Analysis of the consequences of 'thermite' reaction

International Nuclear Information System (INIS)

Yorio, Daniel; Cincotta, Daniel O.; Camacho, Esteban F.; Bruno, Hernan R.; Boero, Norma L.

1999-01-01

The mixture of Al-U 3 O 8 is not in a state of chemical equilibrium, and at temperatures of between 850 degree C and 1000 degree C, it reacts exo thermally. This is known, in corresponding bibliography, as a 'Thermite reaction'. This mixture is used in the manufacturing of the plate-type fuel used in research reactors. It has been pointed out that the release of energy caused by this type of reactions might represent a risk in case of accidents in this type of reactor. Conclusions, in general, tend to indicate that no such risk exists, although no concrete assurance is given that this is the case, and this fact, therefore, leaves room for doubt. The objective of this paper is to provide an in-depth study of what happens to a fuel plate when it is subjected to thermite reaction. We will, furthermore, analyze the consequences of the release of energy generated by this type of reaction within the core of the reactor, clearly defining the problem for this type of fuel and this kind of reactor

Thermodynamic evaluation of highly exothermic reactions for the fabrication of ceramic metal composites

International Nuclear Information System (INIS)

Rodrigues, J.A.; Pandolfelli, V.C.; Botta Filho, W.J.; Tomasi, R.; Stevens, R.; Brook, R.J.

1990-01-01

Highly exothermic reactions allow the synthesis or production of materials. Which present advantages regarding to energy saving, simplicity of process and higher purity of the products. Considering adiabatic conditions these reactions give off a large amount of heat which will raise the temperature of the system, allowing the production of highly refractory materials. This paper presents a thermodynamic forecast of reactants are Nb2O5, Al e Zr. The objective is to produce high toughness alumina matrix composites containing ZrO2 particles and Nb metal. (author)

Exothermic dark matter

International Nuclear Information System (INIS)

Graham, Peter W.; Saraswat, Prashant; Harnik, Roni; Rajendran, Surjeet

2010-01-01

We propose a novel mechanism for dark matter to explain the observed annual modulation signal at DAMA/LIBRA which avoids existing constraints from every other dark matter direct detection experiment including CRESST, CDMS, and XENON10. The dark matter consists of at least two light states with mass ∼few GeV and splittings ∼5 keV. It is natural for the heavier states to be cosmologically long-lived and to make up an O(1) fraction of the dark matter. Direct detection rates are dominated by the exothermic reactions in which an excited dark matter state downscatters off of a nucleus, becoming a lower energy state. In contrast to (endothermic) inelastic dark matter, the most sensitive experiments for exothermic dark matter are those with light nuclei and low threshold energies. Interestingly, this model can also naturally account for the observed low-energy events at CoGeNT. The only significant constraint on the model arises from the DAMA/LIBRA unmodulated spectrum but it can be tested in the near future by a low-threshold analysis of CDMS-Si and possibly other experiments including CRESST, COUPP, and XENON100.

Particle-particle interactions in aluminum reduction of boron oxide

International Nuclear Information System (INIS)

Logan, K.V.; McLemore, W.J.S.; Sparrow, J.T.

1988-01-01

The Georgia Tech Research Institute has been studying the use of thermite reactions for the production of specialized compounds since the mid-1950's. One of the goals of the research at GTRI is to define the reaction mechanism in order to be ble to predict the resultant reaction behaviour and thus prevent hazardous conditions. Thermite processing advantages are discussed in this paper. A typical thermite type of reaction to produce a composite titanium diboride/alumina is shown. The reactions typically use three starting materials for the production of a specific compound. A preliminary experimental mechanistic model of the extremely exothermic oxidation-reduction reaction is being developed

Ventilation equations for improved exothermic process control.

Science.gov (United States)

McKernan, John L; Ellenbecker, Michael J

2007-04-01

Exothermic or heated processes create potentially unsafe work environments for an estimated 5-10 million American workers each year. Excessive heat and process contaminants have the potential to cause acute health effects such as heat stroke, and chronic effects such as manganism in welders. Although millions of workers are exposed to exothermic processes, insufficient attention has been given to continuously improving engineering technologies for these processes to provide effective and efficient control. Currently there is no specific occupational standard established by OSHA regarding exposure to heat from exothermic processes, therefore it is important to investigate techniques that can mitigate known and potential adverse occupational health effects. The current understanding of engineering controls for exothermic processes is primarily based on a book chapter written by W. C. L. Hemeon in 1955. Improvements in heat transfer and meteorological theory necessary to design improved process controls have occurred since this time. The research presented involved a review of the physical properties, heat transfer and meteorological theories governing buoyant air flow created by exothermic processes. These properties and theories were used to identify parameters and develop equations required for the determination of buoyant volumetric flow to assist in improving ventilation controls. Goals of this research were to develop and describe a new (i.e. proposed) flow equation, and compare it to currently accepted ones by Hemeon and the American Conference of Governmental Industrial Hygienists (ACGIH). Numerical assessments were conducted to compare solutions from the proposed equations for plume area, mean velocity and flow to those from the ACGIH and Hemeon. Parameters were varied for the dependent variables and solutions from the proposed, ACGIH, and Hemeon equations for plume area, mean velocity and flow were analyzed using a randomized complete block statistical

Direct detection of exothermic dark matter with light mediator

Energy Technology Data Exchange (ETDEWEB)

Geng, Chao-Qiang [Chongqing University of Posts & Telecommunications,Chongqing, 400065 (China); Department of Physics, National Tsing Hua University,Hsinchu, Taiwan (China); Physics Division, National Center for Theoretical Sciences,Hsinchu, Taiwan (China); Huang, Da; Lee, Chun-Hao [Department of Physics, National Tsing Hua University,Hsinchu, Taiwan (China); Wang, Qing [Department of Physics, Tsinghua University,Beijing, 100084 (China); Collaborative Innovation Center of Quantum Matter,Beijing, 100084 (China)

2016-08-05

We study the dark matter (DM) direct detection for the models with the effects of the isospin-violating couplings, exothermic scatterings, and/or the lightness of the mediator, proposed to relax the tension between the CDMS-Si signals and null experiments. In the light of the new updates of the LUX and CDMSlite data, we find that many of the previous proposals are now ruled out, including the Ge-phobic exothermic DM model and the Xe-phobic DM one with a light mediator. We also examine the exothermic DM models with a light mediator but without the isospin violation, and we are unable to identify any available parameter space that could simultaneously satisfy all the experiments. The only models that can partially relax the inconsistencies are the Xe-phobic exothermic DM models with or without a light mediator. But even in this case, a large portion of the CDMS-Si regions of interest has been constrained by the LUX and SuperCDMS data.

Exothermic reaction induced by high-density current in metals: Possible nuclear origin

Energy Technology Data Exchange (ETDEWEB)

Dufour, J. [Laboratoire des sciences nucleaires, CNAM 2, rue Conte 75141, Cedex 03 Paris (France)]. E-mail: dufourj@cnam.fr; Murat, D.; Dufour, X.; Foos, J. [Laboratoire des sciences nucleaires, CNAM 2, rue Conte 75141, Cedex 03 Paris (France)

2005-07-01

Since 1989, many experimenters worked on low-energy nuclear reactions (LENR). They face both an experimental and a theoretical dilemma: how to design simple and convincing experiments in a complex system and if the phenomenon has a nuclear origin, why do they observe no radiation. A rather simple water mass flow calorimeter was designed to study this phenomenon under different experimental conditions. First results indicate that a high-density current induced an exothermic reaction in a hydrogen processed palladium wire. A working hypothesis is presented to solve the theoretical dilemma. This working hypothesis is based on the possible existence of a still hypothetical proton/electron resonance. We underline that a working hypothesis is not a theory presented to explain the phenomenon; this is just a conceptual scheme to drive the authors to build experiments. (author)

Exothermic reaction induced by high-density current in metals: Possible nuclear origin

International Nuclear Information System (INIS)

Dufour, J.; Murat, D.; Dufour, X.; Foos, J.

