman filtering methods are designed to approximate the evolution of the conditional mean and covariance matrix. For them the principle of energetic consistency holds independently of ensemble size, even with covariance localization. However, full Kalman filter experiments with advection dynamics have shown that a small amount of numerical dissipation can cause a large, state-dependent loss of total variance, to the detriment of filter performance. The principle of energetic consistency offers a simple way to test whether this spurious loss of variance limits ensemble filter performance in full-blown applications. The classical second-moment closure (third-moment discard) equations also satisfy the principle of energetic consistency, independently of the rank of the conditional covariance matrix. Low-rank approximation of these equations offers an energetically consistent, computationally viable alternative to ensemble filtering. Current formulations of long-window, weak-constraint, four-dimensional variational methods are designed to approximate the conditional mode rather than the conditional mean. Thus they neglect the nonlinear bias term in the second-moment closure equation for the conditional mean. The principle of

Magnetic Phase Diagram of α-RuCl3

Science.gov (United States)

Sears, Jennifer; Kim, Young-June; Zhao, Yang; Lynn, Jeffrey

The layered honeycomb material α-RuCl3 is thought to possess unusual magnetic interactions including a strong bond-dependent Kitaev term, offering a potential opportunity to study a material near a well understood spin liquid phase. Although this material orders magnetically at low temperatures and is thus not a realization of a Kitaev spin liquid, it does show a broad continuum of magnetic excitations reminiscent of that expected for the spin liquid phase. It has also been proposed that a magnetic field could destabilize the magnetic order in this material and induce a transition into a spin liquid phase. Low temperature magnetization and specific heat measurements in this material have suggested a complex magnetic phase diagram with multiple unidentified magnetic phases present at low temperature. This has provided motivation for our work characterizing the magnetic transitions and phase diagram in α-RuCl3. I will present detailed bulk measurements combined with magnetic neutron diffraction measurements to map out the phase diagram and identify the various phases present.

Evaluation report on CCTF core-I reflood tests Cl-5 (Run 14), Cl-10 (Run 19) and Cl-12 (Run 21)

International Nuclear Information System (INIS)

Akimoto, Hajime; Murao, Yoshio

1983-06-01

Three tests Cl-5 (Run 14), Cl-10 (Run 19) and Cl-12 (Run 21) were performed using the Cylindrical Core Test Facility to study the effect of the containment pressure on the core cooling and the system behaviors during the reflood phase of a PWR-LOCA. The containment pressures of these tests were 0.15, 0.20 and 0.30 MPa for the tests Cl-10, Cl-5 and Cl-12, respectively. Through the comparison of the test results from these three tests, the following results were obtained. (1) The higher containment pressure gave the higher heat transfer coefficient in the core. This resulted in the lower turnaround temperature, the shorter turnaround time and the shorter quench time at the higher containment pressure. (2) In the higher containment pressure test, the higher core water head, the higher upper plenum water head, the higher downcomer water head in the early period and the lower downcomer water head in the later period were observed than those in the lower containment pressure test. This resulted in the higher pressure drop through the intact loop in the early period of the tests and the lower pressure drop in the later period of the test with the containment pressure. (3) The pressure drop through the broken cold leg pressurized the primary system. The pressure drop through the broken cold leg was decreased with the containment pressure. (4) The core inlet mass flow rate was increased with the containment pressure as observed in the FLECHT-SET phase B1 test. In quantity, however, the effect of the containment pressure on the increase of the core inlet mass flow rate was less in the CCTF than that in the FLECHT-SET. The less sensitivity in the CCTF was attributed mainly to the great pressure drop through the broken cold leg, which was not observed in the FLECHT-SET with big broken cold leg. (5) The system effect of the containment pressure was explained quantitatively. (author)

Nuclear energy I, Non-energetic applications; Energia Nuclear I, Aplicaciones no energeticas

Energy Technology Data Exchange (ETDEWEB)

Lartigue G, J; Navarrete T, M; Cabrera M, L; Arandia, P A; Arriola S, H [Facultad de Quimica, 04510 Mexico D.F. (Mexico)

1986-07-01

The nuclear energy is defined as the energy produced or absorbed in the nuclear reactions, therefore, these are divided in endothermic and exothermic. The exothermic nuclear reactions present more interest from the point of view of its applications and they can show in four main forms: radioactivity (from 0 to 4 MeV/reaction; light nucleus fusion ( {approx} 20 MeV/reaction), heavy nucleus fusion ({approx} 200 MeV/reaction) and nucleons annihilation ( {approx} 2000 MeV/reaction). Nowadays only the fission has reached the stage of profitable energetic application, finding the other three forms in research and development. The non-energetic applications of the nuclear energy are characterized by they do not require of prior conversion to another form of energy and they are made through the use of radioisotopes as well as through the use of endothermic reaction caused in particle accelerators. In this work are presented some of the non-energetic applications with its theoretical and experimental basis as well as its benefits of each one. (Author)

The structure and dynamics of energetic displacement cascades in Cu and Ni. A molecular dynamics computer simulation study

International Nuclear Information System (INIS)

Diaz de la Rubia, T.

1989-01-01

The primary state of damage present in a solid as a result of particle irradiation has been a topic of interest to the physics and materials research community over the last forty years. Energetic displacement cascades resulting from the heavy ion irradiation of a solid play a prominent role in radiation damage and non-equilibrium processing of materials; however, their study has been hampered by the small size (∼10 -20 cm 3 ) and short lifetime (∼10 -11 s) as well as by their highly non-homogeneous nature. In this work, the molecular dynamics computer simulation technique is employed to study the structure and dynamics of energetic displacement cascades in Cu and Ni. The atomic interactions in Cu were described with the use of the Gibson II form of the Born-Mayer pair potential while for Ni the Johnson-Erginsoy pair potential was employed. Calculations were also carried out with the use of the embedded atom method many-body potentials. The results provide the first detailed microscopic description of the evolution of the cascade. The author shows for the first time, that a process akin to melting takes place in the core of the cascade. Atomic mixing, point defect production and point defect agglomeration, all processes directly related to the evolution of the cascade, are then explained in terms of a simple model in which the liquid-like nature of the cascade plays a dominant role in determining the primary state of damage

Infrared (1-12 μm) atomic and molecular emission signatures from energetic materials using laser-induced breakdown spectroscopy

Science.gov (United States)

Kumi Barimah, E.; Hömmerich, U.; Brown, E.; Yang, C. S.-C.; Trivedi, S. B.; Jin, F.; Wijewarnasuriya, P. S.; Samuels, A. C.; Snyder, A. P.

2013-05-01

Laser-induced breakdown spectroscopy (LIBS) is a powerful analytical technique to detect the elemental composition of solids, liquids, and gases in real time. For example, recent advances in UV-VIS LIBS have shown great promise for applications in chemical, biological, and explosive sensing. The extension of conventional UVVIS LIBS to the near-IR (NIR), mid-IR (MIR) and long wave infrared (LWIR) regions (~1-12 μm) offers the potential to provide additional information due to IR atomic and molecular signatures. In this work, a Q-switched Nd: YAG laser operating at 1064 nm was employed as the excitation source and focused onto several chlorate and nitrate compounds including KClO3, NaClO3, KNO3, and NaNO3 to produce intense plasma at the target surface. IR LIBS studies on background air, KCl , and NaCl were also included for comparison. All potassium and sodium containing samples revealed narrow-band, atomic-like emissions assigned to transitions of neutral alkali-metal atoms in accordance with the NIST atomic spectra database. In addition, first evidence of broad-band molecular LIBS signatures from chlorate and nitrate compounds were observed at ~10 μm and ~7.3 μm, respectively. The observed molecular emissions showed strong correlation with FTIR absorption spectra of the investigated materials.

Scaling the Thrust Production and Energetics of Inviscid Intermittent Swimming

Science.gov (United States)

Akoz, Emre; Moored, Keith

2015-11-01

Many fish have adopted an intermittent swimming gait sometimes referred as a burst-and-coast behavior. By using this gait, fish have been estimated at reducing their energetic cost of swimming by about 50%. Lighthill proposed that the skin friction drag of an undulating body can be around 400% greater than a rigidly-held coasting body, which may explain the energetic savings of intermittent swimming. Recent studies have confirmed the increase in skin friction drag over an undulating body, however, the increase is on the order of 20-70%. This more modest gain in skin friction drag is not sufficient to lead to the observed energy savings. Motivated by these observations, we investigate the inviscid mechanisms behind intermittent swimming for parameters typical of biology. We see that there is an energy savings at a fixed swimming speed for intermittent swimming as compared to continuous swimming. Then we consider three questions: What is the nature of the inviscid mechanism that leads to the observed energy savings, how do the forces and energetics of intermittent swimming scale with the swimming parameters, and what are the limitations to the benefit? Supported by the Office of Naval Research under Program Director Dr. Bob Brizzola, MURI grant number N00014-14-1-0533.

Electronic structure and magnetic ordering of the semiconducting chromium trihalides CrCl3, CrBr3, and CrI3

KAUST Repository

Wang, Hao

2011-03-01

We present results from an electronic structure investigation of the chromium halides CrCl3, CrBr3, and CrI3, as obtained by the linearized augmented plane wave method of density functional theory. Our interest focuses on the chloride. While all three halides display strong ferromagnetic coupling within the halide-Cr-halide triple layers, our emphasis is on differences in the interlayer magnetic coupling. In agreement with experimental results, our calculations indicate ferromagnetic ordering for CrBr3 as well as CrI3. The antiferromagnetic state of CrCl3 can be reproduced by introducing an on-site electron-electron repulsion. However, we observe that the ground state depends critically on the specific approach used. Our results show that a low temperature structural phase transition from monoclinic to trigonal is energetically favourable for CrCl3. © 2011 IOP Publishing Ltd.

A population of highly energetic transient events in the centres of active galaxies

Science.gov (United States)

Kankare, E.; Kotak, R.; Mattila, S.; Lundqvist, P.; Ward, M. J.; Fraser, M.; Lawrence, A.; Smartt, S. J.; Meikle, W. P. S.; Bruce, A.; Harmanen, J.; Hutton, S. J.; Inserra, C.; Kangas, T.; Pastorello, A.; Reynolds, T.; Romero-Cañizales, C.; Smith, K. W.; Valenti, S.; Chambers, K. C.; Hodapp, K. W.; Huber, M. E.; Kaiser, N.; Kudritzki, R.-P.; Magnier, E. A.; Tonry, J. L.; Wainscoat, R. J.; Waters, C.

2017-12-01

Recent all-sky surveys have led to the discovery of new types of transients. These include stars disrupted by the central supermassive black hole, and supernovae that are 10-100 times more energetic than typical ones. However, the nature of even more energetic transients that apparently occur in the innermost regions of their host galaxies is hotly debated1-3. Here we report the discovery of the most energetic of these to date: PS1-10adi, with a total radiated energy of 2.3 × 1052 erg. The slow evolution of its light curve and persistently narrow spectral lines over ˜ 3 yr are inconsistent with known types of recurring black hole variability. The observed properties imply powering by shock interaction between expanding material and large quantities of surrounding dense matter. Plausible sources of this expanding material are a star that has been tidally disrupted by the central black hole, or a supernova. Both could satisfy the energy budget. For the former, we would be forced to invoke a new and hitherto unseen variant of a tidally disrupted star, while a supernova origin relies principally on environmental effects resulting from its nuclear location. Remarkably, we also discover that PS1-10adi is not an isolated case. We therefore surmise that this new population of transients has previously been overlooked due to incorrect association with underlying central black hole activity.

Room temperature photoinduced magnetism in [py.H]{sub 3}[FeCl{sub 4}]{sub 2}Cl

Energy Technology Data Exchange (ETDEWEB)

Baniasadi, F. [Physics Department, Shahid Beheshti University, Tehran (Iran, Islamic Republic of); Tehranchi, M.M., E-mail: teranchi@sbu.ac.ir [Physics Department, Shahid Beheshti University, Tehran (Iran, Islamic Republic of); Fathi, M.B. [Physics Department, Kharazmi University, Tehran (Iran, Islamic Republic of); Hamidi, S.M. [Laser and Plasma Research Institute, Shahid Beheshti University, Tehran (Iran, Islamic Republic of); Safari, N.; Amani, V. [Faculty of Chemistry, Shahid Beheshti University, Tehran (Iran, Islamic Republic of)

2015-11-15

Photoinduced magnetism in a homogeneous solution of [py.H]{sub 3}[FeCl{sub 4}]{sub 2}Cl is measured by Faraday rotation in visible light (λ∼450–750 nm) at room temperature. The physics of this phenomenon may be attributed to electronic transitions caused by absorption of light. X-ray diffraction and Debye function analysis are therefore applied to find the abundant unit of molecules dissolved in the solution which are being further utilized to investigate the electronic structure and molecular orbitals by means of hybrid density function theory (B3LYP). Faraday rotation is observed at certain wavelengths consistent with energy differences of HOMO-LUMO energy levels. Thus this work puts forward a new material with certain photomagnetic properties which may be used in fabrication of room temperature magneto-optical switches. - Highlights: • Photoinduced magnetism in (FeCl{sub 4}){sub 2}(py.H){sub 3}Cl is illustrated via Faraday rotation. • The abundant unit of molecule is characterized by Debye function analysis of XRD. • PIM in the molecule is attributed to the charge transfer between HOMO-LUMO.

[Fe(F20 TPP)Cl]-catalyzed amination with arylamines and {[Fe(F20 TPP)(NAr)](PhI=NAr)} + . Intermediate assessed by high-resolution ESI-MS and DFT calculations.

Science.gov (United States)

Liu, Yungen; Chen, Guo-Qiang; Tse, Chun-Wai; Guan, Xianguo; Xu, Zheng-Jiang; Huang, Jie-Sheng; Che, Chi-Ming

2015-01-01

Amination of CH bonds catalyzed by transition metal complexes via nitrene/imide insertion is an appealing strategy for CN bond formation, and the use of iminoiodinanes, or their in situ generated forms from 'PhI(OAc)2 +primary amides (such as sulfonamides, sulfamates, and carbamates)', as nitrogen sources for the amination reaction has been well documented. In this work, a 'metal catalyst+PhI(OAc)2 +primary arylamines' amination protocol has been developed using [Fe(F20 TPP)Cl] (H2 F20 TPP=meso-tetrakis(pentafluorophenyl)porphyrin) as a catalyst. This catalytic method is applicable for both intra- and intermolecular amination of sp(2) and sp(3) CH bonds (>27 examples), affording the amination products, including natural products such as rutaecarpine, in moderate-to-good yields. ESI-MS analysis and DFT calculations lend support for the involvement of {[Fe(F20 TPP)(NC6 H4 -p-NO2 )](PhI=NC6 H4 -p-NO2 )} + . intermediate in the catalysis. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

37Cl/35Cl isotope ratio analysis in perchlorate by ion chromatography/multi collector -ICPMS: Analytical performance and implication for biodegradation studies.

Science.gov (United States)

Zakon, Yevgeni; Ronen, Zeev; Halicz, Ludwik; Gelman, Faina

2017-10-01

In the present study we propose a new analytical method for 37 Cl/ 35 Cl analysis in perchlorate by Ion Chromatography(IC) coupled to Multicollector Inductively Coupled Plasma Mass Spectrometry (MC-ICPMS). The accuracy of the analytical method was validated by analysis of international perchlorate standard materials USGS-37 and USGS -38; analytical precision better than ±0.4‰ was achieved. 37 Cl/ 35 Cl isotope ratio analysis in perchlorate during laboratory biodegradation experiment with microbial cultures enriched from the contaminated soil in Israel resulted in isotope enrichment factor ε 37 Cl = -13.3 ± 1‰, which falls in the range reported previously for perchlorate biodegradation by pure microbial cultures. The proposed analytical method may significantly simplify the procedure for isotope analysis of perchlorate which is currently applied in environmental studies. Copyright © 2017. Published by Elsevier Ltd.

Structure and Properties of Energetic Materials

Science.gov (United States)

1992-12-02

ielting (free/ing) as a function of pressure and temperature may be accomplished bw adiusting these parameters sot that both solid and liquid phases...Eq.(19) has the general time-lag form given by Eq.(1). By comparison of these two equations, one may write hA =Dkc2 + I h2R (20) 2n AL kc 2 h 2 . c0

Energetic Techniques For Planetary Defense

Science.gov (United States)

Barbee, B.; Bambacus, M.; Bruck Syal, M.; Greenaugh, K. C.; Leung, R. Y.; Plesko, C. S.

2017-12-01

Near-Earth Objects (NEOs) are asteroids and comets whose heliocentric orbits tend to approach or cross Earth's heliocentric orbit. NEOs of various sizes periodically collide with Earth, and efforts are currently underway to discover, track, and characterize NEOs so that those on Earth-impacting trajectories are discovered far enough in advance that we would have opportunities to deflect or destroy them prior to Earth impact, if warranted. We will describe current efforts by the National Aeronautics and Space Administration (NASA) and the National Nuclear Security Administration (NNSA) to assess options for energetic methods of deflecting or destroying hazardous NEOs. These methods include kinetic impactors, which are spacecraft designed to collide with an NEO and thereby alter the NEO's trajectory, and nuclear engineering devices, which are used to rapidly vaporize a layer of NEO surface material. Depending on the amount of energy imparted, this can result in either deflection of the NEO via alteration of its trajectory, or robust disruption of the NEO and dispersal of the remaining fragments. We have studied the efficacies and limitations of these techniques in simulations, and have combined the techniques with corresponding spacecraft designs and mission designs. From those results we have generalized planetary defense mission design strategies and drawn conclusions that are applicable to a range of plausible scenarios. We will present and summarize our research efforts to date, and describe approaches to carrying out planetary defense missions with energetic NEO deflection or disruption techniques.

Energetic map

International Nuclear Information System (INIS)

2012-01-01

This report explains the energetic map of Uruguay as well as the different systems that delimits political frontiers in the region. The electrical system importance is due to the electricity, oil and derived , natural gas, potential study, biofuels, wind and solar energy

Towards a 20 kA high temperature superconductor current lead module using REBCO tapes

Science.gov (United States)

Heller, R.; Bagrets, N.; Fietz, W. H.; Gröner, F.; Kienzler, A.; Lange, C.; Wolf, M. J.

2018-01-01

Most of the large fusion devices presently under construction or in operation consisting of superconducting magnets like EAST, Wendelstein 7-X (W7-X), JT-60SA, and ITER, use high temperature superconductor (HTS) current leads (CL) to reduce the cryogenic load and operational cost. In all cases, the 1st generation HTS material Bi-2223 is used which is embedded in a low-conductivity matrix of AgAu. In the meantime, industry worldwide concentrates on the production of the 2nd generation HTS REBCO material because of the better field performance in particular at higher temperature. As the new material can only be produced in a multilayer thin-film structure rather than as a multi-filamentary tape, the technology developed for Bi-2223-based current leads cannot be transferred directly to REBCO. Therefore, several laboratories are presently investigating the design of high current HTS current leads made of REBCO. Karlsruhe Institute of Technology is developing a 20 kA HTS current lead using brass-stabilized REBCO tapes—as a further development to the Bi-2223 design used in the JT-60SA current leads. The same copper heat exchanger module as in the 20 kA JT-60SA current lead will be used for simplicity, which will allow a comparison of the newly developed REBCO CL with the earlier produced and investigated CL for JT-60SA. The present paper discusses the design and accompanying test of single tape and stack REBCO mock-ups. Finally, the fabrication of the HTS module using REBCO stacks is described.

Fusion reactor materials

International Nuclear Information System (INIS)

Sethi, V.K.; Scholz, R.; Nolfi, F.V. Jr.; Turner, A.P.L.

1980-01-01

Data are given for each of the following areas: (1) effects of irradiation on fusion reactor materials, (2) hydrogen permeation and materials behavior in alloys, (3) carbon coatings for fusion applications, (4) surface damage of TiB 2 coatings under energetic D + and 4 He + irradiations, and (5) neutron dosimetry

Economical aspects of nuclear energetics

International Nuclear Information System (INIS)

Celinski, Z.

2000-01-01

The economical aspects of nuclear power generation in respect to costs of conventional energetics have been discussed in detail. The costs and competitiveness of nuclear power have been considered on the base of worldwide trends taking into account investment and fuel costs as well as 'social' costs being result of impact of different types of energetics on environment, human health etc

Luminescence and scintillation properties of Ce-doped Cs2ZnCl4 crystals

Science.gov (United States)

Sugawara, K.; Koshimizu, M.; Yanagida, T.; Fujimoto, Y.; Haruki, R.; Nishikido, F.; Kishimoto, S.; Asai, K.

2015-03-01

In this study, we have synthesized scintillation materials based on Ce-doped Cs2ZnCl4 crystals. The light yield was enhanced by up to 20% by doping Cs2ZnCl4 with Ce3+ ions. In the scintillation time profiles, fast components exhibited decay time constants on the order of nanoseconds, which was ascribed to Auger-free luminescence (AFL). The light yield of the AFL component decreased at 10 mol% Ce3+ concentration, which is mainly attributed to the reabsorption of AFL photons inside the crystals by Ce3+ ions, as seen in the scintillation spectra. Long components had decay time constants of approximately 30 ns. In addition, at 10 mol% Ce3+ concentration, a prominent band appeared at approximately 500 nm in the scintillation spectrum, which was not observed in the photoluminescence spectra. The long components in the scintillation time profiles and the 500 nm band in the scintillation spectra were tentatively attributed to self-trapped excitons perturbed by Ce3+ ions.

Textural improvement of salt-reduced Alaska pollack (Theragra chalcogramma) roe product by CaCl2.

Science.gov (United States)

Chen, Chaoping; Okazaki, Emiko; Osako, Kazufumi

2016-12-15

Salt-reduced Alaska pollack roe benefits public health by decreasing NaCl intake; however, it has a poor texture with low breaking strength. This study addresses the feasibility of NaCl reduction in salted roe products, with focusing on the improvement of breaking strength using CaCl2. Salted roe products were prepared by immersing Alaska pollack roe in either NaCl solutions (3.5, 7.0, 15.0, 20.0, and 25.0%) or 7.0% NaCl solutions with added CaCl2 (0.0, 0.5, 1.0, 2.0, and 3.0%). Breaking strength, moisture and salt contents, eggshell protein composition of the salted roe products, as well as total endogenous transglutaminase (TGase) activity in various NaCl and CaCl2 concentrations were analyzed. CaCl2 addition enhanced eggshell protein crosslinking and breaking strength of the salt-reduced roe products. An acyl transfer reaction catalyzed by calcium-dependent TGase may be responsible for the eggshell protein crosslinking and improved texture. Thus, we successfully developed a salt-reduced Alaska roe product using CaCl2. Copyright © 2016 Elsevier Ltd. All rights reserved.

Energetic Sustainability and the Environment: A Transdisciplinary, Economic–Ecological Approach

Directory of Open Access Journals (Sweden)

Ioan G. Pop

2017-05-01

Full Text Available The paper combines original concepts about eco-energetic systems, in a transdisciplinary sustainable context. Firstly, it introduces the concept of M.E.N. (Mega-Eco-Nega-Watt, the eco-energetic paradigm based on three different but complementary ecological economic spaces: the Megawatt as needed energy, the Ecowatt as ecological energy, and the Negawatt as preserved energy. The paper also deals with the renewable energies and technologies in the context of electrical energy production. Secondly, in the context of the M.E.N. eco-energetic paradigm, comprehensive definitions are given about eco-energetic systems and for pollution. Thirdly, the paper introduces a new formula for the eco-energetic efficiency which correlates the energetic efficiency of the system and the necessary newly defined ecological coefficient. The proposed formula for eco-energetic efficiency enables an interesting form of relating to different situations in which the input energy, output energy, lost energy, and externalities involved in an energetic process, interact to produce energy in a specific energetic system, in connection with the circular resilient economy model. Finally, the paper presents an original energetic diagram to explain different channels to produce electricity in a resilience regime, with high eco-energetic efficiency from primary external energetic sources (gravitation and solar sources, fuels (classical and radioactive, internal energetic sources (geothermal, volcanoes and other kind of sources. Regardless the kind of energetic sources used to obtain electricity, the entire process should be sustainable in what concerns the transdisciplinary integration of the different representative spheres as energy, socio-economy, and ecology (environment.

The crystal structure of TeCl3+AuCl4-

International Nuclear Information System (INIS)

Jones, P.G.; Jentsch, D.; Schwarzmann, E.

1986-01-01

TeCl 3 + AuCl 4 - crystallizes in the triclinic space group Panti 1 with a=7.564(2), b=7.720(3), c=8.964(3) A, α=78.26(3), β=88.84(3), γ=89.35(3) 0 , Z=2. The structure was refined to R 0.041 for 1380 reflections. The cation polyhedron, including secondary Te...Cl interactions, is a square pyramid with mean Te-Cl 2.294, Te...Cl 3.028 A. The secondary interactions link the ions to form centrosymmetric (TeCl 3 .AuCl 4 ) 2 dimers. (orig.)

Next Generation Energetic Materials: New Cluster Hydrides and Metastable Alloys of Aluminum in Very Low Oxidation States

Science.gov (United States)

2016-10-01

knowledge of barrier heights . For the reactions of 3O2 with closed- and open-shell Alx − and Gax − clusters, these cal- culations are complicated not only...nanoparticle nucleation on functionalized graphene surfactants from aluminum monochloride solutions. This data shows a strong affinity of AlCl units for... graphene vacancy sites; adsorption of AlCl to the site results in oxidative insertion into the Al–Cl bond and formation of an Al(III) center. Preliminary

Optimization of some eco-energetic systems

International Nuclear Information System (INIS)

Purica, I.; Pavelescu, M.; Stoica, M.

1976-01-01

An optimization problem of two eco-energetic systems is described. The first one is close to the actual eco-energetic system in Romania, while the second is a new one, based on nuclear energy as primary source and hydrogen energy as secondary source. The optimization problem solved is to find the optimal structure of the systems so that the objective functions adopted, namely unitary energy cost C and total pollution P, to be minimum at the same time. The problem can be modelated with a bimatrix cooperative mathematical game without side payments. We demonstrate the superiority of the new eco-energetic system. (author)

Dynamic fracture and hot-spot modeling in energetic composites

Science.gov (United States)

Grilli, Nicolò; Duarte, Camilo A.; Koslowski, Marisol

2018-02-01

Defects such as cracks, pores, and particle-matrix interface debonding affect the sensitivity of energetic materials by reducing the time-to-ignition and the threshold pressure to initiate an explosion. Frictional sliding of preexisting cracks is considered to be one of the most important causes of localized heating. Therefore, understanding the dynamic fracture of crystalline energetic materials is of extreme importance to assess the reliability and safety of polymer-bonded explosives. Phase field damage model simulations, based on the regularization of the crack surface as a diffuse delta function, are used to describe crack propagation in cyclotetramethylene-tetranitramine crystals embedded in a Sylgard matrix. A thermal transport model that includes heat generation by friction at crack interfaces is coupled to the solution of crack propagation. 2D and 3D dynamic compression simulations are performed with different boundary velocities and initial distributions of cracks and interface defects to understand their effect on crack propagation and heat generation. It is found that, at an impact velocity of 400 m/s, localized damage at the particle-binder interface is of key importance and that the sample reaches temperatures high enough to create a hot-spot that will lead to ignition. At an impact velocity of 10 m/s, preexisting cracks advanced inside the particle, but the increase of temperature will not cause ignition.

Positron trapping defects in free-volume investigation of Ge–Ga–S–CsCl glasses

International Nuclear Information System (INIS)

Klym, H.; Ingram, A.; Shpotyuk, O.; Hotra, O.; Popov, A.I.