2005-01-01

Since 1989, many experimenters worked on low-energy nuclear reactions (LENR). They face both an experimental and a theoretical dilemma: how to design simple and convincing experiments in a complex system and if the phenomenon has a nuclear origin, why do they observe no radiation. A rather simple water mass flow calorimeter was designed to study this phenomenon under different experimental conditions. First results indicate that a high-density current induced an exothermic reaction in a hydrogen processed palladium wire. A working hypothesis is presented to solve the theoretical dilemma. This working hypothesis is based on the possible existence of a still hypothetical proton/electron resonance. We underline that a working hypothesis is not a theory presented to explain the phenomenon; this is just a conceptual scheme to drive the authors to build experiments. (author)

Analysis of a thermite experiment to study low pressure corium dispersion

International Nuclear Information System (INIS)

Wilhelm, D.

2001-08-01

The report describes the recalculation of a thermite experiment in a reduced scale which simulates the discharge of molten core materials out of the pressure vessel of a light water reactor into the open compartments and the dome of the containment. The experiment was performed in the framework of a multinational effort at the Sandia National Laboratory, U.S.A. It is being followed by the DISCO program at the Forschungszentrum Karlsruhe. A computational fluid dynamics code was supplemented with specific models to recalculate the Sandia experiment in order to identify problem areas which need to be addressed in the future. Therefore, a first attempt was undertaken to extrapolate to reactor conditions. This was done in two steps to separate geometric from material scaling relationships. The study shows that important experimental results can be extrapolated according to general scaling laws but that there are sensitivities, especially when replacing thermite by corium. The results show a considerable scatter and a dependence on geometric resolution and dynamics of energy transfer between participating components. (orig.) [de

Calculation of the CAREM reactor with the HUEMUL-PUMA-THERMIT chain of codes; Calculo del reactor CAREM con la cadena de codigos HUEMUL-PUMA-THERMIT

Energy Technology Data Exchange (ETDEWEB)

Notari, Carla; Grant, Carlos R [Comision Nacional de Energia Atomica, General San Martin (Argentina)

2000-07-01

The purpose of the work was the evaluation of the the CAREM 25 reactor core, using a chain of codes (HUEMUL-PUMA-THERMIT) different to the one used in the original design (CONDOR-CITVAP-THERMIT). First, we performed a partial validation of the our codes in lattices similar to CAREM and reproduced a benchmark for simulation of gadolinium burnup. The results were considered satisfactory for this stage of the project. Then, we calculated the core along the normal operating equilibrium cycle and in hot and cold shut-down conditions. The main outcome of our evaluation confirms the general behaviour of the reference calculations except in one important point referring to the cold shut down. In this condition, the failure of one single rod of bank number 13 of the shut down system, leaves the core in a supercritical state at the beginning of the cycle and this anomaly persists during almost a third of the overall cycle. A new design of the core is proposed with minor modifications of the reference one, without introducing new types of fuel elements and keeping the same fuel management scheme. This new core fulfills all the design requirements. (author)

Comparison of Bacillus atrophaeus spore viability following exposure to detonation of C4 and to deflagration of halogen-containing thermites

Science.gov (United States)

Tringe, J. W.; Létant, S. E.; Dugan, L. C.; Levie, H. W.; Kuhl, A. L.; Murphy, G. A.; Alves, S. W.; Vandersall, K. S.; Pantoya, M. L.

2013-12-01

Energetic materials are being considered for the neutralization of spore-forming bacteria. In this study, the neutralization effects of a monomolecular explosive were compared to the effects of halogen-containing thermites. Bacillus atrophaeus spores were exposed to the post-detonation environment of a 100 g charge of the military explosive C-4 at a range of 50 cm. These tests were performed in the thermodynamically closed environment of a 506-l barometric calorimeter. Associated temperatures were calculated using a thermodynamic model informed by calculations with the Cheetah thermochemical code. Temperatures in the range of 2300-2800 K were calculated to persist for nearly the full 4 ms pressure observation time. After the detonation event, spores were characterized using optical microscopy and the number of viable spores was assessed. Results showed live spore survival rates in the range of 0.01%-1%. For the thermite tests, a similar, smaller-scale configuration was employed that examined the spore neutralization effects of two thermites: aluminum with iodine pentoxide and aluminum with potassium chlorate. Only the former mixture resulted in spore neutralization. These results indicate that the detonation environment produced by an explosive with no chemical biocides may provide effective spore neutralization similar to a deflagrating thermite containing iodine.

Comparison of Bacillus atrophaeus spore viability following exposure to detonation of C4 and to deflagration of halogen-containing thermites

International Nuclear Information System (INIS)

Tringe, J. W.; Létant, S. E.; Dugan, L. C.; Levie, H. W.; Kuhl, A. L.; Murphy, G. A.; Alves, S. W.; Vandersall, K. S.; Pantoya, M. L.

2013-01-01

Energetic materials are being considered for the neutralization of spore-forming bacteria. In this study, the neutralization effects of a monomolecular explosive were compared to the effects of halogen-containing thermites. Bacillus atrophaeus spores were exposed to the post-detonation environment of a 100 g charge of the military explosive C-4 at a range of 50 cm. These tests were performed in the thermodynamically closed environment of a 506-l barometric calorimeter. Associated temperatures were calculated using a thermodynamic model informed by calculations with the Cheetah thermochemical code. Temperatures in the range of 2300–2800 K were calculated to persist for nearly the full 4 ms pressure observation time. After the detonation event, spores were characterized using optical microscopy and the number of viable spores was assessed. Results showed live spore survival rates in the range of 0.01%–1%. For the thermite tests, a similar, smaller-scale configuration was employed that examined the spore neutralization effects of two thermites: aluminum with iodine pentoxide and aluminum with potassium chlorate. Only the former mixture resulted in spore neutralization. These results indicate that the detonation environment produced by an explosive with no chemical biocides may provide effective spore neutralization similar to a deflagrating thermite containing iodine

Comparison of Bacillus atrophaeus spore viability following exposure to detonation of C4 and to deflagration of halogen-containing thermites

Energy Technology Data Exchange (ETDEWEB)

Tringe, J. W.; Létant, S. E.; Dugan, L. C.; Levie, H. W.; Kuhl, A. L.; Murphy, G. A.; Alves, S. W.; Vandersall, K. S. [Lawrence Livermore National Laboratory, 7000 East Avenue, Livermore, California 94550 (United States); Pantoya, M. L. [Mechanical Engineering Department, Texas Tech University, Lubbock, Texas 79409 (United States)

2013-12-21

Energetic materials are being considered for the neutralization of spore-forming bacteria. In this study, the neutralization effects of a monomolecular explosive were compared to the effects of halogen-containing thermites. Bacillus atrophaeus spores were exposed to the post-detonation environment of a 100 g charge of the military explosive C-4 at a range of 50 cm. These tests were performed in the thermodynamically closed environment of a 506-l barometric calorimeter. Associated temperatures were calculated using a thermodynamic model informed by calculations with the Cheetah thermochemical code. Temperatures in the range of 2300–2800 K were calculated to persist for nearly the full 4 ms pressure observation time. After the detonation event, spores were characterized using optical microscopy and the number of viable spores was assessed. Results showed live spore survival rates in the range of 0.01%–1%. For the thermite tests, a similar, smaller-scale configuration was employed that examined the spore neutralization effects of two thermites: aluminum with iodine pentoxide and aluminum with potassium chlorate. Only the former mixture resulted in spore neutralization. These results indicate that the detonation environment produced by an explosive with no chemical biocides may provide effective spore neutralization similar to a deflagrating thermite containing iodine.

Ignition dynamics and activation energies of metallic thermites: From nano- to micron-scale particulate composites

Science.gov (United States)

Hunt, Emily M.; Pantoya, Michelle L.

2005-08-01

Ignition behaviors associated with nano- and micron-scale particulate composite thermites were studied experimentally and modeled theoretically. The experimental analysis utilized a CO2 laser ignition apparatus to ignite the front surface of compacted nickel (Ni) and aluminum (Al) pellets at varying heating rates. Ignition delay time and ignition temperature as a function of both Ni and Al particle size were measured using high-speed imaging and microthermocouples. The apparent activation energy was determined from this data using a Kissinger isoconversion method. This study shows that the activation energy is significantly lower for nano- compared with micron-scale particulate media (i.e., as low as 17.4 compared with 162.5kJ /mol, respectively). Two separate Arrhenius-type mathematical models were developed that describe ignition in the nano- and the micron-composite thermites. The micron-composite model is based on a heat balance while the nanocomposite model incorporates the energy of phase transformation in the alumina shell theorized to be an initiating step in the solid-solid diffusion reaction and uniquely appreciable in nanoparticle media. These models were found to describe the ignition of the Ni /Al alloy for a wide range of heating rates.