2016-01-01

Evolution of free-volume positron trapping defects caused by crystallization process in (80GeS_2–20Ga_2S_3)_1_0_0_−_x(CsCl)_x, 0 ≤ x ≤ 15 chalcogenide-chalcohalide glasses was studied by positron annihilation lifetime technique. It is established that CsCl additives in Ge–Ga–S glassy matrix transform defect-related component spectra, indicating that the agglomeration of free-volume voids occurs in initial and crystallized (80GeS_2–20Ga_2S_3)_1_0_0_−_x(CsCl)_x, 0 ≤ x ≤ 10 glasses. Void fragmentation in (80GeS_2–20Ga_2S_3)_8_5(CsCl)_1_5 glass can be associated with loosing of their inner structure. Full crystallization in each of these glasses corresponds to the formation of defect-related voids. These trends are confirmed by positron-positronium decomposition algorithm. It is shown, that CsCl additives result in white shift in the visible regions in transmission spectra. The γ-irradiation of 80GeS_2–20Ga_2S_3 base glass leads to slight long-wavelength shift of the fundamental optical absorption edge and decreasing of transmission speaks in favor of possible formation of additional defects in glasses and their darkening. - Highlights: • CsCl additives in Ge–Ga–S glassy matrix lead to the agglomeration of voids. • Full crystallization of Ge–Ga–S–CsCl glasses corresponds to the formation of defect voids. • Gamma-irradiation of glass stimulates the creation of additional defects and darkening.

Surface structure and reaction property of CuCl{sub 2}-PdCl{sub 2} bimetallic catalyst in methanol oxycarbonylation: A DFT approach

Energy Technology Data Exchange (ETDEWEB)

Meng, Qingsen [Key Laboratory for Green Chemical Technology of Ministry of Education, Collaborative Innovation Center of Chemical Science and Engineering (Tianjin), School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China); Wang, Shengping, E-mail: spwang@tju.edu.cn [Key Laboratory for Green Chemical Technology of Ministry of Education, Collaborative Innovation Center of Chemical Science and Engineering (Tianjin), School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China); Shen, Yongli; Yan, Bing [Key Laboratory for Green Chemical Technology of Ministry of Education, Collaborative Innovation Center of Chemical Science and Engineering (Tianjin), School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China); Wu, Yuanxin [School of Chemical Engineering and Pharmacy, Wuhan Institute of Technology, Wuhan 430073 (China); Ma, Xinbin [Key Laboratory for Green Chemical Technology of Ministry of Education, Collaborative Innovation Center of Chemical Science and Engineering (Tianjin), School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China)

2014-02-15

Surface structure of CuCl{sub 2}-PdCl{sub 2} bimetallic catalyst (Wacker-type catalyst) was built employing density functional theory (DFT) calculations, and the reaction mechanism of methanol oxycarbonylation over the CuCl{sub 2}-PdCl{sub 2} surfaces was also investigated. On the CuCl{sub 2}-PdCl{sub 2} surface, the active site for methanol oxidation was confirmed as Cu-Cl-Cu (Pd). Comparing with pure CuCl{sub 2} surface, the introduction of Pd atom causes the electron repopulation on the surface and lowers the energy barrier for methanol oxidation, but the number of the active site decreases with the increasing of Pd doping volume. Agreed with previous experimental results, the Pd site is most favorable for the CO insertion, indicated by the lowest activation barrier for the formation of COOCH{sub 3} on Pd atom. The lowest energy barrier for the formation of DMC appears when COOCH{sub 3} species adsorbed on Pd atom and methoxyl adsorbed on Cu atoms, which is 0.42 eV. Finally, the reconstruction of the unsaturated surface is a spontaneous and exothermic process. Comparing with other surfaces, the rate-limiting step, methanol oxidation, on CuCl{sub 2}-PdCl{sub 2} surface with Pd/Cu = 1:17 has the lowest energy barrier, which is agreed with the experimental observation that PdCl{sub 2}-CuCl{sub 2} catalyst with Pd/Cu = 1:20 has the favorable activity. The adsorbed methoxyl will further lower the activation barrier of methanol oxidation, which is agreed with experimental observation that the Wacker-type catalysts have an induction period in the methanol oxidative carbonylation system.

Neutral Particle Analyzer Vertically Scanning Measurements of MHD-induced Energetic Ion Redistribution or Loss in the National Spherical Torus Experiment

International Nuclear Information System (INIS)

Medley, S.S.; Andre, R.; Bell, R.E.; Darrow, D.S.; Domier, C.W.; Fredrickson, E.D.; Gorelenkov, N.N.; Kaye, S.M.; LeBlanc, B.P.; Lee, K.C.; Levinton, F.M.; Liu, D.; Luhmann, N.C. Jr.; Menard, J.E.; Park, H.; Stutman, D.; Roquemore, A.L.; Tritz, K.; Yuh, H

2007-01-01

Observations of magneto-hydro-dynamic (MHD) induced redistribution or loss of energetic ions measured using the vertically scanning capability of the Neutral Particle Analyzer diagnostic on the National Spherical Torus Experiment (NSTX) are presented along with TRANSP and ORBIT code analysis of the results. Although redistribution or loss of energetic ions due to bursting fishbone-like and low-frequency (f ∼ 10 kHz) kinktype MHD activity has been reported previously, the primary goal of this work is to study redistribution or loss due to continuous Alfvenic (f ∼ 20-150 kHz) modes, a topic that heretofore has not been investigated in detail for NSTX plasmas. Initial indications are that the former drive energetic ion loss whereas the continuous Alfvenic modes only cause redistribution and the energetic ions remain confined.

Neutral Particle Analyzer Vertically Scanning Measurements of MHD-induced Energetic Ion Redistribution or Loss in the National Spherical Torus Experiment

Energy Technology Data Exchange (ETDEWEB)

S.S. Medley, R. Andre, R.E. Bell, D.S. Darrow, C.W. Domier, E.D. Fredrickson, N.N. Gorelenkov, S.M. Kaye, B.P. LeBlanc, K.C. Lee, F.M. Levinton, D. Liu, N.C. Luhmann, Jr., J.E. Menard, H. Park, D. Stutman, A.L. Roquemore, K. Tritz, H. Yuh and the NSTX Team

2007-11-15

Observations of magneto-hydro-dynamic (MHD) induced redistribution or loss of energetic ions measured using the vertically scanning capability of the Neutral Particle Analyzer diagnostic on the National Spherical Torus Experiment (NSTX) are presented along with TRANSP and ORBIT code analysis of the results. Although redistribution or loss of energetic ions due to bursting fishbone-like and low-frequency (f ~ 10 kHz) kinktype MHD activity has been reported previously, the primary goal of this work is to study redistribution or loss due to continuous Alfvénic (f ~ 20 – 150 kHz) modes, a topic that heretofore has not been investigated in detail for NSTX plasmas. Initial indications are that the former drive energetic ion loss whereas the continuous Alfvénic modes only cause redistribution and the energetic ions remain confined.

Improvement of pre-treatment method for 36Cl/Cl measurement of Cl in natural groundwater by AMS

International Nuclear Information System (INIS)

Nakata, Kotaro; Hasegawa, Takuma

2011-01-01

Estimation of 36 Cl/Cl by accelerator mass spectrometry (AMS) is a useful method to trace hydrological processes in groundwater. For accurate estimation, separation of SO 4 2- from Cl - in groundwater is required because 36 S affects AMS measurement of 36 Cl. Previous studies utilized the difference in solubility between BaSO 4 and BaCl 2 (BaSO 4 method) to chemically separate SO 4 2- from Cl - . However, the accuracy of the BaSO 4 method largely depends on operator skill, and consequently Cl - recovery is typically incomplete (70-80%). In addition, the method is time consuming (>1 week), and cannot be applied directly to dilute solutions. In this study, a method based on ion-exchange column chromatography (column method) was developed for separation of Cl - and SO 4 2- . Optimum conditions were determined for the diameter and height of column, type and amount of resin, type and concentration of eluent, and flow rate. The recovery of Cl - was almost 100%, which allowed complete separation from SO 4 2- . The separation procedure was short ( 4 methods, and then analyzed by AMS to estimate 36 S counts and 36 Cl/Cl values. 36 S counts in samples processed by the column method were stable and lower than those from the BaSO 4 method. The column method has the following advantages over the BaSO 4 method: (1) complete and stable separation of Cl - and SO 4 2- , (2) less operator influence on results, (3) short processing time ( - , and (5) concentration of Cl - and separation from SO 4 2- in the one system for dilute solutions.

Prevalence and pharmacologic treatment of patients with low back pain treated at kosovo energetic corporation.

Science.gov (United States)

Ibraimi, Zana; Murtezani, Ardiana; Haxhiu, Bekim; Mustafa, Aziz; Martinaj, Merita

2013-12-01

Low back pain (LBP) is a common complaint among the general population with a subgroup developing chronic and disabling symptoms generating large societal costs. Recurrences and functional limitations can be minimized with appropriate conservative management, including medications, physical therapy modalities, exercise and patient education. The purpose of this study was to determine the prevalence of low back complaints in industrial workers, to investigate whether individual risk factors involved in the occurrence of LBP, and to determine the most frequent used drug in LBP treatment. Data for this study were provided from Kosovo Energetic Corporation. A cross-sectional study design was utilized. Self-administered questionnaires were distributed among 228 industrial workers. Patient with LBP underwent a comprehensive clinical, radiological and biochemical evaluation. showed that LBP occurred in 63.5% of workers. Individual factors did not show significant associations with LBP. Age (OR=0.99/95% Cl 0.95-1.03), weight (OR=1.13/95% Cl 0.99-1.06), height (OR=0.97/95% Cl 0.91-1.02), and work experience (OR=1.01/95% Cl 0.97-1.05) increase odds for LBP but not significantly. The most frequently used drugs in patients included in this study are NSAIDs. In 33 (55.0%) patients for the treatment of LBP two types of drugs are administered. Increased physical activity, health promotion and reduced body weight can prevent morbidity from LBP. A continuous consultation with the Clinical Pharmacist demonstrates effective way of dosage and drug re-evaluation for the patients with LBP.

Relation between Kitaev magnetism and structure in $\\alpha$-RuCl$_3$

OpenAIRE

Glamazda, A.; Lemmens, P.; Do, S. -H.; Kwon, Y. S.; Choi, K. -Y.

2017-01-01

Raman scattering has been employed to investigate lattice and magnetic excitations of the honeycomb Kitaev material $\\alpha$-RuCl$_3$ and its Heisenberg counterpart CrCl$_3$. Our phonon Raman spectra give evidence for a first-order structural transition from a monoclinic to a rhombohedral structure for both compounds. Significantly, only $\\alpha$-RuCl$_3$ features a large thermal hysteresis, consistent with the formation of a wide phase of coexistence. In the related temperature interval of $...

Chemistry of high-energy materials

Energy Technology Data Exchange (ETDEWEB)

Klapoetke, Thomas M. [Ludwig-Maximilians-Univ., Muenchen (Germany). Dept. of Chemistry; Maryland Univ., College Park, MD (US). Center of Energetic Concepts Development (CECD)

2011-07-01

The graduate-level textbook Chemistry of High-Energy Materials provides an introduction to and an overview of primary and secondary (high) explosives as well as propellant charges, rocket propellants and pyrotechnics. After a brief historical overview, the main classes of energetic materials are discussed systematically. Thermodynamic aspects, as far as relevant to energetic materials, are discussed, as well as modern computational approaches to predict performance and sensitivity parameters. The most important performance criteria such as detonation velocity, detonation pressure and heat of explosion, as well as the relevant sensitivity parameters suc as impact and friction sensitivity and electrostatic discharge sensitivity are explored in detail. Modern aspects of chemical synthesis including lead-free primary explosives and high-nitrogen compounds are also included in this book together with a discussion of high-energy materials for future defense needs. The most important goal of this book, based on a lecture course which has now been held at LMU Munich for over 12 years, is to increase knowledge and know-how in the synthesis and safe handling of high-energy materials. Society needs now as much as ever advanced explosives, propellant charges, rocket propellants and pyrotechnics to meet the demands in defense and engineering. This book is first and foremost aimed at advanced students in chemistry, engineering and materials sciences. However, it is also intended to provide a good introduction to the chemistry of energetic materials and chemical defense technology for scientists in the defense industry and government-run defense organizations. (orig.)

Material and energy recovery in integrated waste management systems. An evaluation based on life cycle assessment

International Nuclear Information System (INIS)

Giugliano, Michele; Cernuschi, Stefano; Grosso, Mario; Rigamonti, Lucia

2011-01-01

This paper reports the environmental results, integrated with those arising from mass and energy balances, of a research project on the comparative analysis of strategies for material and energy recovery from waste, funded by the Italian Ministry of Education, University and Research. The project, involving the cooperation of five University research groups, was devoted to the optimisation of material and energy recovery activities within integrated municipal solid waste (MSW) management systems. Four scenarios of separate collection (overall value of 35%, 50% without the collection of food waste, 50% including the collection of food waste, 65%) were defined for the implementation of energetic, environmental and economic balances. Two sizes of integrated MSW management system (IWMS) were considered: a metropolitan area, with a gross MSW production of 750,000 t/year and an average province, with a gross MSW production of 150,000 t/year. The environmental analysis was conducted using Life Cycle Assessment methodology (LCA), for both material and energy recovery activities. In order to avoid allocation we have used the technique of the expansion of the system boundaries. This means taking into consideration the impact on the environment related to the waste management activities in comparison with the avoided impacts related to the saving of raw materials and primary energy. Under the hypotheses of the study, both for the large and for the small IWMS, the energetic and environmental benefits are higher than the energetic and environmental impacts for all the scenarios analysed in terms of all the indicators considered: the scenario with 50% separate collection in a drop-off scheme excluding food waste shows the most promising perspectives, mainly arising from the highest collection (and recycling) of all the packaging materials, which is the activity giving the biggest energetic and environmental benefits. Main conclusions of the study in the general field of the

Effect of Defects on Mechanisms of Initiation and Energy Release in Energetic Molecular Crystals

Science.gov (United States)

2011-02-10

also examined other energetic and reactive materials such as 1,3,5,7 cyclooctatetraene (COT) and potassium chlorate (KClO3) and ringed hydrocarbons...the space charge induced by the diffusive separation of potassium and fluoride ions in the shock wave affects polarization currents and depends on

Spontaneous Energy Concentration in Energetic Molecules, Interfaces and Composites: Response to Ultrasound and THz Radiation

Science.gov (United States)

2015-12-21

crystals or crystalline composites. One crystal had a slippery surface coating and the other did not. The coated ammonium nitrate , RDX and PBX...vibrational spectroscopies and time-resolved thermal imaging microscopy. 15. SUBJECT TERMS Ultrasound, THz radiation, energetic materials, hot spots, energy...studying fast processes at interfaces. 3. At the level of bulk materials, we developed a high-speed thermal imaging microscope apparatus.15󈧔

No solid solution compounds in between the binaries. Syntheses and crystal structures of Nb(Br{sub 0.62(4)}Cl{sub 0.38(4)}){sub 2}Cl{sub 2} and NbI{sub 2}Cl{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Reckeweg, Olaf; Schleid, Thomas [Stuttgart Univ. (Germany). Inst. fuer Anorganische Chemie

2018-04-01

The anion-mixed niobium tetrahalides Nb(Br{sub 0.62(4)}Cl{sub 0.38(4)}){sub 2}Cl{sub 2} and NbI{sub 2}Cl{sub 2} were obtained by heating NbBr{sub 5} with NbCl{sub 5} and NbI{sub 5} with NbCl{sub 5}, respectively, in equimolar ratios with niobium metal in evacuated, torch-sealed silica ampoules at 720 K for 3 days. The orthorhombic title compounds form as very brittle black needles and were characterized by single-crystal X-ray diffraction [space group: Immm, Z=4; a=704.27(6), b=824.13(7), c=929.64(8) pm for Nb(Br{sub 0.62(4)}Cl{sub 0.38(4)}){sub 2}Cl{sub 2} and a=753.76(6), b=829.38(7) and c=983.41(8) pm for NbI{sub 2}Cl{sub 2}]. Surprisingly enough, these mixed-anionic halides are not isostructural with either NbCl{sub 4}, NbBr{sub 4} or NbI{sub 4}, but crystallize isotypically with TaI{sub 2}Cl{sub 2}, thus being examples for differential site occupancy stabilized materials. Structural features of other niobium(IV) halides are compiled and compared to those of Nb(Br{sub 0.62(4)}Cl{sub 0.38(4)}){sub 2}Cl{sub 2} and NbI{sub 2}Cl{sub 2}. Except for NbF{sub 4}, they all exhibit chains of trans-edge connected [NbX{sub 6}]{sup 2-} octahedra, which allow Peierls distortions to form Nb-Nb single bonds. The packing of these chains differ, however, depending on the actual halide or mixed-halide combination.

Determination of the equilibrium constant of FeZrCl6 formation from FeCl3 and ZrCl4

International Nuclear Information System (INIS)

Berdonosov, S.S.; Kharisov, B.I.; Nikitin, M.I.

1992-01-01

Equilibrium pressures of chlorine formed in the course of reaction FeCl 3 +ZrCl 4 ↔ FeZrCl 6 +0.5 Cl 2 were determined at the temperatures of 250-325 deg C. The values of equilibrium constant K p of the reaction mentioned at the temperatures of 250, 275, 300 and 325 deg were calculated, taking into consideration the determined values of p Cl2 and literature data on equilibrium pressures of ZrCl 4 and FeCl 3 vapours

Dynamical spin structure factors of α-RuCl3

Science.gov (United States)

Suzuki, Takafumi; Suga, Sei-ichiro

2018-03-01

Honeycomb-lattice magnet α-RuCl3 is considered to be a potential candidate of realizing Kitaev spin liquid, although this material undergoes a phase transition to the zigzag magnetically ordered state at T N ∼ 7 K. Quite recently, inelastic neutron-scattering experiments using single crystal α-RuCl3 have unveiled characteristic dynamical properties. We calculate dynamical spin structure factors of three ab-initio models for α-RuCl3 with an exact numerical diagonalization method. We also calculate temperature dependences of the specific heat by employing thermal pure quantum states. We compare our numerical results with the experiments and discuss characteristics obtained by using three ab-initio models.

Energetic and frictional effects in the transport of ions in a cyclic peptide nanotube

Energy Technology Data Exchange (ETDEWEB)

Seo, Yongil; Song, Yeon Ho; Hwang, Hyeon Seok [Dept. of Chemistry and Institute for Molecular Science and Fusion Technology, Kangwon National University, Chuncheon (Korea, Republic of); Schatz, George C. [Dept. of Chemistry, Northwestern University, Evanston (United States)

2017-01-15

The effects of geometric restraints and frictional parameters on the energetics and dynamics of ion transport through a synthetic ion channel are investigated using molecular dynamics (MD) simulations for several different ions. To do so, potential of mean force profiles and position-dependent diffusion coefficients for Na{sup +}, K{sup +}, Ca{sup 2+}, and Cl{sup −} transport through a simple cyclic peptide nanotube, which is composed of 4× cyclo[−(D-Ala-Glu-D-Ala-Gln){sub 2−}] rings, are calculated via an adaptive biasing force MD simulation method and a Baysian inference/Monte Carlo algorithm. Among the restraints and parameters examined in this work, the radius parameter used in the flat-bottom half-harmonic restraint at the entrance and exit to channel has a great effect on the energetics of ion transport through the variation of entropy in the outside of the channel. The diffusivity profiles for the ions show a strong dependence on the damping coefficient, but the dependence on the coefficient becomes minimal inside the channel, indicating that the most important factor which affects the diffusivity of ions inside the channel is local interactions of ions with the structured channel water molecules through confinement.

Rocket measurements of energetic particles in the midlatitude precipitation zone

Science.gov (United States)

Voss, H. D.; Smith, L. G.; Braswell, F. M.

1980-01-01

Measurements of energetic ion and electron properties as a function of altitude in the midlatitude zone of nighttime energetic particle precipitation are reported. The measurements of particle fluxes, energy spectra and pitch angle distributions were obtained by a Langmuir probe, six energetic particle spectrometers and an electrostatic analyzer on board a Nike Apache rocket launched near the center of the midlatitude zone during disturbed conditions. It is found that the incident flux was primarily absorbed rather than backscattered, and consists of mainly energetic hydrogen together with some helium and a small energetic electron component. Observed differential energy spectra of protons having an exponential energy spectrum, and pitch angle distributions at various altitudes indicate that the energetic particle flux decreases rapidly for pitch angles less than 70 deg. An energetic particle energy flux of 0.002 ergs/sq cm per sec is calculated which indicates the significance of energetic particles as a primary nighttime ionization source for altitudes between 120 and 200 km in the midlatitude precipitation zone.

CH3Cl self-broadening coefficients and their temperature dependence

International Nuclear Information System (INIS)

Dudaryonok, A.S.; Lavrentieva, N.N.; Buldyreva, J.V.

2013-01-01

CH 3 35 Cl self-broadening coefficients at various temperatures of atmospheric interest are computed by a semi-empirical method particularly suitable for molecular systems with strong dipole–dipole interactions. In order to probe the dependence on the rotational number K, the model parameters are adjusted on extensive room-temperature measurements for K≤7 and allow reproducing fine features of J-dependences observed for K≤3; for higher K up to 20, the fitting is performed on specially calculated semi-classical values. The temperature exponents for the standard power law are extracted and validated by calculation of low-temperature self-broadening coefficients comparing very favorably with available experimental data. An extensive line-list of self-broadening coefficients at the reference temperature 296 K and associated temperature exponents for 0≤J≤70, 0≤K≤20 is provided as Supplementary material for their use in atmospheric applications and spectroscopic databases. -- Highlights: • We calculated methyl chloride self-broadening coefficients using two methods. • Rotational quantum numbers were J from 0 till 70 and K from 0 till 20. • The temperature exponents were calculated for every mentioned line

Calculating Heat of Formation Values of Energetic Compounds: A Comparative Study

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Michael S. Elioff

2016-01-01

Full Text Available Heat of formation is one of several important parameters used to assess the performance of energetic compounds. We evaluated the ability of six different methods to accurately calculate gas-phase heat of formation (ΔfH298,go values for a test set of 45 nitrogen-containing energetic compounds. Density functional theory coupled with the use of isodesmic or other balanced equations yielded calculated results in which 82% (37 of 45 of the ΔfH298,go values were within ±2.0 kcal/mol of the most recently recommended experimental/reference values available. This was compared to a procedure using density functional theory (DFT coupled with an atom and group contribution method in which 51% (23 of 45 of the ΔfH298,go values were within ±2.0 kcal/mol of these values. The T1 procedure and Benson’s group additivity method yielded results in which 51% (23 of 45 and 64% (23 of 36 of the ΔfH298,go values, respectively, were within ±2.0 kcal/mol of these values. We also compared two relatively new semiempirical approaches (PM7 and RM1 with regard to their ability to accurately calculate ΔfH298,go. Although semiempirical methods continue to improve, they were found to be less accurate than the other approaches for the test set used in this investigation.

Distillation of LiCl from the LiCl-Li2O molten salt of the electrolytic reduction process

International Nuclear Information System (INIS)

Kim, I.S.; Oh, S.C.; Im, H.S.; Hur, J.M.; Lee, H.S.

2013-01-01

Electrolytic reduction of the uranium oxide in LiCl-Li 2 O molten salt for the treatment of spent nuclear fuel requires the separation of the residual salt from the reduced metal product, which contains about 20 wt% salt. In order to separate the residual salt and reuse it in the electrolytic reduction, a vacuum distillation process was developed. Lab-scale distillation equipment was designed and installed in an argon atmosphere glove box. The equipment consisted of an evaporator in which the reduced metal product was contained and exposed to a high temperature and reduced pressure; a receiver; and a vertically oriented condenser that operated at a temperature below the melting point of lithium chloride. We performed experiments with LiCl-Li 2 O salt to evaluate the evaporation rate of LiCl salt and varied the operating temperature to discern its effect on the behavior of salt evaporation. Complete removal of the LiCl salt from the evaporator was accomplished by reducing the internal pressure to <100 mTorr and heating to 900 deg C. We achieved evaporation efficiency as high as 100 %. (author)

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

International Nuclear Information System (INIS)

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

2016-01-01

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

Radiotoxicology analysis in Nuclear and Energetic Research Institute (IPEN-CNEN/SP)

International Nuclear Information System (INIS)

Duarte, C.L.; Gaburo, J.C.; Bellintani, S.A.

1987-01-01

The radiotoxicology laboratory of Nuclear and Energetic Research Institute (IPEN) has the objective of control the internal contamination of workers that handle radioactive materials, in industrial and medical sectors. This control is made through radiochemical analysis of excreta. Nowadays in this laboratory are realized occupational controls on individual, exposure to uranium, tritium, iodine, fluorine, lead compounds, for workers of IPEN and for external institutions, when solicited. (C.G.C.) [pt

Structure of Energetic Particle Mediated Shocks Revisited

International Nuclear Information System (INIS)

Mostafavi, P.; Zank, G. P.; Webb, G. M.

2017-01-01

The structure of collisionless shock waves is often modified by the presence of energetic particles that are not equilibrated with the thermal plasma (such as pickup ions [PUIs] and solar energetic particles [SEPs]). This is relevant to the inner and outer heliosphere and the Very Local Interstellar Medium (VLISM), where observations of shock waves (e.g., in the inner heliosphere) show that both the magnetic field and thermal gas pressure are less than the energetic particle component pressures. Voyager 2 observations revealed that the heliospheric termination shock (HTS) is very broad and mediated by energetic particles. PUIs and SEPs contribute both a collisionless heat flux and a higher-order viscosity. We show that the incorporation of both effects can completely determine the structure of collisionless shocks mediated by energetic ions. Since the reduced form of the PUI-mediated plasma model is structurally identical to the classical cosmic ray two-fluid model, we note that the presence of viscosity, at least formally, eliminates the need for a gas sub-shock in the classical two-fluid model, including in that regime where three are possible. By considering parameters upstream of the HTS, we show that the thermal gas remains relatively cold and the shock is mediated by PUIs. We determine the structure of the weak interstellar shock observed by Voyager 1 . We consider the inclusion of the thermal heat flux and viscosity to address the most general form of an energetic particle-thermal plasma two-fluid model.

Structure of Energetic Particle Mediated Shocks Revisited

Energy Technology Data Exchange (ETDEWEB)

Mostafavi, P.; Zank, G. P. [Department of Space Science, University of Alabama in Huntsville, Huntsville, AL 35899 (United States); Webb, G. M. [Center for Space Plasma and Aeronomic Research (CSPAR), University of Alabama in Huntsville, Huntsville, AL 35899 (United States)

2017-05-20

The structure of collisionless shock waves is often modified by the presence of energetic particles that are not equilibrated with the thermal plasma (such as pickup ions [PUIs] and solar energetic particles [SEPs]). This is relevant to the inner and outer heliosphere and the Very Local Interstellar Medium (VLISM), where observations of shock waves (e.g., in the inner heliosphere) show that both the magnetic field and thermal gas pressure are less than the energetic particle component pressures. Voyager 2 observations revealed that the heliospheric termination shock (HTS) is very broad and mediated by energetic particles. PUIs and SEPs contribute both a collisionless heat flux and a higher-order viscosity. We show that the incorporation of both effects can completely determine the structure of collisionless shocks mediated by energetic ions. Since the reduced form of the PUI-mediated plasma model is structurally identical to the classical cosmic ray two-fluid model, we note that the presence of viscosity, at least formally, eliminates the need for a gas sub-shock in the classical two-fluid model, including in that regime where three are possible. By considering parameters upstream of the HTS, we show that the thermal gas remains relatively cold and the shock is mediated by PUIs. We determine the structure of the weak interstellar shock observed by Voyager 1 . We consider the inclusion of the thermal heat flux and viscosity to address the most general form of an energetic particle-thermal plasma two-fluid model.

Energetic consumption levels and human development indexes

International Nuclear Information System (INIS)

Boa Nova, Antonio Carlos

1999-01-01

The article overviews the energetic consumption levels and human development indexes. The human development indexes are described based on the United Nations Development Programme. A comparison between the energetic consumption levels and human development indexes is also presented

Amorphous chalcogenide semiconductors for solid state dosimetric systems of high-energetic ionizing radiation

International Nuclear Information System (INIS)

Shpotyuk, O.

1997-01-01

The application possibilities of amorphous chalcogenide semiconductors use as radiation-sensitive elements of high-energetic (E > 1 MeV) dosimetric systems are analysed. It is shown that investigated materials are characterized by more wide region of registered absorbed doses and low temperature threshold of radiation information bleaching in comparison with well-known analogies based on coloring oxide glasses. (author)

X-ray spectroscopic technique for energetic electron transport studies in short-pulse laser/plasma interactions

Energy Technology Data Exchange (ETDEWEB)

Tutt, T.E.