Uncontrolled re-entry of satellite parts after finishing their mission in LEO: Titanium alloy degradation by thermite reaction energy

Science.gov (United States)

Monogarov, K. A.; Pivkina, A. N.; Grishin, L. I.; Frolov, Yu. V.; Dilhan, D.

2017-06-01

Analytical and experimental studies conducted at Semenov Institute of Chemical Physics for investigating the use of pyrotechnic compositions, i.e., thermites, to reduce the risk of the fall of thermally stable parts of deorbiting end-of-life LEO satellites on the Earth are described. The main idea was the use of passive heating during uncontrolled re-entry to ignite thermite composition, fixed on the titanium surface, with the subsequent combustion energy release to be sufficient to perforate the titanium cover. It is supposed, that thus destructed satellite parts will lose their streamline shape, and will burn out being aerodynamically heated during further descending in atmosphere (patent FR2975080). On the base of thermodynamic calculations the most promising thermite compositions have been selected for the experimental phase. The unique test facilities have been developed for the testing of the efficiency of thermite charges to perforate the titanium TA6V cover of 0.8 mm thickness under temperature/pressure conditions duplicated the uncontrolled re-entry of titanium tank after its mission on LEO. Experiments with the programmed laser heating inside the vacuum chamber revealed the only efficient thermite composition among preliminary selected ones to be Al/Co3O4. Experimental searching of the optimal aluminum powder between spherical and flaked nano- and micron-sized ones revealed the possibility to adjust the necessary ignition delay time, according to the titanium cover temperature dependency on deorbiting time. For the titanium tank the maximum temperature is 1100 °C at altitude 68 km and pressure 60 Pa. Under these conditions Al/Co3O4 formulations with nano-Al spherical particles provide the ignition time to be 13.3 s, and ignition temperature as low as 592±5 °C, whereas compositions with the micron-sized spherical Al powder reveal these values to be much higher, i.e., 26.3 s and 869±5 °C, respectively. The analytical and experimental studies described

The exothermic reaction route of a self-heatable conductive ink for rapid processable printed electronics

Science.gov (United States)

Shin, Dong-Youn; Han, Jin Wook; Chun, Sangki

2013-12-01

We report the exothermic reaction route and new capability of a self-heatable conductive ink (Ag2O and silver 2,2-dimethyloctanoate) in order to achieve both a low sintering temperature and electrical resistivity within a short sintering time for flexible printed electronics and display appliances. Unlike conventional conductive ink, which requires a costly external heating instrument for rapid sintering, self-heatable conductive ink by itself is capable of generating heat as high as 312 °C when its exothermic reaction is triggered at a temperature of 180 °C. This intensive exothermic reaction is found to result from the recursive reaction of the 2,2-dimethyloctanoate anion, which is thermally dissociated from silver 2,2-dimethyloctanoate, with silver oxide microparticles. Through this recursive reaction, a massive number of silver atoms are supplied from silver oxide microparticles, and the nucleation of silver atoms and the fusion of silver nanoparticles become the major source of heat. This exothermic reaction eventually realizes the electrical resistivity of self-heatable conductive ink as low as 27.5 μΩ cm within just 40 s by combining chemical annealing, which makes it suitable for the roll-to-roll printable electronics such as a flexible touch screen panel.We report the exothermic reaction route and new capability of a self-heatable conductive ink (Ag2O and silver 2,2-dimethyloctanoate) in order to achieve both a low sintering temperature and electrical resistivity within a short sintering time for flexible printed electronics and display appliances. Unlike conventional conductive ink, which requires a costly external heating instrument for rapid sintering, self-heatable conductive ink by itself is capable of generating heat as high as 312 °C when its exothermic reaction is triggered at a temperature of 180 °C. This intensive exothermic reaction is found to result from the recursive reaction of the 2,2-dimethyloctanoate anion, which is thermally

Nano-Phase Powder Based Exothermic Braze Repair Technology For RCC Materials, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — MRi is proposing, with its partner, Exotherm Corp (Camden, NJ) to demonstrate the feasibility of using exothermic brazing to join RCC (or C:SiC) composites to itself...

The exothermic reaction route of a self-heatable conductive ink for rapid processable printed electronics.

Science.gov (United States)

Shin, Dong-Youn; Han, Jin Wook; Chun, Sangki

2014-01-07

We report the exothermic reaction route and new capability of a self-heatable conductive ink (Ag2O and silver 2,2-dimethyloctanoate) in order to achieve both a low sintering temperature and electrical resistivity within a short sintering time for flexible printed electronics and display appliances. Unlike conventional conductive ink, which requires a costly external heating instrument for rapid sintering, self-heatable conductive ink by itself is capable of generating heat as high as 312 °C when its exothermic reaction is triggered at a temperature of 180 °C. This intensive exothermic reaction is found to result from the recursive reaction of the 2,2-dimethyloctanoate anion, which is thermally dissociated from silver 2,2-dimethyloctanoate, with silver oxide microparticles. Through this recursive reaction, a massive number of silver atoms are supplied from silver oxide microparticles, and the nucleation of silver atoms and the fusion of silver nanoparticles become the major source of heat. This exothermic reaction eventually realizes the electrical resistivity of self-heatable conductive ink as low as 27.5 μΩ cm within just 40 s by combining chemical annealing, which makes it suitable for the roll-to-roll printable electronics such as a flexible touch screen panel.

Prompt striations observed in a barium thermite release at 335 km

International Nuclear Information System (INIS)

Simons, D.J.; Pongratz, M.B.; Smith, G.M.; Barasch, G.E.; Fitzgerald, T.J.

1981-01-01

Three barium clouds have been released from a single rocket at altitudes of 335, 443, and 535 km. The releases were by means of barium thermite injection. Adding the different cross-field velocity components of the rocket at each of the releases resulted in barium clouds with different kinetic velocity distributions. The barium cloud with the most peaked velocity distribution striated promptly, in good agreement with theoretical predictions based on a kinetic plasma instability. Details of the data analysis and experiment are discussed

Calculation of the CAREM reactor with the HUEMUL-PUMA-THERMIT chain of codes

International Nuclear Information System (INIS)

Notari, Carla; Grant, Carlos R.

2000-01-01

The purpose of the work was the evaluation of the the CAREM 25 reactor core, using a chain of codes (HUEMUL-PUMA-THERMIT) different to the one used in the original design (CONDOR-CITVAP-THERMIT). First, we performed a partial validation of the our codes in lattices similar to CAREM and reproduced a benchmark for simulation of gadolinium burnup. The results were considered satisfactory for this stage of the project. Then, we calculated the core along the normal operating equilibrium cycle and in hot and cold shut-down conditions. The main outcome of our evaluation confirms the general behaviour of the reference calculations except in one important point referring to the cold shut down. In this condition, the failure of one single rod of bank number 13 of the shut down system, leaves the core in a supercritical state at the beginning of the cycle and this anomaly persists during almost a third of the overall cycle. A new design of the core is proposed with minor modifications of the reference one, without introducing new types of fuel elements and keeping the same fuel management scheme. This new core fulfills all the design requirements. (author)

SIMBATH 1976-1992, seventeen years of experimental investigation of key issues concerned with severe reactor accidents

International Nuclear Information System (INIS)

Kaiser, A.; Peppler, W.; Will, H.

1994-01-01

The course of the initiating phase of severe fast reactor accidents is determined by early material motion. In simulation experiments (SIMBATH, simulation experiments in fuel element mock-ups with thermite) the behavior of single pin, 7 pin, 19 pin, 37 pin bundles undergoing meltdown was investigated. Thermite (Al + Fe 2 O 3 ) filled tubes were used to simulate fuel rods, while exothermal heat of the thermite reaction simulated the nuclear heat. The energy of 3.4 kJ per centimeter of pin length resulted in melting temperature of about 3200 K. SIMBATH is an out-of-pile experimental program with non-radioactive materials which provided the possibility to perform numerous experiments. The x-ray high speed photography used in the test enabled to visualise material motion and relocation qualitatively, and furthermore to gain quantitative results by additionally installed photodiodes. The results of the experiment serve as a database to evaluate physical phenomena relevant to be modelled by computer codes (SIMMER) and to verify the codes. The experiments were carried out either in stagnant sodium with an axial temperature gradient, or in flowing sodium, simulating unprotected loss of flow (ULOF) or unprotected transient overpower accidents (UTOP) conditions, respectively

Transport processes in exothermic gas-solid reactions

International Nuclear Information System (INIS)

Vijay, P.L.; Sathiyamoorthy, D.