1994-12-01

When a solid target is irradiated by a laser beam, the material is locally heated to a high temperature and a plasma forms. The interaction of the laser with plasma can produce energetic electrons. By observing the behavior of these {open_quotes}hot{close_quotes} electrons, we hope to obtain a better understanding of Laser/Plasma Interactions. In this work we employ a layered-fluorescer technique to study the transport, and therefore the energetics, of the electrons. The plasma forms on a thin foil of metallic Pd which is bonded to thin layer of metallic Sn. Electrons formed from the plasma penetrate first the Pd and then the Sn. In both layers the energetic electrons promote inner (K) shell ionization of the metallic atoms which leads to the emission of characteristic K{sub {alpha}} x-rays of the fluorescers. By recording the x-ray spectrum emitted by the two foils, we can estimate the energy-dependent range of the electrons and their numbers.

Use of thermodynamic calculation for investigating phase diagram of the ternary system NaCl-PbCl2-NdCl3

International Nuclear Information System (INIS)

Kostygov, V.I.; Potemin, S.S.

1984-01-01

Thermodynamic calculation of meltability diagram of ternary system NaCl-PbCl 2 -NdCl 3 with the use of literature and experimental data on meltability diagrams of binary systems forming it, as well as data on crystallization heats of the components, has been carried out. Equations are derived under condition of pseudoperfection of the ternary system. 64 mol.% PbCl 2 , 26 mol.% NaCl, 10 mol.% NdCl 3 and average temperature of crystallization 391 deg C correspond to the calculated composition of the ternary eutectics, 49 mol.% PbCl 2 , 35 mol.% NaCl, 16 mol.% NdCl 3 and average temperature of peritectic transformation 416 deg C - to the composition of the ternary peritectic. The results obtained agree well with the experimental data

The uptake of Cs, Cl, I, Co, U and Pu by C-S-H, portlandite and ettringite

International Nuclear Information System (INIS)

Le Callonnec, C.; Richet, C.; Ayache, R.

2000-01-01

The aim of this work is to study the retention of Pu, Cs, Cl, U, Co and I onto the three phases of a cement paste: calcium silicate hydrates or C-S-H (Ca/Si=1.65), portlandite (Ca(OH) 2 ) and ettringite (Ca 6 Al 2 S 3 O 21 .32H 2 O). C-S-H of Ca/Si molar ratio of 1.65 and ettringite were prepared in suspension, while portlandite was provided by an industrial laboratory. The sorptive power for each ion was determined by a batch model at 20 degrees Celsius. The uptake of ions onto the phases has been obtained by introducing a very small volume of radioactive Cs, Co, Cl, I, U and Pu solution in each batch. Aliquots of solution were periodically removed for analysis. The results show that there are two kinds of ions whatever the solid phase: those which are poorly sorbed: Cs, Cl, I and Co, U and Pu which are strongly sorbed (by a factor 100 to 10000). Elsewhere, the comparison between the sorptive power of each phase reveals that C-S-H develops a significant sorption potential for pluri-valent ions (Pu, U, Co) as well as for Cl. The retention capacity of portlandite mainly towards pluri-valent cations is one or two orders of magnitude weaker than C-S-H capacity. Ettringite only plays a sorptive role relatively to Cs. However, iodine does not have a strong affinity for any solid at all. The data allow us to calculate a global sorption coefficient Kd of the cement paste for each ion. Assuming that the proportion of C-S-H, portlandite, ettringite is respectively 65%, 15% and 5% in a Portland cement, the global sorption coefficient is in good agreement with literature regarding on U, Cs, I and Cl. Cementitious materials appear to be an interesting chemical barrier that can limit the diffusion of pluri-valent cations. As C-S-H represent from 60% to 75% of the cement paste, this study leads to underline that C-S-H is mainly responsible for the retention capacity of cementitious materials specially towards U, Pu, Co, Cl although its sorption power is limited concerning

Ecological problems of thermonuclear energetics. Review

Energy Technology Data Exchange (ETDEWEB)

Sivintsev, Yu V

1980-01-01

A review of preliminary quantitative estimates of radiation hazard of thermonuclear reactors is presented. Main attention is given to three aspects: nonradiation effect on environment, radionuclide blow-ups at normal operation and emergency situations with their consequences. The given data testify to great radiological advantages of thermonuclear energetics as compared with the modern nuclear energetics with thermal and prospective fast reactors.

SEPARATION OF CsCl FROM LiCl-CsCl MOLTEN SALT BY COLD FINGER MELT CRYSTALLIZATION

Directory of Open Access Journals (Sweden)

JOSHUA R. VERSEY

2014-06-01

Full Text Available This study provides a fundamental understanding of a cold finger melt crystallization technique by exploring the heat and mass transfer processes of cold finger separation. A series of experiments were performed using a simplified LiCl-CsCl system by varying initial CsCl concentrations (1, 3, 5, and 7.5 wt%, cold finger cooling rates (7.4, 9.8, 12.3, and 14.9 L/min, and separation times (5, 10, 15, and 30 min. Results showed a potential recycling rate of 0.36 g/min with a purity of 0.33 wt% CsCl in LiCl. A CsCl concentrated drip formation was found to decrease crystal purity especially for smaller crystal formations. Dimensionless heat and mass transfer correlations showed that separation production is primarily influenced by convective transfer controlled by cooling gas flow rate, where correlations are more accurate for slower cooling gas flow rates.

CH_3Cl, CH_2Cl_2, CHCl_3, and CCl_4: Infrared spectra, radiative efficiencies, and global warming potentials

International Nuclear Information System (INIS)

Wallington, Timothy J.; Pivesso, Bruno Pasquini; Lira, Alane Moura; Anderson, James E.; Nielsen, Claus Jørgen; Andersen, Niels Højmark; Hodnebrog, Øivind

2016-01-01

Infrared spectra for the title compounds were measured experimentally in 700 Torr of air at 295 K and systematically modeled in B3LYP, M06-2X and MP2 calculations employing various basis sets. Calibrated infrared spectra over the wavenumber range 600–3500 cm"−"1 are reported and combined with literature data to provide spectra for use in experimental studies and radiative transfer calculations. Integrated absorption cross sections are (units of cm"−"1 molecule"−"1): CH_3Cl, 660–780 cm"−"1, (3.89±0.19)×10"−"1"8; CH_2Cl_2, 650–800 cm"−"1, (2.16±0.11)×10"−"1"7; CHCl_3, 720–810 cm"−"1, (4.08±0.20)×10"−"1"7; and CCl_4, 730–825 cm"−"1, (6.30±0.31)×10"−"1"7. CH_3Cl, CH_2Cl_2, CHCl_3, and CCl_4 have radiative efficiencies of 0.004, 0.028, 0.070, and 0.174 W m"−"2 ppb"−"1 and global warming potentials (100 year horizon) of 5, 8, 15, and 1775, respectively. Quantum chemistry calculations generally predict larger band intensities than the experimental values. The best agreement with experiments is obtained in MP2(Full) calculations employing basis sets of at least triple-zeta quality augmented by diffuse functions. The B3LYP functional is found ill-suited for calculating vibrational frequencies and infrared intensities of halocarbons. - Highlights: • Infrared spectra reported for CH_3Cl, CH_2Cl_2, CHCl_3, and CCl_4. • REs of CH_3Cl, CH_2Cl_2, CHCl_3, and CCl_4 are 0.004, 0.028, 0.070, and 0.174 W m"−"2 ppb"−"1, respectively. • GWPs of CH_3Cl, CH_2Cl_2, CHCl_3, and CCl_4 are 5, 8, 15, and 1775, respectively.

Electrochemical characterisation of CaCl2 deficient LiCl-KCl-CaCl2 eutectic melt and electro-deoxidation of solid UO2

Science.gov (United States)

Sri Maha Vishnu, D.; Sanil, N.; Mohandas, K. S.; Nagarajan, K.

2016-03-01

The CaCl2 deficient ternary eutectic melt LiCl-KCl-CaCl2 (50.5: 44.2: 5.3 mol %) was electrochemically characterised by cyclic voltammetry and polarization techniques in the context of its probable use as the electrolyte in the electrochemical reduction of solid UO2 to uranium metal. Tungsten (cathodic polarization) and graphite (anodic polarization) working electrodes were used in these studies carried out in the temperature range 623 K-923 K. The cathodic limit of the melt was observed to be set by the deposition of Ca2+ ions followed by Li+ ions on the tungsten electrode and the anodic limit by oxidation of chloride ions on the graphite electrode (chlorine evolution). The difference between the onset potential of deposition of Ca2+ and Li+ was found to be 0.241 V at a scan rate of 20 mV/s at 623 K and the difference decreased with increase in temperature and vanished at 923 K. Polarization measurements with stainless steel (SS) cathode and graphite anode at 673 K showed the possibility of low-energy reactions occurring on the UO2 electrode in the melt. UO2 pellets were cathodically polarized at 3.9 V for 25 h to test the feasibility of electro-reduction to uranium in the melt. The surface of the pellets was found reduced to U metal.

SO2 absorption in EmimCl-TEG deep eutectic solvents.

Science.gov (United States)

Yang, Dezhong; Zhang, Shaoze; Jiang, De-En; Dai, Sheng

2018-05-23

Deep eutectic solvents (DESs) based on 1-ethyl-3-methylimidazolium chloride (EmimCl) and triethylene glycol (TEG) with different molar ratios (from 6 : 1 to 1 : 1) were prepared. FTIR and theoretical calculation indicated that the C2-H on the imidazolium ring form hydrogen bonds with the hydroxyl group rather than the ether O atom of the TEG. The EmimCl-TEG DESs can efficiently capture SO2; in particular, EmimCl-TEG (6 : 1) can capture 0.54 g SO2 per gram of solvent at 0.10 atm and 20 °C, the highest absorption amount for DESs under the same conditions. Theoretical calculation showed that the high SO2 absorption capacity was mainly due to the strong charge-transfer interaction between SO2 and the anion Cl-. Moreover, SO2 desorption in the DESs can be controlled by tuning the interaction between EmimCl and TEG, and the DESs can be cycled many times.

Synthesis and characterization of technetium(III) complexes containing 2,2'-bipyridine and 1,10-phenanthroline. X-ray crystal structures of cis (Cl),trans(P)-[TcCl2(P(CH3)2C6H5)2(bpy)]B(C6H5)4, cis (Cl),trans(P)-[TcCl2(P(CH3)2C6H5)2(phen)]B(C6H5)4, and cis (Cl),trans(P)-[TcCl2(P(CH3CH2)(C6H5)2)2(bpy)]SO3CF3

International Nuclear Information System (INIS)

Wilcox, B.E.; Ho, D.M.; Deutsch, E.

1989-01-01

Technetium(III) complexes of the general formula cis(Cl),trans(P)-[TcCl 2 (P) 2 L] + , where (P) is dimethylphenylphosphine (PMe 2 Ph) or ethyldiphenylphosphine (PEtPh 2 ) and L is 2,2'-bipyridine (bpy), 4,4'-dimethyl-2,2'-bipyridine (Me 2 bpy), or 1,10-phenanthroline (phen), have been synthesized and characterized. They are prepared by L substitution onto, with concomitant displacement of one chloride and one phosphine ligand from, the mer-TcCl 3 (P) 3 starting material in refluxing ethanol. Analysis of these complexes by fast atom bombardment mass spectrometry (in the positive ion mode) provides fingerprint mass spectra that exhibit peaks assigned to the molecular ion M + as well as peaks assigned to M + minus one or more monodentate ligands. Results of single-crystal x-ray structure determinations of cis(Cl),trans(P)-[TcCl 2 (PMe 2 Ph) 2 (bpy)]BPh 4 (A), cis(Cl),trans(P)-[TcCl 2- (PMe 2 Ph) 2 (phen)]BPh 4 (B), and cis(Cl),trans(P)-[TcCl 2 (PEtPh 2 ) 2 (bpy)]SO 3 CF 3 (C), with formula weights of 921.62, 945.64, and 903.65, respectively are reported. 26 refs., 5 figs., 5 tabs

Assessment of accident energetics in LMFBR core-disruptive accidents

International Nuclear Information System (INIS)

Fauske, H.K.

1977-01-01

An assessment of accident energetics in LMFBR core-disruptive accidents is given with emphasis on the generic issues of energetic recriticality and energetic fuel-coolant interaction events. Application of a few general behavior principles to the oxide-fueled system suggests that such events are highly unlikely following a postulated core meltdown event

Energetic Assessment of the Nonexercise Activities under Free-Living Conditions

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Shijie Sun

2016-01-01

Full Text Available Nonexercise activities (NAs are common types of physical activity in daily life and critical component in energy expenditure. However, energetic assessment of NA, particularly in free-living subjects, is a technical challenge. In this study, mechanical modeling and portable device were used to evaluate five common types of NA in daily life: sit to stand, lie to sit, bowing while standing, squat, and right leg over left. A human indirect calorimeter was used to measure the activity energy expenditure of NA. Mechanical work and mechanical efficiency of NA were calculated for mechanical modeling. Thirty-two male subjects were recruited for the study (20 subjects for the development of models and 12 subjects for evaluation of models. The average (mean ± SD mechanical work of 5 NAs was 2.31 ± 0.50, 2.88 ± 0.57, 1.75 ± 0.55, 3.96 ± 1.25, and 1.25 ± 0.51 J/kg·m, respectively. The mean mechanical efficiencies of those activities were 22.0 ± 3.3%, 26.5 ± 5.1%, 19.8 ± 3.7%, 24.0 ± 5.5%, and 26.3 ± 5.5%. The activity energy expenditure estimated by the models was not significantly different from the measurements by the calorimeter (p>0.05 with accuracies of 102.2 ± 20.7%, 103.7 ± 25.8%, 105.6 ± 14.6%, 101.1 ± 28.0%, and 95.8 ± 20.7%, respectively, for those activities. These findings suggest that the mechanical models combined with a portable device can provide an alternative method for the energetic analysis of nonexercise activities under free-living condition.

Energetic Assessment of the Nonexercise Activities under Free-Living Conditions.

Science.gov (United States)

Sun, Shijie; Tang, Qiang; Quan, Haiying; Lu, Qi; Sun, Ming; Zhang, Kuan

2016-01-01

Nonexercise activities (NAs) are common types of physical activity in daily life and critical component in energy expenditure. However, energetic assessment of NA, particularly in free-living subjects, is a technical challenge. In this study, mechanical modeling and portable device were used to evaluate five common types of NA in daily life: sit to stand, lie to sit, bowing while standing, squat, and right leg over left. A human indirect calorimeter was used to measure the activity energy expenditure of NA. Mechanical work and mechanical efficiency of NA were calculated for mechanical modeling. Thirty-two male subjects were recruited for the study (20 subjects for the development of models and 12 subjects for evaluation of models). The average (mean ± SD) mechanical work of 5 NAs was 2.31 ± 0.50, 2.88 ± 0.57, 1.75 ± 0.55, 3.96 ± 1.25, and 1.25 ± 0.51 J/kg·m, respectively. The mean mechanical efficiencies of those activities were 22.0 ± 3.3%, 26.5 ± 5.1%, 19.8 ± 3.7%, 24.0 ± 5.5%, and 26.3 ± 5.5%. The activity energy expenditure estimated by the models was not significantly different from the measurements by the calorimeter (p > 0.05) with accuracies of 102.2 ± 20.7%, 103.7 ± 25.8%, 105.6 ± 14.6%, 101.1 ± 28.0%, and 95.8 ± 20.7%, respectively, for those activities. These findings suggest that the mechanical models combined with a portable device can provide an alternative method for the energetic analysis of nonexercise activities under free-living condition.

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

Energy Technology Data Exchange (ETDEWEB)

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

2016-11-15

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

Electric conductivity of PCl5-ZrCl4, PCl5-TaCl5, and PCl5-MoCl5 molten mixtures

International Nuclear Information System (INIS)

Salyulev, A.B.; Red'kin, A.A.; Moskalenko, N.I.

1997-01-01

When mixing individual molecular melts of PCl 5 with ZrCl 4 , TaCl 5 or with MoCl 5 , an essential (by several orders) increase in electric conductivity (up to 0.02-0.1 Ohm -1 ·cm -1 ), which stems, in all probability, from the appearance of complex ions PCl 4 + , ZrCl 5 - , ZrCl 6 2- , TaCl 5 - and MoCl 6 - in the molten mixtures as a result of chemical interaction

Heliospheric Observations of Energetic Particles

Science.gov (United States)

Summerlin, Errol J.

2011-01-01

Heliospheric observations of energetic particles have shown that, on long time averages, a consistent v^-5 power-law index arises even in the absence of transient events. This implies an ubiquitous acceleration process present in the solar wind that is required to generate these power-law tails and maintain them against adiabatic losses and coulomb-collisions which will cool and thermalize the plasma respectively. Though the details of this acceleration process are being debated within the community, most agree that the energy required for these tails comes from fluctuations in the magnetic field which are damped as the energy is transferred to particles. Given this source for the tail, is it then reasonable to assume that the turbulent LISM should give rise to such a power-law tail as well? IBEX observations clearly show a power-law tail of index approximately -5 in energetic neutral atoms. The simplest explanation for the origins of these ENAs are that they are energetic ions which have charge-exchanged with a neutral atom. However, this would imply that energetic ions possess a v^-5 power-law distribution at keV energies at the source of these ENAs. If the source is presumed to be the LISM, it provides additional options for explaining the, so called, IBEX ribbon. This presentation will discuss some of these options as well as potential mechanisms for the generation of a power-law spectrum in the LISM.

Physics of energetic ions

International Nuclear Information System (INIS)

1999-01-01

Physics knowledge (theory and experiment) in energetic particles relevant to design of a reactor scale tokamak is reviewed, and projections for ITER are provided in this Chapter of the ITER Physics Basis. The review includes single particle effects such as classical alpha particle heating and toroidal field ripple loss, as well as collective instabilities that might be generated in ITER plasmas by energetic alpha particles. The overall conclusion is that fusion alpha particles are expected to provide an efficient plasma heating for ignition and sustained burn in the next step device. The major concern is localized heat loads on the plasma facing components produced by alpha particle loss, which might affect their lifetime in a tokamak reactor. (author)

Energetic particle observations at the subsolar magnetopause

Directory of Open Access Journals (Sweden)

A. A. Eccles

Full Text Available The pitch-angle distributions (PAD of energetic particles are examined as the ISEE-1 satellite crosses the Earth’s magnetopause near the subsolar point. The investigation focuses on the possible existence of a particular type of distribution that would be associated with a source of energetic particles in the high-latitude magnetosphere. PADs, demonstrating broad, persistent field-aligned fluxes filling a single hemisphere (upper/northern or lower/southern, were observed just sunward of the magnetopause current layer for an extended period of many minutes. These distributions are a direct prediction of a possible source of energetic particles located in the high altitude dayside cusp and we present five examples in detail of the three-dimensional particle distributions to demonstrate their existence. From these results, other possible causes of such PADs are examined.

Key words. Magnetospheric physics (energetic particles, precipitating; magnetopause, cusp and boundary layers; magnetospheric configuration and dynamics

Energetically resolved multiple-fluid equilibria of tokamak plasmas

International Nuclear Information System (INIS)

Hole, M J; Dennis, G

2009-01-01

In many magnetically confined fusion experiments, a significant fraction of the stored energy of the plasma resides in energetic, or non-thermal, particle populations. Despite this, most equilibrium treatments are based on MHD: a single fluid treatment which assumes a Maxwell-Boltzmann distribution function. Detailed magnetic reconstruction based on this treatment ignore the energetic complexity of the plasma and can result in model-data inconsistencies, such as thermal pressure profiles which are inconsistent with the total stored kinetic energy of the plasma. Alternatively, ad hoc corrections to the pressure profile, such as summing the energetic and thermal pressures, have poor theoretical justification. Motivated by this omission, we generalize ideal MHD one step further: we consider multiple quasi-neutral fluids, each in thermal equilibrium and each thermally insulated from each other-no population mixing occurs. Kinetically, such a model may be able to describe the ion or electron distribution function in regions of velocity phase space with a large number of particles, at the expense of more weakly populated phase space, which may have uncharacteristically high temperature and hence pressure. As magnetic equilibrium effects increase with the increase in pressure, our work constitutes an upper limit to the effect of energetic particles. When implemented into an existing solver, FLOW (Guazzotto et al 2004 Phys. Plasmas 11, 604-14), it becomes possible to qualitatively explore the impact of resolving the energetic populations on plasma equilibrium configurations in realistic geometry. Deploying the modified code, FLOW-M, on a high performance spherical torus configuration, we find that the effect of variations of the pressure, poloidal flow and toroidal flow of the energetic populations is qualitatively similar to variations in the background plasma. We also study the robustness of the equilibrium to uncertainties in the current profile and the energetic

Magnetic and Crystal Structure of α-RuCl3

Science.gov (United States)

Sears, Jennifer

The layered honeycomb material α-RuCl3 has been proposed as a candidate material to show significant bond-dependent Kitaev type interactions. This has prompted several recent studies of magnetism in this material that have found evidence for multiple magnetic transitions in the temperature range of 8-14 K. We will present elastic neutron scattering measurements collected using a co-aligned array of α-RuCl3 crystals, identifying zigzag magnetic order within the honeycomb planes with an ordering temperature of ~8 K. It has been reported that the ordering temperature depends on the c axis periodicity of the layered structure, with ordering temperatures of 8 and 14 K for three and two-layer periodicity respectively. While the in-plane magnetic order has been identified, it is clear that a complete understanding of magnetic ordering and interactions will depend on the three dimensional structure of the crystal. Evidence of a structural transition at ~150 K has been reported and questions remain about the structural details, in particular the stacking of the honeycomb layers. We will present x-ray diffraction measurements investigating the low and high temperature structures and stacking disorder in α-RuCl3. Finally, we will present inelastic neutron scattering measurements of magnetic excitations in this material. Work done in collaboration with K. W. Plumb (Johns Hopkins University), J. P. Clancy, Young-June Kim (University of Toronto), J. Britten (McMaster University), Yu-Sheng Chen (Argonne National Laboratory), Y. Qiu, Y. Zhao, D. Parshall, and J. W. Lynn (NCNR).

Seperation of CsCl from LiCl-CsCl molten salt by cold finger melt cryst allization

Energy Technology Data Exchange (ETDEWEB)

Versey, Joshua R. [Dept. of Chemical and Materials Engineering and Nuclear Engineering Program University of Idaho, Idaho (United States); Phongikaroon, Supathorn [Dept. of Mechanical and Nuclear Engineering Virginia Commonwealth University, Richmond (Korea, Republic of); Simpson, Michael F. [Dept. of Metallurgical Engineering University of Utah, Utah (Korea, Republic of)

2014-06-15

This study provides a fundamental understanding of a cold finger melt crystallization technique by exploring the heat and mass transfer processes of cold finger separation. A series of experiments were performed using a simplified LiCl-CsCl system by varying initial CsCl concentrations (1, 3, 5, and 7.5 wt%), cold finger cooling rates (7.4, 9.8, 12.3, and 14.9 L/min), and separation times (5, 10, 15, and 30 min). Results showed a potential recycling rate of 0.36 g/min with a purity of 0.33 wt% CsCl in LiCl. A CsCl concentrated drip formation was found to decrease crystal purity especially for smaller crystal formations. Dimensionless heat and mass transfer correlations showed that separation production is primarily influenced by convective transfer controlled by cooling gas flow rate, where correlations are more accurate for slower cooling gas flow rates.

Amorphous chalcogenide semiconductors for solid state dosimetric systems of high-energetic ionizing radiation

Energy Technology Data Exchange (ETDEWEB)

Shpotyuk, O. [Pedagogical University, Czestochowa (Poland)]|[Institute of Materials, Lvov (Ukraine)

1997-12-31

The application possibilities of amorphous chalcogenide semiconductors use as radiation-sensitive elements of high-energetic (E > 1 MeV) dosimetric systems are analysed. It is shown that investigated materials are characterized by more wide region of registered absorbed doses and low temperature threshold of radiation information bleaching in comparison with well-known analogies based on coloring oxide glasses. (author). 16 refs, 1 tab.

Rate constants for the reactions of OH with CH3Cl, CH2Cl2, CHCl3, and CH3Br

Science.gov (United States)

Hsu, K.-J.; Demore, W. B.

1994-01-01

Rate constants for the reactions of OH with CH3Cl, CH2Cl2, CHCl3, and CH3Br have been measured by a relative rate technique in which the reaction rate of each compound was compared to that of HFC-152a (CH3CHF2) and (for CH2Cl2) HFC-161 (CH3CH2F). Using absolute rate constants for HFC-152a and HFC-161, which we have determined relative to those for CH4, CH3CCl3, and C2H6, temperature dependent rate constants of both compounds were derived. The derived rate constant for CH3Br is in good agreement with recent absolute measurements. However, for the chloromethanes all the rate constants are lower at atmospheric temperatures than previously reported, especially for CH2Cl2 where the present rate constant is about a factor of 1.6 below the JPL 92-20 value. The new rate constant appears to resolve a discrepancy between the observed atmospheric concentrations and those calculated from the previous rate constant and estimated release rates.

Distribution of {sup 36}Cl/Cl in a river-recharged aquifer: Implications for the fallout rate of bomb-produced {sup 36}Cl

Energy Technology Data Exchange (ETDEWEB)

Tosaki, Yuki, E-mail: tosaki@tac.tsukuba.ac.j [Sustainable Environmental Studies, Graduate School of Life and Environmental Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8572 (Japan); Massmann, Gudrun [Institute of Geological Sciences, Department of Earth Sciences, Freie Universitaet Berlin, Malteserstrasse 74-100, 12249 Berlin (Germany); Tase, Norio [Sustainable Environmental Studies, Graduate School of Life and Environmental Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8572 (Japan); Sasa, Kimikazu; Takahashi, Tsutomu [Tandem Accelerator Complex, Research Facility Center for Science and Technology, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8577 (Japan); Matsushi, Yuki [Department of Nuclear Engineering and Management, School of Engineering, University of Tokyo, 2-11-16 Yayoi, Bunkyo-ku, Tokyo 113-0032 (Japan); Tamari, Michiko [Department of Chemistry, Graduate School of Pure and Applied Sciences, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8571 (Japan); Nagashima, Yasuo [Tandem Accelerator Complex, Research Facility Center for Science and Technology, University of Tsukuba, 1-1-1 Tennodai, Tsukuba, Ibaraki 305-8577 (Japan); Bessho, Kotaro; Matsumura, Hiroshi [Radiation Science Center, High Energy Accelerator Research Organization (KEK), 1-1 Oho, Tsukuba, Ibaraki 305-0801 (Japan)

2010-04-15

Distribution of {sup 36}Cl/Cl ratios in a river-recharged aquifer was investigated in the Oderbruch area, northeastern Germany. The aquifer is confined up to 3.5-4 km inland, where it changes to an unconfined condition. The {sup 36}Cl/Cl ratios in the confined area were in the range between 4.6 x 10{sup -14} and 23.1 x 10{sup -14}, showing a peak at 2-3 km away from the river. A plot of {sup 36}Cl/Cl vs. reciprocal Cl{sup -} concentrations indicated possible effect of the Cl{sup -} concentration variation on the observed {sup 36}Cl/Cl ratios. After accounting for this effect, the estimated {sup 36}Cl fallout rates for the last 30 yrs show reasonable agreement with the Dye-3 data and the mid-latitude background value. The results suggest that a local {sup 36}Cl fallout curve can be constructed from groundwater when dispersive mixing is of minor importance.