1997-01-01

The variation of the concentration of gaseous reactant, temperature distribution for an exothermic reaction, the diffusivity factor and the reaction ratio profiles with various radial positions of a solid reactant have been computed and illustrated for a specific case of reduction reaction of UO 3 by hydrogen

Simulation of TRAN B experiments by alumina thermite melt injection (SIMBATH out-of-pile experiments, TRAN simulation B1/1, B1/3, B1/4)

International Nuclear Information System (INIS)

Peppler, W.; Will, H.

1986-07-01

The SIMBATH programme was initiated to investigate the physical phenomena of transient material movement and relocation during transient overpower (TOP) and loss of flow (LOF) driven TOP accidents in LMFBR's. The energy release during the accident is simulated out of pile by the reaction of a thermite mixture. Within the frame of comparing studies of the behaviour of fuel (UO 2 ) and the thermite melt (Al 2 O 3 +Fe) used, respectively, the TRAN B series was reproduced out of pile with this thermite. Special emphasis is given to the similarities and differences in the freezing behaviour of these two materials. The test results of the simulation experiments are analysed and reported. Additionally the tests were recalculated with the code PLUGM. Similarity is found with respect to the freezing behaviour of these two materials. (orig.) [de

Evaluation of Hanford high level waste vitrification chemistry for an NCAW simulant -- FY 1994: Potential exothermic reactions in the presence of formic acid, glycolic acid, and oxalic acid

Energy Technology Data Exchange (ETDEWEB)

Sills, J.A.

1995-07-01

A potential for an uncontrollable exothermic reaction between nitrate and organic salts during preparation of a high level waste melter feed has been identified. In order to examine this potential more closely, the thermal behavior of simulated neutralized current acid waste (NCAW) treated with various organic reductants was studied. Differential scanning calorimetry (DSC) measurements were collected on simulated waste samples and their supernates treated with organics. Organic reductants used were formic acid, glycolic acid, and oxalic acid. For comparison, samples of untreated simulant and untreated simulant with added noble metals were tested. When heated, untreated simulant samples both with and without noble metals showed no exothermic behavior. All of the treated waste simulant samples showed exothermic behavior. Onset temperatures of exothermic reactions were 120 C to 210 C. Many onset temperatures, particularly those for formic acid treated samples, are well below 181 C, the estimated maximum steam coil temperature (considered to be a worst case maximum temperature for chemical process tank contents). The enthalpies of the reactions were {minus}180 {times} 10{sup {minus}3} J/Kg supernate ({minus}181 J/g) for the oxalic acid treated simulant supernate to {minus}1,150 {times} 10{sup {minus}3} J/Kg supernate ({minus}1,153 J/g) for the formic acid treated simulant supernate.

Evaluation of Hanford high level waste vitrification chemistry for an NCAW simulant -- FY 1994: Potential exothermic reactions in the presence of formic acid, glycolic acid, and oxalic acid

International Nuclear Information System (INIS)

Sills, J.A.

1995-07-01

A potential for an uncontrollable exothermic reaction between nitrate and organic salts during preparation of a high level waste melter feed has been identified. In order to examine this potential more closely, the thermal behavior of simulated neutralized current acid waste (NCAW) treated with various organic reductants was studied. Differential scanning calorimetry (DSC) measurements were collected on simulated waste samples and their supernates treated with organics. Organic reductants used were formic acid, glycolic acid, and oxalic acid. For comparison, samples of untreated simulant and untreated simulant with added noble metals were tested. When heated, untreated simulant samples both with and without noble metals showed no exothermic behavior. All of the treated waste simulant samples showed exothermic behavior. Onset temperatures of exothermic reactions were 120 C to 210 C. Many onset temperatures, particularly those for formic acid treated samples, are well below 181 C, the estimated maximum steam coil temperature (considered to be a worst case maximum temperature for chemical process tank contents). The enthalpies of the reactions were -180 x 10 -3 J/Kg supernate (-181 J/g) for the oxalic acid treated simulant supernate to -1,150 x 10 -3 J/Kg supernate (-1,153 J/g) for the formic acid treated simulant supernate

Analysis of the consequences of 'thermite' reaction; Analisis sobre las consecuencias de la reaccion 'termita'

Energy Technology Data Exchange (ETDEWEB)

Yorio, Daniel; Cincotta, Daniel O; Camacho, Esteban F; Bruno, Hernan R; Boero, Norma L [Comision Nacional de Energia Atomica, General San Martin (Argentina). Centro Atomico Constituyentes

1999-07-01

The mixture of Al-U{sub 3}O{sub 8} is not in a state of chemical equilibrium, and at temperatures of between 850 degree C and 1000 degree C, it reacts exo thermally. This is known, in corresponding bibliography, as a 'Thermite reaction'. This mixture is used in the manufacturing of the plate-type fuel used in research reactors. It has been pointed out that the release of energy caused by this type of reactions might represent a risk in case of accidents in this type of reactor. Conclusions, in general, tend to indicate that no such risk exists, although no concrete assurance is given that this is the case, and this fact, therefore, leaves room for doubt. The objective of this paper is to provide an in-depth study of what happens to a fuel plate when it is subjected to thermite reaction. We will, furthermore, analyze the consequences of the release of energy generated by this type of reaction within the core of the reactor, clearly defining the problem for this type of fuel and this kind of reactor.

Design of an isopropanol–acetone–hydrogen chemical heat pump with exothermic reactors in series

International Nuclear Information System (INIS)

Xu, Min; Duan, Yanjun; Xin, Fang; Huai, Xiulan; Li, Xunfeng

2014-01-01

The isopropanol–acetone–hydrogen chemical heat pump system with a series of exothermic reactors in which the reaction temperatures decrease successively is proposed. This system shows the better energy performances as compared with the traditional system with a single exothermic reactor, especially when the higher upgraded temperature is need. At the same amounts of the heat released, the work input of the compressor and the heater are both reduced notably. The results indicate that the advantages of the IAH-CHP system with exothermic reactors in series are obvious. - Highlights: • We propose the IAH-CHP system with exothermic reactors in series. • The COP and exergy efficiency of the system increase by 7.6% and 10.3% respectively. • The work input of the system is reduced notably at the same quantity of heat released

Exothermic reactions among components of lithium-sulfur dioxide and lithium-thionyl chloride cells

Science.gov (United States)

Dallek, S.; James, S. D.; Kilroy, W. P.

1981-03-01

Differential scanning calorimetry measurements were made on various components of Li-SOCl2 cells to identify those combinations that react exothermically and might cause batteries to explode. The passivation of Li by SO2 in acetonitrile (AN) was characterized over a wide range of SO2 concentration (0.1-14M). In the absence of SO2, trace additions of water greatly lower the exothermicity of the Li-AN reaction. The Li-SOCl2-LiAlCl4 mixture is inert over a wide range of temperature well above the melting point of Li. However, adding carbon black converts this inert mixture into one which is highly and consistently reactive. The addition of copper powder enhances carbon's catalytic effect on the reactivity of the Li-SOCl2-LiAlCl4 mixture while trace additions of water have the opposite effect.

A DFT study on the enthalpies of thermite reactions and enthalpies of formation of metal composite oxide

Science.gov (United States)

Zhang, Yu-ying; Wang, Meng-jie; Chang, Chun-ran; Xu, Kang-zhen; Ma, Hai-xia; Zhao, Feng-qi

2018-05-01

The standard thermite reaction enthalpies (ΔrHmθ) for seven metal oxides were theoretically analyzed using density functional theory (DFT) under five different functional levels, and the results were compared with experimental values. Through the comparison of the linear fitting constants, mean error and root mean square error, the Perdew-Wang functional within the framework of local density approximation (LDA-PWC) and Perdew-Burke-Ernzerhof exchange-correlation functional within the framework of generalized gradient approximation (GGA-PBE) were selected to further calculate the thermite reaction enthalpies for metal composite oxides (MCOs). According to the Kirchhoff formula, the standard molar reaction enthalpies for these MCOs were obtained and their standard molar enthalpies of formation (ΔfHmθ) were finally calculated. The results indicated that GGA-PBE is the most suitable one out of the total five methods to calculate these oxides. Tungstate crystals present the maximum deviation of the enthalpies of thermite reactions for MCOs and these of their physical metal oxide mixtures, but ferrite crystals are the minimum. The correlation coefficients are all above 0.95, meaning linear fitting results are very precise. And the molar enthalpies of formation for NiMoO4, CuMoO4, PbZrO3 (Pm/3m), PbZrO3 (PBA2), PbZrO3 (PBam), MgZrO3, CdZrO3, MnZrO3, CuWO4 and Fe2WO6 were first obtained as -1078.75, -1058.45, -1343.87, -1266.54, -1342.29, -1333.03, -1210.43, -1388.05, -1131.07 and - 1860.11 kJ·mol-1, respectively.