Evaluación de la calidad de registro de historias clínicas en consultorios externos del servicio de medicina interna de la Clínica Centenario Peruano Japonesa, 2010-2011

Directory of Open Access Journals (Sweden)

Juan P. Matzumura Kasano

2014-07-01

Full Text Available El eje de la auditoria médica es una historia clínica adecuadamente confeccionada. La historia clínica es la constancia escrita de todos los exámenes médicos, estudios realizados y tratamientos aplicados durante el transcurso de la enfermedad. Objetivo: Evaluar la calidad de registro de las historias clínicas de Consultorios Externos del Servicio de Medicina Interna en la Clínica Centenario Peruano Japonesa. Diseño: Descriptivo de corte transversal. Lugar: Consultorios externos del Servicio de Medicina Interna de la Clínica Centenario Peruano Japonesa. Material: Historias clínicas de pacientes atendidos en la consulta externa del Servicio de Medicina Interna. Métodos: Se evaluó 323 historias clínicas mediante un muestreo aleatorio simple, las cuales fueron sometidas a una ficha de auditoría que comprendía 10 ítems, cada uno calificado con 10 puntos, para un total de 100 puntos: fecha y hora de atención, pulcritud y legibilidad, anamnesis adecuada, signos vitales, examen físico, diagnóstico, plan de trabajo, exámenes auxiliares, tratamiento completo y firma y sello del médico. Las historias que obtenían un puntaje total mayor o igual de 80 fueron calificadas como ‘aceptables’; las restantes como ‘falta mejorar’. Principales medidas de resultados: Historias auditadas aceptables o falta mejorar. Resultados: El 63,8% (206 de las historias tenía una calidad de registro ‘aceptable’, mientras que en 36,2% (117 de historias, la calidad de registro ‘falta mejorar’. Los ítems diagnóstico y tratamiento completo fueron los que presentaron un registro deficiente con mayor frecuencia, tanto en aquellas historias que cumplían un registro aceptable (64,6% y 62,6% llenadas de modo completo, respectivamente como en aquellas con registro falta mejorar (20,5% y 23,1%, respectivamente. La firma y sello del médico tratante fue el ítem que en ambas categorías era el mejor registrado (99,5% y 93,2%, respectivamente

Studies on compatibility of energetic materials by thermal methods

Directory of Open Access Journals (Sweden)

Maria Alice Carvalho Mazzeu

2010-04-01

Full Text Available The chemical compatibility of explosives, pyrotechnics and propellants with those materials is studied to evaluate potential hazards when in contact with other materials during production, storage and handling. Compatibility can be studied by several thermal methods as DSC (differential scanning calorimetry, TG (Thermogravimetry, VST (Vacuum stability test and others. The test methods and well defined criteria are the most important elements when a compatibility study is being accomplished. In this paper, the compatibility of two very important high explosives used in ammunition, RDX (Cyclo-1,3,5-trimethylene-2,4,6-trinitramine and HMX (Cyclotetramethylene tetranitramine was studied with the materials: fluoroelastomer (Viton and powdered aluminum (Al, using DSC and VST methods. The criteria to judge the compatibility between materials is based on a standardization agreement (STANAG 4147, 2001, and the final conclusion is that explosives and this materials are compatible, but in DSC it was observed that the peak of decomposition temperature of the admixture of RDX with Al decreased in 3º C and another peak appeared after the decomposition peak.

Energetic use of the urban solid wastes (waste-to-energy); Aproveitamento energetico de residuos solidos urbanos (waste-to-energy)

Energy Technology Data Exchange (ETDEWEB)

Dodde, Paula Arrais Moreira; Fonseca, Zilton Jose Sa da [Universidade Federal do Rio de Janeiro (PPE/COPPE/UFRJ), RJ (Brazil). Coordenacao dos Programas de Pos-Graduacao de Engenharia. Programa de Planejamento Energetico], Emails: pauladodde@yahoo.com.br, ziltonfonseca@ig.com.br

2010-07-01

This paper approaches the advantages and disadvantages of energetic using of biomass present in the garbage (the urban solid residue is composed by average 65% of organic material)This paper effluents technologically.

Energetic policies 2005-2030

International Nuclear Information System (INIS)

2008-01-01

This power point exhibition shows the following topics: energy analysis, production and use, supply and demand, consumption, energy sources, energetic prospective of Uruguay country, medium and long term perspectives.

Advances in magnetospheric physics, 1971--1974: energetic particles

International Nuclear Information System (INIS)

West, H.I. Jr.

1974-12-01

An account is given of energetic particle research in magnetospheric physics for the time period 1971--1974. Emphasis is on relating the various aspects of energetic particles to magnetospheric processes. 458 refs. (U.S.)

Range and energetics of charge hopping in organic semiconductors

Science.gov (United States)

Abdalla, Hassan; Zuo, Guangzheng; Kemerink, Martijn

2017-12-01

The recent upswing in attention for the thermoelectric properties of organic semiconductors (OSCs) adds urgency to the need for a quantitative description of the range and energetics of hopping transport in organic semiconductors under relevant circumstances, i.e., around room temperature (RT). In particular, the degree to which hops beyond the nearest neighbor must be accounted for at RT is still largely unknown. Here, measurements of charge and energy transport in doped OSCs are combined with analytical modeling to reach the univocal conclusion that variable-range hopping is the proper description in a large class of disordered OSC at RT. To obtain quantitative agreement with experiment, one needs to account for the modification of the density of states by ionized dopants. These Coulomb interactions give rise to a deep tail of trap states that is independent of the material's initial energetic disorder. Insertion of this effect into a classical Mott-type variable-range hopping model allows one to give a quantitative description of temperature-dependent conductivity and thermopower measurements on a wide range of disordered OSCs. In particular, the model explains the commonly observed quasiuniversal power-law relation between the Seebeck coefficient and the conductivity.

Simple preparations of Pd6Cl12, Pt6Cl12, and Qn[Pt2Cl8+n], n=1, 2 (Q=TBA+, PPN+) and structural characterization of [TBA][Pt2Cl9] and [PPN]2[Pt2Cl10].C7H8.

Science.gov (United States)

Dell'Amico, Daniela Belli; Calderazzo, Fausto; Marchetti, Fabio; Ramello, Stefano; Samaritani, Simona

2008-02-04

The hexanuclear Pd6Cl12, i.e., the crystal phase classified as beta-PdCl2, was obtained by reacting [TBA]2[Pd2Cl6] with AlCl3 (or FeCl3) in CH2Cl2. The action of AlCl3 on PtCl42-, followed by digestion of the resulting solid in 1,2-C2H4Cl2 (DCE), CHCl3, or benzene, produced Pt6Cl12.DCE, Pt6Cl12.CHCl3, or Pt6Cl12.C6H6, respectively. Treating [TBA]2[PtCl6] with a slight excess of AlCl3 afforded [TBA][Pt2Cl9], whose anion was established crystallographically to be constituted by two "PtCl6" octahedra sharing a face. Dehydration of H2PtCl6.nH2O with SOCl2 gave an amorphous compound closely analyzing as PtCl4, reactive with [Q]Cl in SOCl2 to yield [Q][Pt2Cl9] or [Q]2[Pt2Cl10], depending on the [Q]Cl/Pt molar ratio (Q=TBA+, PPN+). A single-crystal X-ray diffraction study has shown [PPN]2[Pt2Cl10].C7H8 to contain dinuclear anions formed by two edge-sharing PtCl6 octahedra.

Studies of the effects of TiCl3 in LiBH4/CaH2/TiCl3 reversible hydrogen storage system

International Nuclear Information System (INIS)

Liu Dongan; Yang Jun; Ni Jun; Drews, Andy

2012-01-01

nano-composite a fully reversible hydrogen storage material. These four states of LiCl in LiBH 4 /CaH 2 /TiCl 3 system, i.e. “formed-solid solution-molten solution-precipitation”, are reported for the first time and the detailed study of this system is beneficial to further improve hydrogen storage property of complex hydrides.

In Vitro Effect of Lysozyme on Albumin Deposition to Hydrogel Contact Lens Materials.

Science.gov (United States)

Babaei Omali, Negar; Subbaraman, Lakshman N; Heynen, Miriam; Fadli, Zohra; Coles-Brennan, Chantal; Jones, Lyndon W

2017-11-01

Albumin deposition on contact lenses could be detrimental to contact lens (CL) wear because this may increase the risk of bacterial binding and reduce comfort. Lysozyme deposition on selected lens materials would reduce albumin deposition on lenses. This study aims to determine if lysozyme deposition on CLs could act as a barrier against subsequent albumin adsorption, using an in vitro model. Six hydrogel CL materials (etafilcon A, polymacon, nelfilcon A, omafilcon A, ocufilcon B, and nesofilcon A) were evaluated. Four CLs of each type were soaked in lysozyme solution for 16 hours at 37°C. Lysozyme-coated lenses were then placed in vials with 1.5 mL of artificial tear solution containing I-labeled albumin for 16 hours at 37°C with shaking. Four uncoated lenses of each type were used as controls. Lenses soaked in radiolabeled albumin were rinsed in a phosphate-buffered saline solution, and radioactive counts were measured directly on lenses using a gamma counter. Albumin uptake on lenses was measured using a calibration curve by plotting radioactive counts versus protein concentration. Results are reported as mean ± SD. Lysozyme-coated etafilcon A lenses exhibited lower levels of deposited albumin than uncoated etafilcon A lenses (58 ± 12 vs. 84 ± 5 ng/lens; P albumin adsorption between control (uncoated) and lysozyme-coated polymacon (105 ± 10 vs. 110 ± 34 ng/lens), nelfilcon A (51 ± 7 vs. 42 ± 20 ng/lens), omafilcon A (90 ± 20 vs. 80 ± 38 ng/lens), ocufilcon B (87 ± 20 vs. 115 ± 50 ng/lens), and nesofilcon A (170 ± 29 vs. 161 ± 10 ng/lens) lens materials (P > .05). Uncoated nesofilcon A lenses deposited the highest amount of albumin when compared with other uncoated lenses (P albumin, which may potentially be beneficial to CL wearers.

Adesão de profissionais de enfermagem ao seguimento clínico após exposição ocupacional com material biológico

Directory of Open Access Journals (Sweden)

Lívia Agy Loureiro

2009-06-01

Full Text Available O objetivo deste estudo foi avaliar a adesão dos profissionais de enfermagem ao seguimento clínico, após aexposição ocupacional a material biológico, no ambulatório especializado (AOPS. Os dados se referem aacidentes ocorridos com profissionais de enfermagem no período julho a dezembro de 2006 e foram obtidos pormeio de consulta ao prontuário. O estudo foi desenvolvido nas duas unidades (campus e emergência de umhospital universitário de grande porte na cidade de Ribeirão Preto. Observou-se que em 30,4% foi indicado ouso de anti-retrovirais para quimioprofilaxia; dos que fizeram o uso, 31,3% apresentaram efeitos adversos.Destaca-se que 69,6% dos profissionais completaram o seguimento clínico indicado. É premente a necessidadede implementação de um programa de educação permanente junto aos trabalhadores de saúde para prevençãode exposições ocupacionais e adesão ao seguimento clínico após exposição.

Preparation of Ferrotitanium Alloys by Electrolysis-Assisted Calciothermic Reduction of Ilmenite in Equimolar CaCl2-NaCl Electrolyte: Effect of Calcium Oxide

Science.gov (United States)

Zhou, Zhongren; Zhang, Yingjie; Hua, Yixin; Xu, Cunying; Dong, Peng; Zhang, Qibo; Wang, Ding

2018-04-01

The effect of CaO content on the preparation of ferrotitanium alloys from ilmenite with the method of the electrolysis-assisted calciothermic reduction has been investigated by use of ilmenite powders as raw materials that positions them next to the cathodic molybdenum plate, equimolar CaCl2-NaCl molten salt with 2-7 mol.% CaO as electrolyte and graphite as anode at 700°C with cell voltage of 2.8 V under argon atmosphere. It is demonstrated that increasing the reactant CaO content is beneficial to the calciothermic reduction of ilmenite and the intermediate CaTiO3. Experimental results also show that after 14 h of calciothermic reduction process, the products are ferrotitanium alloys and the specific energy consumption is only about 10.21 kWh kg-1 when adding 5 mol.% CaO into equimolar CaCl2-NaCl molten salt and approximately 14.40 kWh kg-1 when CaO content is increased to 7 mol.%.

Thermal Energetic Reactor with High Reproduction of Fission Materials

International Nuclear Information System (INIS)

Kotov, V.M.

2012-01-01

Existing thermal reactors are energy production scale limited because of low portion of raw uranium usage. Fast reactors are limited by reprocessing need of huge mass of raw uranium at the initial stage of development. The possibility of development of thermal reactors with high fission materials reproduction, which solves the problem, is discussed here. Neutron losses are decreased, uranium-thorium fuel with artificial fission materials equilibrium regime is used, additional in-core and out-core neutron sources are used for supplying of high fission materials reproduction. Liquid salt reactors can use dynamic loading regime for this purpose. Preferable construction is channel type reactor with heavy water moderator. Good materials for fuel element shells and channel walls are zirconium alloys enriched by 90Zr. Water cooled reactors with usage 12% of raw uranium and liquid metal cooled reactors with usage 25% of raw uranium are discussed. Reactors with additional neutron sources obtain full usage of raw uranium with small additional energy expenses. On the base of thermal reactors with high fission materials reproduction world atomic power engineering development supplying higher power and requiring smaller speed of raw uranium mining, than in the variant with fast reactors, is possible.

Energetic and financial evaluation of solar assisted heat pump space heating systems

International Nuclear Information System (INIS)

Bellos, Evangelos; Tzivanidis, Christos; Moschos, Konstantinos; Antonopoulos, Kimon A.

2016-01-01

Highlights: • Four solar heating systems are presented in this work. • Various combinations between solar collectors and heat pumps are presented. • The systems are compared energetically and financially. • The use of PV and an air source heat pump is the best choice financially. • The use of PVT with a water source heat pump is the best solution energetically. - Abstract: Using solar energy for space heating purposes consists an alternative way for substituting fossil fuel and grid electricity consumption. In this study, four solar assisted heat pump heating systems are designed, simulated and evaluated energetically and financially in order to determine the most attractive solution. The use of PV collectors with air source heat pump is compared to the use of FPC, PVT and FPC with PV coupled with a water source heat pump. A sensitivity analysis for the electricity cost is conducted because of the great variety of this parameter over the last years. The final results proved that for electricity cost up to 0.23 €/kW h the use of PV coupled with an air source heat pump is the most sustainable solution financially, while for higher electricity prices the coupling of PVT with an water source heat pump is the best choice. For the present electricity price of 0.2 €/kW h, 20 m"2 of PV is able to drive the air source heat pump with a yearly solar coverage of 67% leading to the most sustainable solution. Taking into account energetic aspects, the use of PVT leads to extremely low grid electricity consumption, fact that makes this technology the most environmental friendly.