Thermal process for immobilization of radioactive wastes

International Nuclear Information System (INIS)

Brownell, L.E.; Isaacson, R.E.; Kupfer, M.J.; Schulz, W.W.

1971-01-01

The Thermalt process involves an exothermic, thermite-like reaction of aluminum metal with basalt, quartz sand, and radioactive waste. The resulting melt when solidified is a silicious stone-like material that is similar in chemical composition to basalt. The process utilizes low cost ingredients: basalt rock, which occurs naturally in the Hanford region, inexpensive aluminum metal such as aluminum scrap which need not be pure, and the waste which is predominately sodium nitrate salt. The waste itself along with the basalt provides the oxygen necessary for the reaction. The exothermic reaction provides the necessary heat to melt the ingredients thus eliminating the need for external heat sources such as furnaces which are necessary with most other melt methods. The final product is highly stable and essentially nonleachable; leach rates appear as low or lower than other melt products described in the literature. Initial studies indicate the process is effective for both low-level and high-level wastes. (U.S.)

Reactor for exothermic reactions

Science.gov (United States)

Smith, L.A. Jr.; Hearn, D.; Jones, E.M. Jr.

1993-03-02

A liquid phase process is described for oligomerization of C[sub 4] and C[sub 5] isoolefins or the etherification thereof with C[sub 1] to C[sub 6] alcohols wherein the reactants are contacted in a reactor with a fixed bed acid cation exchange resin catalyst at an LHSV of 5 to 20, pressure of 0 to 400 psig and temperature of 120 to 300 F. Wherein the improvement is the operation of the reactor at a pressure to maintain the reaction mixture at its boiling point whereby at least a portion but less than all of the reaction mixture is vaporized. By operating at the boiling point and allowing a portion of the reaction mixture to vaporize, the exothermic heat of reaction is dissipated by the formation of more boil up and the temperature in the reactor is controlled.

Combustion-Assisted Photonic Annealing of Printable Graphene Inks via Exothermic Binders.

Science.gov (United States)

Secor, Ethan B; Gao, Theodore Z; Dos Santos, Manuel H; Wallace, Shay G; Putz, Karl W; Hersam, Mark C

2017-09-06

High-throughput and low-temperature processing of high-performance nanomaterial inks is an important technical challenge for large-area, flexible printed electronics. In this report, we demonstrate nitrocellulose as an exothermic binder for photonic annealing of conductive graphene inks, leveraging the rapid decomposition kinetics and built-in energy of nitrocellulose to enable versatile process integration. This strategy results in superlative electrical properties that are comparable to extended thermal annealing at 350 °C, using a pulsed light process that is compatible with thermally sensitive substrates. The resulting porous microstructure and broad liquid-phase patterning compatibility are exploited for printed graphene microsupercapacitors on paper-based substrates.

In vitro pulp chamber temperature rise from irradiation and exotherm of flowable composites.

Science.gov (United States)

Baroudi, Kusai; Silikas, Nick; Watts, David C

2009-01-01

The aim of this study was to investigate the pulpal temperature rise induced during the polymerization of flowable and non-flowable composites using light-emitting diode (LED) and halogen (quartz-tungsten-halogen) light-curing units (LCUs). Five flowable and three non-flowable composites were examined. Pulpal temperature changes were recorded over 10 min in a sample primary tooth by a thermocouple. A conventional quartz-tungsten-halogen source and two LEDs, one of which was programmable, were used for light curing the resin composites. Three repetitions per material were made for each LCU. There was a wide range of temperature rises among the materials (P < 0.05). Temperature rises ranged between 1.3 degrees C for Filtek Supreme irradiated by low-power LED and 4.5 degrees C for Grandio Flow irradiated by high-power LED. The highest temperature rises were observed with both the LED high-power and soft-start LCUs. The time to reach the exothermic peak varied significantly between the materials (P < 0.05). Pulpal temperature rise is related to both the radiant energy output from LCUs and the polymerization exotherm of resin composites. A greater potential risk for heat-induced pulp damage might be associated with high-power LED sources. Flowable composites exhibited higher temperature rises than non-flowable materials, because of higher resin contents.

Exothermic potential of sodium nitrate salt cake

International Nuclear Information System (INIS)

Beitel, G.A.

1977-06-01

High-Level radioactive liquid waste is being reduced to a liquid slurry by an evaporation and crystallization process and stored in the existing single-shell tanks. Continuous pumping of the waste storage tank will reduce the present 30 to 50% moisture to the minimum possible. The reduced waste is a relatively immobile salt cake consisting predominantly of sodium nitrate (NaNO 3 ) with lesser amounts of sodium nitrite (NaNO 2 ), sodium metaaluminate (NaAlO 2 ), and sodium hydroxide (NaOH). Trace amounts of fission products, transuranics, and a broad spectrum of organic materials in small but unknown amounts are also present. A program was initiated in 1973 to determine whether or not conditions exist which could lead to an exothermic reaction in the salt cake. Results of the latest series of tests conducted to determine the effects of mass and pressure are summarized. Hanford salt cake, as stored, cannot support combustion, and does not ignite when covered with a burning volatile hydrocarbon

Applications of the thermit code to 3D thermal hydraulic analysis of LWR cores

International Nuclear Information System (INIS)

Reed, W.H.

1979-01-01

The THERMIT code calculates the three-dimensional transient thermal hydraulic behavior of light water reactor cores. Its two-fluid dynamics equations for two-phase flow offer improved physical modelling capability needed in the context of calculation coupled to neutron kinetics for feedback. The numerical fluid dynamics method was chosen for reliability over a wider range of transients. An improved heat transfer numerical method is presented which gives better numerical stability and accuracy. A number of example calculations are discussed which give an idea of the power and flexibility of the code

Simulation of sodium boiling experiments with THERMIT sodium version

International Nuclear Information System (INIS)

Huh, K.Y.

1982-05-01

Natural and forced convection experiments (SBTF and French) are simulated with the sodium version of the thermal-hydraulic computer code THERMIT. Simulation is done for the test section with the pressure-velocity boundary condition and subsequently extended to the whole loop. For the test section simulation, a steady-state and transient calculations are performed and compared with experimental data. For the loop simulation, two methods are used, a simulated 1-D loop and an actual 1-D loop. In the simulated 1-D loop analysis, the vapor density is increased by one hundred and two hundred times to avoid the code failure and the results still showed some of the important characteristics of the two-phase flow oscillation in a loop. A mathematical model is suggested for the two-phase flow oscillation. In the actual 1-D loop, only the single phase calculation was performed and turned out to be nearly the same as the simulated 1-D loop single phase results

Method for conducting exothermic reactions

Science.gov (United States)

Smith, L. Jr.; Hearn, D.; Jones, E.M. Jr.

1993-01-05

A liquid phase process for oligomerization of C[sub 4] and C[sub 5] isoolefins or the etherification thereof with C[sub 1] to C[sub 6] alcohols wherein the reactants are contacted in a reactor with a fixed bed acid cation exchange resin catalyst at an LHSV of 5 to 20, pressure of 0 to 400 psig and temperature of 120 to 300 F. wherein the improvement is the operation of the reactor at a pressure to maintain the reaction mixture at its boiling point whereby at least a portion but less than all of the reaction mixture is vaporized. By operating at the boiling point and allowing a portion of the reaction mixture to vaporize, the exothermic heat of reaction is dissipated by the formation of more boil up and the temperature in the reactor is controlled.

Influence of power-law index on an unsteady exothermic reaction ...

African Journals Online (AJOL)

This study presents the solution of an unsteady Arrhenius exothermic reaction where we reduced the exponential term to a power-law approximation. A numerical solution of the problem is obtained using shooting technique with second order Runge-Kuta scheme. It is shown that the temperature of the reactant depends on ...

Influence of curing agents on gelation and exotherm behaviour of an ...

Indian Academy of Sciences (India)

Unsaturated polyester resin; resin curing; gel time; exotherm behaviour; peroxide initiator. 1. Introduction ... process cycle to manufacture a composite part. The magni- ... work, which makes sudden irreversible transformation from a liquid resin to a ... anistic models attempt to quantify the balance of chemical species taking ...

Microwave assisted preparation of magnesium phosphate cement (MPC) for orthopedic applications: A novel solution to the exothermicity problem

International Nuclear Information System (INIS)

Zhou, Huan; Agarwal, Anand K.; Goel, Vijay K.; Bhaduri, Sarit B.

2013-01-01

There are two interesting features of this paper. First, we report herein a novel microwave assisted technique to prepare phosphate based orthopedic cements, which do not generate any exothermicity during setting. The exothermic reactions during the setting of phosphate cements can cause tissue damage during the administration of injectable compositions and hence a solution to the problem is sought via microwave processing. This solution through microwave exposure is based on a phenomenon that microwave irradiation can remove all water molecules from the alkaline earth phosphate cement paste to temporarily stop the setting reaction while preserving the active precursor phase in the formulation. The setting reaction can be initiated a second time by adding aqueous medium, but without any exothermicity. Second, a special emphasis is placed on using this technique to synthesize magnesium phosphate cements for orthopedic applications with their enhanced mechanical properties and possible uses as drug and protein delivery vehicles. The as-synthesized cements were evaluated for the occurrences of exothermic reactions, setting times, presence of Mg-phosphate phases, compressive strength levels, microstructural features before and after soaking in (simulated body fluid) SBF, and in vitro cytocompatibility responses. The major results show that exposure to microwaves solves the exothermicity problem, while simultaneously improving the mechanical performance of hardened cements and reducing the setting times. As expected, the cements are also found to be cytocompatible. Finally, it is observed that this process can be applied to calcium phosphate cements system (CPCs) as well. Based on the results, this microwave exposure provides a novel technique for the processing of injectable phosphate bone cement compositions. - Highlights: • A microwave assisted system for bone cement manufacturing • A solution to exothermicity problem of acid–base reaction based bone cement �

Microwave assisted preparation of magnesium phosphate cement (MPC) for orthopedic applications: A novel solution to the exothermicity problem

Energy Technology Data Exchange (ETDEWEB)

Zhou, Huan, E-mail: Huan.Zhou@rockets.utoledo.edu [Department of Mechanical, Industrial and Manufacturing Engineering, The University of Toledo, Toledo, OH 43606 (United States); Agarwal, Anand K.; Goel, Vijay K. [Department of Bioengineering, The University of Toledo, Toledo, OH 43606 (United States); Bhaduri, Sarit B. [Department of Mechanical, Industrial and Manufacturing Engineering, The University of Toledo, Toledo, OH 43606 (United States); Division of Dentistry, The University of Toledo, Toledo, OH 43606 (United States)

2013-10-15

There are two interesting features of this paper. First, we report herein a novel microwave assisted technique to prepare phosphate based orthopedic cements, which do not generate any exothermicity during setting. The exothermic reactions during the setting of phosphate cements can cause tissue damage during the administration of injectable compositions and hence a solution to the problem is sought via microwave processing. This solution through microwave exposure is based on a phenomenon that microwave irradiation can remove all water molecules from the alkaline earth phosphate cement paste to temporarily stop the setting reaction while preserving the active precursor phase in the formulation. The setting reaction can be initiated a second time by adding aqueous medium, but without any exothermicity. Second, a special emphasis is placed on using this technique to synthesize magnesium phosphate cements for orthopedic applications with their enhanced mechanical properties and possible uses as drug and protein delivery vehicles. The as-synthesized cements were evaluated for the occurrences of exothermic reactions, setting times, presence of Mg-phosphate phases, compressive strength levels, microstructural features before and after soaking in (simulated body fluid) SBF, and in vitro cytocompatibility responses. The major results show that exposure to microwaves solves the exothermicity problem, while simultaneously improving the mechanical performance of hardened cements and reducing the setting times. As expected, the cements are also found to be cytocompatible. Finally, it is observed that this process can be applied to calcium phosphate cements system (CPCs) as well. Based on the results, this microwave exposure provides a novel technique for the processing of injectable phosphate bone cement compositions. - Highlights: • A microwave assisted system for bone cement manufacturing • A solution to exothermicity problem of acid–base reaction based bone cement �

FY 1998 report on the result of R and D projects by local consortiums. Rare metal recovery and resourcing of residual slags from metal plating wastes and aluminum dross by continuous thermit reaction (CTR) system; 1998 nendo CTR (Continuous Termit Reaction) System ni yoru aluminium dross to mekki surajji kara no energy less, rare metal kaisei process to sono slag no saishigenka seika hokokusho

Energy Technology Data Exchange (ETDEWEB)

NONE

2000-03-01

The R and D project has been implemented for treating metal plating wastes (sludge) and aluminum dross in a melting furnace operated in a reducing atmosphere, in order to make the wastes harmless and recover the rare metals by the thermit reactions. The theoretical analysis of the powder properties has produced the desired powder pretreatment conditions, such as drying/firing conditions, mixing ratio and composition, forming conditions, and characteristics of the formed articles. For recovering the useful metals, it is confirmed that the thermit reactions proceed efficiently in a high-temperature melting furnace operated in a reducing atmosphere, and the molten metals are easily separated from the molten slag. It is also confirmed that the formed article allows separation of the metals from the residual slag more easily than the mixed powder. For the design of the continuous thermit reaction (CTR) system, it is investigated whether the products and other discharged substances can be safely handled and effectively utilized, and the control/instrumentation systems and others are established after setting the conditions for, e.g., sludge drying/firing in air, powder mixing/crushing, briquette production, and flow of the thermit reactions in a reducing atmosphere. (NEDO)

Effect of Al-B2O3-TiO2 Exothermic System on Performances of Fly Ash Glass/Ceramic Composite Coating

Directory of Open Access Journals (Sweden)

Yajun An

2018-01-01

Full Text Available Glass/ceramic composite coatings were prepared on 40Cr steel matrix by thermo-chemical reaction with fly ash and a small amount of SiO2, Al2O3, MgO, and albite as main raw materials. On this basis, adding 10% Al-TiO2-B2O3 exothermic system, the morphology, phase, thermal shock resistance, and corrosion resistance of the coating were tested, and the influence of exothermic system on the structure and properties of the composite coating was studied. The experimental results show that the addition of exothermic system can promote the formation of NaB15, TiB2, Na2B4O7, Ca2Al2SiO7, and other new phases by thermo-chemical reaction; when compared to the composite coating without addition of exothermic system, combined with a good interface, higher compactness, and lower porosity. The highest micro hardness can be reached 725HV0.1. The number of thermal shock from 700 °C to room temperature can reach more than 50 times; acid, salt, oil immersion corrosion test, composite coating with exothermic system relative to the matrix increased by 27.40 times, 3.97 times, and 1.88 times, respectively. The overall performance is better than that of the composite coating without exothermic system.

Nano-Phase Powder Based Exothermic Braze Repair Technology For RCC Materials, Phase II

Data.gov (United States)

National Aeronautics and Space Administration — The Phase II project will advance innovative, cost effective and reliable nano-phase exothermic RCC joining processes (ExoBrazeTM) in order to be able to reinforce...

Synthesis of (U,Zr)C solid solutions under exothermic conditions

International Nuclear Information System (INIS)

Wang, L.L.; Moore, H.G.; Gladson, J.W.

1993-01-01

The reactions of forming (U,Zr)C solid solutions from their elemental components or similarly less stable reactants such as UC 2 are strongly exothermic due to the high stability of these solid solutions. A simple approach of utilizing this heat of formation energy to assist the solid solution reaction process is to intimately mix the less stable reactant powders and then pressed them into a compact. The compact is then heated to the ignition temperature of the reaction. The feasibility of this reaction method to synthesize (U,Zr)C solid solutions has been demonstrated in this study. The preliminary results also show that both the initial composition and the heating rate have a significant effect on the nature of the reaction process. As expected the degree of powder mixing was also found to affect the completeness of the reaction

Apparatus for measuring photopolymerization exotherms

International Nuclear Information System (INIS)

Pargellis, A.N.