Energetic matrix of Rio de Janeiro State, Brazil - 1994/2004

International Nuclear Information System (INIS)

1996-01-01

This book has been structured into three parts and three appendices. In the first part, named Energetic matrix of Rio de Janeiro State, the most important economic and social aspects of the State and the methodology for elaboration of economic and energetic scenarios has been detailed. In the second part, an analysis of seven consumption sectors components of the energetic matrix structure ( industrial, transports, residential, commercial, energetic, agriculture and cattle-breeding, non energetic) has been performed, with the objective of providing information on the present status and future prospects of energy consumption by sectors up to 2004. Finally, in the third part, the energy supply of Rio de Janeiro State for the consumption sectors has been discussed

Properties of the LiCl-KCl-Li2O system as operating medium for pyro-chemical reprocessing of spent nuclear fuel

Science.gov (United States)

Mullabaev, Albert; Tkacheva, Olga; Shishkin, Vladimir; Kovrov, Vadim; Zaikov, Yuriy; Sukhanov, Leonid; Mochalov, Yuriy

2018-03-01

Crystallization temperatures (liquidus and solidus) in the LiCl-Li2O and (LiCl-KCl)-Li2O systems with the KCl content of 10 and 20 mol.% were obtained with independent methods of thermal analysis using cooling curves, isothermal saturation, and differential scanning calorimetry. The linear sweep voltammetry was applied to control the time of the equilibrium establishment in the molten system after the Li2O addition, which depended on the composition of the base melt and the concentration of Li2O. The fragments of the binary LiCl-Li2O and quazi-binary [LiCl-KCl(10 mol.%)]-Li2O and [LiCl-KCl(20 mol.%)]-Li2O phase diagrams in the Li2O concentration range from 0 to 12 mol.% were obtained. The KCl presence in the LiCl-KCl-Li2O molten mixture in the amount of 10 and 20 mol.% reduces the liquidus temperature by 30 and 80°, respectively, but the region of the homogeneous molten state of the system is considerably narrowed, which complicates its practical application. The Li2O solubility in the molten LiCl, LiCl-KCl(10 mol.%) and LiCl-KCl(20 mol.%) decreases with increasing the KCl content and is equal to 11.5, 7.7 and 3.9 mol.% at 650°С, respectively. The LiCl-KCl melt with 10 mol.% KCl can be recommended for practical use as a medium for the SNF pyro-chemical reprocessing at temperature below 700 °C.

Energetic magnetospheric protons in the plasma depletion layer

International Nuclear Information System (INIS)

Fuselier, S.A.

1992-01-01

Interplanetary magnetic field draping against the Earth's dayside subsolar magnetopause creates a region of reduced plasma density and increased magnetic field called the plasma depletion layer. In this region, leakage of energetic ions from the Earth's magnetosphere onto magnetic field lines in the plasma depletion layer can be studied without interference from ions accelerated at the Earth's quasi-parallel bow shock. Active Magnetospheric Particle Tracer Experiment/Charge Composition Explorer (AMPTE/CCE) observations for 13 plasma depletion layer events are used to determine the characteristics of energetic protons between a few keV/e and ∼100keV/e leaked from the magnetosphere. Results indicate that the leaked proton distributions resemble those in the magnetosphere except that they have lower densities and temperatures and much higher velocities parallel (or antiparallel) and perpendicular to the magnetic field. Compared to the low-energy magnetosheath proton distributions present in the depletion layer, the leaked energetic proton distributions typically have substantially higher flow velocities along the magnetic field indicate that the leaked energetic proton distributions to contribute to the energetic proton population seen upstream and downstream from the quasi-parallel bow shock. However, their contribution is small compared to the contribution from acceleration of protons at the bow shock because the leaked proton densities are on the order of 10 times smaller than the energetic proton densities typically observed in the vicinity of the quasi-parallel bow shock

A new silver based composite material for SPA water disinfection.

Science.gov (United States)

Tartanson, M A; Soussan, L; Rivallin, M; Chis, C; Penaranda, D; Lapergue, R; Calmels, P; Faur, C

2014-10-15

A new composite material based on alumina (Al2O3) modified by two surface nanocoatings - titanium dioxide (TiO2) and silver (Ag) - was studied for spa water disinfection. Regarding the most common microorganisms in bathing waters, two non-pathogenic bacteria Escherichia coli (Gram-negative) and Staphylococcus epidermidis (Gram positive) were selected as surrogates for bacterial contamination. The bactericidal properties of the Al2O3-TiO2-Ag material were demonstrated under various operating conditions encountered in spa water (temperature: 22-37 °C, presence of salt: CaCO3 or CaCl2, high oxygen content, etc.). Total removal of 10(8) CFU mL(-1) of bacteria was obtained in less than 10 min with 16 g L(-1) of material. Best results were observed for both conditions: a temperature of 37 °C and under aerobic condition; this latest favouring Reactive Oxygen Species (ROS) generation. The CaCO3 salt had no impact on the bactericidal activity of the composite material and CaCl2 considerably stabilized the silver desorption from the material surface thanks to the formation of AgCl precipitate. Preliminary tests of the Al2O3-TiO2-Ag bactericidal behaviour in a continuous water flow confirmed that 2 g L(-1) of material eliminated more than 90% of a 2.0 × 10(8) CFU mL(-1) bacterial mixture after one water treatment recycle and reached the disinfection standard recommended by EPA (coliform removal = 6 log) within 22 h. Copyright © 2014 Elsevier Ltd. All rights reserved.

ECO2N V. 2.0: A New TOUGH2 Fluid Property Module for Mixtures of Water, NaCl, and CO₂

Energy Technology Data Exchange (ETDEWEB)

Pan, L. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Spycher, N. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Doughty, C. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States); Pruess, K. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

2014-12-01

ECO2N V2.0 is a fluid property module for the TOUGH2 simulator (Version 2.1) that was designed for applications to geologic sequestration of CO₂ in saline aquifers and enhanced geothermal reservoirs. ECO2N V2.0 is an enhanced version of the previous ECO2N V1.0 module (Pruess, 2005). It expands the temperature range up to about 300°C whereas V1.0 can only be used for temperatures below about 110°C. V2.0 includes a comprehensive description of the thermodynamics and thermophysical properties of H₂O - NaCl -CO₂ mixtures, that reproduces fluid properties largely within experimental error for the temperature, pressure and salinity conditions of interest (10 °C < T < 300 °C; P < 600 bar; salinity up to halite saturation). This includes density, viscosity, and specific enthalpy of fluid phases as functions of temperature, pressure, and composition, as well as partitioning of mass components H₂O, NaCl and CO₂ among the different phases. In particular, V2.0 accounts for the effects of water on the thermophysical properties of the CO₂-rich phase, which was ignored in V1.0, using a model consistent with the solubility models developed by Spycher and Pruess (2005, 2010). In terms of solubility models, V2.0 uses the same model for partitioning of mass components among the different phases (Spycher and Pruess, 2005) as V1.0 for the low temperature range (<99°C) but uses a new model (Spycher and Pruess, 2010) for the high temperature range (>109°C). In the transition range (99-109°C), a smooth interpolation is applied to estimate the partitioning as a function of the temperature. Flow processes can be modeled isothermally or non-isothermally, and phase conditions represented may include a single (aqueous or CO₂-rich) phase, as well as two-phase mixtures. Fluid phases may appear or disappear in the course of a simulation, and solid salt may precipitate or dissolve. This report gives technical

Sociosynergistic Management of the Companies. Economic, Energetic and Ecologic Challenge

Directory of Open Access Journals (Sweden)

Dušan Turan

2008-06-01

Full Text Available Sociosynergistic management is inevitable condition of nanotechnology tendency of value-creating process of the companies in incoming third level of social division of labor. This management is being a product of transdisciplinary nanocognition and nano-projection of the systems there through creates for the management the operation base for system solution of economic effectiveness, energetic friendliness and ecologic safety of material-technological processes of the companies. He uncovers the sociosynergetics as a system entirety in the limits of abstract thinking, notion-categorical communication and knowingly-practical acting of the subject.

Application of PXAMS technique for 36Cl analysis in soil collected at Semipalatinsk Nuclear Test Site

International Nuclear Information System (INIS)

Tolmachyov, S.; Maeda, Y.; Mitarai, S.; Nakashima, T.; Momoshima, N.; Yamamoto, M.

2001-01-01

36 Cl in soil samples from the Semipalatinsk Nuclear Test Site (former USSR) was measured at Kyushu University Tandem Laboratory (KUTL) by accelerator mass spectrometry (AMS) coupled with projectile X-ray detection (PXD) technique. The separation of competing 36 S and 3 6Cl atomic isobars, was satisfactory by PXD technique. Measured 36 Cl/Cl atom ratio was (5.0 ± 0.6) x 10 -10 and an average activity of 36 Cl was calculated as (2.0 ± 0.2) mBq/g, which is in a good agreement with that obtained by liquid scintillation counting (LSC) method previously. Currently developed AMS system at the Kyushu University can be applied for routine 36 Cl analysis at 36 Cl/Cl = 10 -11 atom ratio level. (author)

Energetic electron injections and dipolarization events in Mercury's magnetotail: Substorm dynamics

Science.gov (United States)

Dewey, R. M.; Slavin, J. A.; Raines, J. M.; Imber, S.; Baker, D. N.; Lawrence, D. J.

2017-12-01

Despite its small size, Mercury's terrestrial-like magnetosphere experiences brief, yet intense, substorm intervals characterized by features similar to at Earth: loading/unloading of the tail lobes with open magnetic flux, dipolarization of the magnetic field at the inner edge of the plasma sheet, and, the focus of this presentation, energetic electron injection. We use the Gamma-Ray Spectrometer's high-time resolution (10 ms) energetic electron measurements to determine the relationship between substorm activity and energetic electron injections coincident with dipolarization fronts in the magnetotail. These dipolarizations were detected on the basis of their rapid ( 2 s) increase in the northward component of the tail magnetic field (ΔBz 30 nT), which typically persists for 10 s. We estimate the typical flow channel to be 0.15 RM, planetary convection speed of 750 km/s, cross-tail potential drop of 7 kV, and flux transport of 0.08 MWb for each dipolarization event, suggesting multiple simultaneous and sequential dipolarizations are required to unload the >1 MWb of magnetic flux typically returned to the dayside magnetosphere during a substorm interval. Indeed, while we observe most dipolarization-injections to be isolated or in small chains of events (i.e., 1-3 events), intervals of sawtooth-like injections with >20 sequential events are also present. The typical separation between dipolarization-injection events is 10 s. Magnetotail dipolarization, in addition to being a powerful source of electron acceleration, also plays a significant role in the substorm process at Mercury.

Evidence for a Field-induced Quantum Spin Liquid in $\\alpha$-RuCl$_3$

OpenAIRE

Baek, S. -H.; Do, S. -H.; Choi, K. -Y.; Kwon, Y. S.; Wolter, A. U. B.; Nishimoto, S.; Brink, Jeroen van den; Büchner, B.

2017-01-01

We report a $^{35}$Cl nuclear magnetic resonance study in the honeycomb lattice, $\\alpha$-RuCl$_3$, a material that has been suggested to potentially realize a Kitaev quantum spin liquid (QSL) ground state. Our results provide direct evidence that $\\alpha$-RuCl$_3$ exhibits a magnetic field-induced QSL. For fields larger than $\\sim 10$ T a spin-gap opens up while resonance lines remain sharp, evidencing that spins are quantum disordered and locally fluctuating. The spin gap increases linearly...

Preparation and Gas Adsorption of Porous Materials from Molecular Precursors

DEFF Research Database (Denmark)

Hu, Xinming

with bimodal porosity are produced via cyclotrimerization of two aromatic tetranitriles and in situ carbonization in molten ZnCl2. The carbonization occurs by decomposition of triazine rings, which results in complete loss of nitrogen and formation of substantial mesopores. The resulting materials possess...... surface areas above 1200 m2 g−1 and exhibit exceptionally high H2 uptake (up to 2.34 wt% at 77 K and 1 bar) but low CO2 uptake capacity. In Chapter 4, a nitrogen-rich porous carbon is prepared via cyclotrimerization of a perfluorinated aromatic nitrile and in situ carbonization in molten ZnCl2......), and H2 (2.0 wt%, 77 K and 1.0 bar). Chapters 5, 6, and 7 deal with the construction of triazatriangulenium (TATA)-based ionic porous frameworks. A variety of polycondensation reactions have been applied, but only FeCl3-promoted oxidative polymerization of thiophene-/carbazolefunctionalized TATAs...

EFECTO DE NaCl Y CaCl2 EN EL DESARROLLO DE EJES EMBRIONARIOS DE Persea americana Mill CRIOLLO y 'HASS' CULTIVADOS in vitro

Directory of Open Access Journals (Sweden)

Leobarda Guadalupe Ramírez-Guerrero

2010-01-01

Full Text Available El objetivo de este estudio fue identificar materiales de aguacate tolerantes a salinidad, útiles como portainjertos. Se sembraron in vitro ejes embrionarios de aguacate criollo y 'Hass' en medio Murashige y Skoog al 100 % de su composición nutrimental en condiciones salinas inducidas con NaCl y CaCl2. Se emplearon cinco niveles de cada sal (0.1, 0.3, 0.5, 0.7, 0.9 %, así como la combinación de éstas en proporción 1,1. Se estudió germinación, emergencia, enraizamiento y supervivencia de brotes de aguacate. El criollo superó al 'Hass' con el 21 % de germinación, 36 % de emergencia, con aproximadamente el 50 % en cada una de las variables de crecimiento y el 10 % de supervivencia de plántulas. El desarrollo de los ejes embrionarios fue más limitado en los tratamientos con NaCl en comparación a los establecidos en CaCl2 y NaCl,CaCl2. Con la técnica in vitro se determinó a los 65 días de cultivo que el material criollo fue más tolerante al estrés salino con respecto al 'Hass'.