1986-01-01

The resultant exotherms obtained from the photopolymerization of thin-film chemical samples have been investigated. The radiant source used is a standard 200-W in. -1 mercury discharge lamp. About 55% of this power is in the infrared (IR) part of the spectrum, which is removed by a water-cooled quartz tube. Different regions of the remaining spectrum were selected in the range 270--450 nm with cuton filters. A grating spectrometer is used to measure the transmitted spectra. A thin foil heat flow sensor is used as a calorimeter to measure the heat given off by a chemical sample when exposed to 0.5-s pulses of ultraviolet (UV) radiation. The pulse is formed by means of a bistable electronic shutter. Data were taken for samples ranging from 0.0125 to 0.05 mm [0.5 to 2.0 milli-inch (mils)] thicknesses. The heat output per gram is largest for the thinner samples and the absorption characteristics were observed to depend on the thickness of the sample

Kinetic analysis of overlapping multistep thermal decomposition comprising exothermic and endothermic processes: thermolysis of ammonium dinitramide.

Science.gov (United States)

Muravyev, Nikita V; Koga, Nobuyoshi; Meerov, Dmitry B; Pivkina, Alla N

2017-01-25

This study focused on kinetic modeling of a specific type of multistep heterogeneous reaction comprising exothermic and endothermic reaction steps, as exemplified by the practical kinetic analysis of the experimental kinetic curves for the thermal decomposition of molten ammonium dinitramide (ADN). It is known that the thermal decomposition of ADN occurs as a consecutive two step mass-loss process comprising the decomposition of ADN and subsequent evaporation/decomposition of in situ generated ammonium nitrate. These reaction steps provide exothermic and endothermic contributions, respectively, to the overall thermal effect. The overall reaction process was deconvoluted into two reaction steps using simultaneously recorded thermogravimetry and differential scanning calorimetry (TG-DSC) curves by considering the different physical meanings of the kinetic data derived from TG and DSC by P value analysis. The kinetic data thus separated into exothermic and endothermic reaction steps were kinetically characterized using kinetic computation methods including isoconversional method, combined kinetic analysis, and master plot method. The overall kinetic behavior was reproduced as the sum of the kinetic equations for each reaction step considering the contributions to the rate data derived from TG and DSC. During reproduction of the kinetic behavior, the kinetic parameters and contributions of each reaction step were optimized using kinetic deconvolution analysis. As a result, the thermal decomposition of ADN was successfully modeled as partially overlapping exothermic and endothermic reaction steps. The logic of the kinetic modeling was critically examined, and the practical usefulness of phenomenological modeling for the thermal decomposition of ADN was illustrated to demonstrate the validity of the methodology and its applicability to similar complex reaction processes.

APPLICATION OF EXOTHERMIC PLUGS AT PRODUCTION OF STEEL CASTING IS THE WAY TO ECONOMY

Directory of Open Access Journals (Sweden)

V. M. Gatsuro

2008-01-01

Full Text Available It is shown that application of exothermic plugs allows to decrease steel intensity of casting mold, labor intensiveness for trim, expenses for melting of 1 ton of good casting, material expenses for burden materials.

Self-propagating exothermic reaction analysis in Ti/Al reactive films using experiments and computational fluid dynamics simulation

Energy Technology Data Exchange (ETDEWEB)

Sen, Seema, E-mail: seema.sen@tu-ilmenau.de [Technical University of Ilmenau, Department of Materials for Electronics, Gustav-Kirchhoff-Str. 5, 98693 Ilmenau (Germany); Niederrhein University of Applied Science, Department of Mechanical and Process Engineering, Reinarzstraße 49, 47805 Krefeld (Germany); Lake, Markus; Kroppen, Norman; Farber, Peter; Wilden, Johannes [Niederrhein University of Applied Science, Department of Mechanical and Process Engineering, Reinarzstraße 49, 47805 Krefeld (Germany); Schaaf, Peter [Technical University of Ilmenau, Department of Materials for Electronics, Gustav-Kirchhoff-Str. 5, 98693 Ilmenau (Germany)

2017-02-28

Highlights: • Development of nanoscale Ti/Al multilayer films with 1:1, 1:2 and 1:3 molar ratios. • Characterization of exothermic reaction propagation by experiments and simulation. • The reaction velocity depends on the ignition potentials and molar ratios of the films. • Only 1Ti/3Al films exhibit the unsteady reaction propagation with ripple formation. • CFD simulation shows the time dependent atom mixing and temperature flow during exothermic reaction. - Abstract: This study describes the self-propagating exothermic reaction in Ti/Al reactive multilayer foils by using experiments and computational fluid dynamics simulation. The Ti/Al foils with different molar ratios of 1Ti/1Al, 1Ti/2Al and 1Ti/3Al were fabricated by magnetron sputtering method. Microstructural characteristics of the unreacted and reacted foils were analyzed by using electronic and atomic force microscopes. After an electrical ignition, the influence of ignition potentials on reaction propagation has been experimentally investigated. The reaction front propagates with a velocity of minimum 0.68 ± 0.4 m/s and maximum 2.57 ± 0.6 m/s depending on the input ignition potentials and the chemical compositions. Here, the 1Ti/3Al reactive foil exhibits both steady state and unsteady wavelike reaction propagation. Moreover, the numerical computational fluid dynamics (CFD) simulation shows the time dependent temperature flow and atomic mixing in a nanoscale reaction zone. The CFD simulation also indicates the potentiality for simulating exothermic reaction in the nanoscale Ti/Al foil.

Study on Exothermic Oxidation of Acrylonitrile-butadiene-styrene (ABS Resin Powder with Application to ABS Processing Safety

Directory of Open Access Journals (Sweden)

Jenq-Renn Chen

2010-08-01

Full Text Available Oxidative degradation of commercial grade ABS (Acrylonitrile-butadiene-styrene resin powders was studied by thermal analysis. The instabilities of ABS containing different polybutadiene (PB contents with respect to temperature were studied by Differential Scanning Calorimeter (DSC. Thermograms of isothermal test and dynamic scanning were performed. Three exothermic peaks were observed and related to auto-oxidation, degradation and oxidative decomposition, respectively. Onset temperature of the auto-oxidation was determined to be around 193 °C. However, threshold temperature of oxidation was found to be as low as 140 °C by DSC isothermal testing. Another scan of the powder after degeneration in air showed an onset temperature of 127 °C. Reactive hazards of ABS powders were verified to be the exothermic oxidation of unsaturated PB domains, not the SAN (poly(styrene-acrylonitrile matrix. Heat of oxidation was first determined to be 2,800 ± 40 J per gram of ABS or 4,720 ± 20 J per gram of PB. Thermal hazards of processing ABS powder are assessed by adiabatic temperature rise at process conditions. IR spectroscopy associated with heat of oxidation verified the oxidative mechanism, and these evidences excluded the heat source from the degradation of SAN. A specially prepared powder of ABS without adding anti-oxidant was analyzed by DSC for comparing the exothermic behaviors. Exothermic onset temperatures were determined to be 120 °C and 80 °C by dynamic scanning and isothermal test, respectively. The assessment successfully explained fires and explosions in an ABS powder dryer and an ABS extruder.

Thermal oxidation of cesium loaded Prussian blue as a precaution for exothermic phase change in extreme conditions

International Nuclear Information System (INIS)

Parajuli, Durga; Tanaka, Hisashi; Takahashi, Akira; Kawamoto, Tohru

2013-01-01

Cesium adsorbed Prussian blue is studied for the thermal oxidation. The TG-DTA shows exothermic phase change of micro aggregates of nano-PB at above 270°C. For this reason, Cs loaded PB was heated between 180 to 260°C. Heating at 180 removed only the water. Neither the oxidation of Iron nor the removal of cyanide is observed at this temperature. Oxidation of cyanide is observed upon heating above 200°C while loaded Cs is released after heating at >250°C followed by washing with water. Thermal oxidation between 200 to 220°C for more than 2 h showed control on exothermic phase change and loaded Cs is also not solubilized. (author)

A randomized trial of exothermic mattresses for preterm newborns in polyethylene bags.

LENUS (Irish Health Repository)

McCarthy, Lisa K

2013-07-01

Hypothermia on admission to the NICU is associated with increased mortality in preterm infants. Many newborns are hypothermic on admission despite using polyethylene bags (PBs). Using exothermic mattresses (EMs) in addition to PBs may reduce hypothermia but increase hyperthermia. We wished to determine whether placing preterm newborns in PBs on EMs in the DR results in more infants with rectal temperature outside the range 36.5 to 37.5°C on NICU admission.

Warming preterm infants in the delivery room: polyethylene bags, exothermic mattresses or both?

Science.gov (United States)

McCarthy, Lisa K; O'Donnell, Colm P F

2011-12-01

To compare the admission temperature of infants treated with polyethylene bags alone to infants treated with exothermic mattresses in addition to bags in the delivery room. We prospectively studied infants born at bags at birth. Some infants were also placed on mattresses. Admission axillary temperatures were measured in all infants on admission to the neonatal intensive care. We compared the temperatures of infants treated with bags alone to those treated with mattresses and bags. We studied 43 infants: 15 were treated with bags while 28 were treated with a bag and mattress. Mean admission temperature was similar between the groups. Hypothermia and hyperthermia occurred more frequently in infants treated with a bag and mattress, and more infants treated with a bag had admission temperatures 36.5-37.5°C. The use of exothermic mattresses in addition to polyethylene bags, particularly in younger, smaller newborns, may result in more hypothermia and hyperthermia on admission. A randomised controlled trial is necessary to determine which strategy results in more infants having admission temperatures in the normal range. © 2011 The Author(s)/Acta Paediatrica © 2011 Foundation Acta Paediatrica.

Evaluation of the exothermicity of the chemi-ionization reaction Sm + O → SmO+ + e−

International Nuclear Information System (INIS)

Cox, Richard M; Kim, JungSoo; Armentrout, P. B.; Bartlett, Joshua; VanGundy, Robert A.; Heaven, Michael C.; Ard, Shaun G.; Shuman, Nicholas S.; Viggiano, Albert A.; Melko, Joshua J.

2015-01-01

The exothermicity of the chemi-ionization reaction Sm + O → SmO + + e − has been re-evaluated through the combination of several experimental methods. The thermal reactivity (300–650 K) of Sm + and SmO + with a range of species measured using a selected ion flow tube-mass spectrometer apparatus is reported and provides limits for the bond strength of SmO + , 5.661 eV ≤ D 0 (Sm + -O) ≤ 6.500 eV. A more precise value is measured to be 5.72 5 ± 0.07 eV, bracketed by the observed reactivity of Sm + and SmO + with several species using a guided ion beam tandem mass spectrometer (GIBMS). Combined with the established Sm ionization energy (IE), this value indicates an exothermicity of the title reaction of 0.08 ± 0.07 eV, ∼0.2 eV smaller than previous determinations. In addition, the ionization energy of SmO has been measured by resonantly enhanced two-photon ionization and pulsed-field ionization zero kinetic energy photoelectron spectroscopy to be 5.7427 ± 0.0006 eV, significantly higher than the literature value. Combined with literature bond energies of SmO, this value indicates an exothermicity of the title reaction of 0.14 ± 0.17 eV, independent from and in agreement with the GIBMS result presented here. The evaluated thermochemistry also suggests that D 0 (SmO) = 5.83 ± 0.07 eV, consistent with but more precise than the literature values. Implications of these results for interpretation of chemical release experiments in the thermosphere are discussed

Instrument-free exothermic heating with phase change temperature control for paper microfluidic devices

Science.gov (United States)

Singleton, Jered; Zentner, Chris; Buser, Josh; Yager, Paul; LaBarre, Paul; Weigl, Bernhard H.

2013-03-01

Many infectious diseases, as well as some cancers, that affect global health are most accurately diagnosed through nucleic acid amplification and detection. There is a great need to simplify nucleic acid-based assay systems for use in global health in low-resource settings as well as in settings that do not have convenient access to laboratory staff and equipment such as doctors' offices and home care settings. In developing countries, unreliable electric power, inadequate supply chains, and lack of maintenance for complex diagnostic instruments are all common infrastructure shortfalls. Many elements of instrument-free, disposable, nucleic acid amplification assays have been demonstrated in recent years. However, the problem of instrument-free,1 low-cost, temperature-controlled chemical heating remains unsolved. In this paper we present the current status and results of work towards developing disposable, low-cost, temperature-controlled heaters designed to support isothermal nucleic acid amplification assays that are integrated with a two-dimensional paper network. Our approach utilizes the heat generated through exothermic chemical reactions and controls the heat through use of engineered phase change materials to enable sustained temperatures required for nucleic acid amplification. By selecting appropriate exothermic and phase change materials, temperatures can be controlled over a wide range, suitable for various isothermal amplification methods, and maintained for over an hour at an accuracy of +/- 1°C.

Using Different Conceptual Change Methods Embedded within 5E Model: A Sample Teaching of Endothermic-Exothermic Reactions

Science.gov (United States)

Turk, Fatma; Calik, Muammer

2008-01-01

Since Widodo, Duit and Muller (2002) addressed that there is a gap between teacher's theoretical knowledge and their practical classroom constructivist behavior, we presented a sample teaching activity about Endothermic-Exothermic Reactions for teacher usage. Therein, the aim of this study is to design a 5E model to include students' alternative…

Conditioning of radioactive ash residue in a wave of solid-phase exothermal reactions

International Nuclear Information System (INIS)

Karlina, O.K.; Varlakova, G.A.; Ozhovan, M.I.; Tivanskij, V.M.; Dmitriev, S.A.

2001-01-01

The abilities for utilization of exothermic reaction heat in solid phase for conditioning the ash residue produced as a result of solid radioactive waste burning are analyzed. It is shown that the process of ash residue making monolithic with obtaining the glass-like finish product containing 50-60 mass % of ash residue which meets the requirements for solidified radioactive wastes may be realized without energy supplying from external heat sources. The conditioning is realized in a special crucible furnace-container designed not only for the process conducting but also for subsequent storage or disposal of the finish product [ru

Experiments on the behaviour of thermite melt injected into sodium: Final report on the THINA test results

International Nuclear Information System (INIS)

Huber, F.; Kaiser, A.; Peppler, W.

1994-01-01

During hypothetical accidents of fast breeder reactors the core melts and part of the core material inventory is ejected into the upper coolant plenum. As a consequence, a fuel to coolant thermal interaction occurs between the melt and the sodium. A series of simulating experiments was carried out in KfK/IRS to improve the knowledge about the phenomenology of molten fuel/coolant interactions and to support theoretical work on the safety of fast breeder reactors. In the tests, a thermite melt of up to 3270 K is injected from below into a sodium pool the temperature of which is between 770 and 820 K. The masses of the melt and the sodium are about five and 150 kg, respectively. Thermal interactions have been observed to occur as a sequence of small local pressure events mainly during the melt injection. Large-scale vapour explosions have not been observed. Generally, the conversion ratios of thermal to mechanical energy have been low. (author)

Effect of the exothermal polymerization reaction on polymer gel dosimetric measurements

International Nuclear Information System (INIS)

Sedaghat, Mahbod; Bujold, Rachel; Lepage, Martin

2010-01-01

Discrepancies in polymer gel dosimetric measurements have been observed between containers of different sizes receiving the same radiation dose. We hypothesized that these deviations are caused by a change in the rate of polymerization due to internal heat increase in the gel containers resulting from the exothermic polymerization of monomers. Here, we test this hypothesis in a polyacrylamide gel dosimeter by recording the temperature in glass phantoms of different sizes during and after irradiation. The dose response of the samples was determined with magnetic resonance imaging. The difference of R 2 values along the depth of the containers was below ±1%. We discuss that this small difference can be attributed to variations in the rate of gelatin cooling during manufacture rather than to the measured heat increase during irradiation.

Study of the U3O8-Al thermite reaction and strength of reactor fuel tubes

International Nuclear Information System (INIS)

Peacock, H.B.

1983-08-01

Heating tests using 53 wt % U 3 O 8 -Al pellets show that an exothermic reaction occurs between 875 and 1000 0 C and takes 10 to 20 seconds to reach maximum temperature. The maximum temperature is a function of particle size of the U 3 O 8 with large particles exhibiting lower peak temperatures. The calculated energy release was 123 cal/g of U 3 O 8 -aluminum fuel. Tests using aluminum clad outer fuel tube sections gave lower peak temperatures than for pellets. No violent reactions occurred. The results are reasonably consistent with recent reported data indicating that the exothermic U 3 O 8 -Al reaction is not an important energy source. The compressive and tensile strengths of U 3 O 8 tubes above 660 0 C are low. In compression, sections with 2 psi average axial stress failed at 917 0 C, while sections with 7 psi failed at 669 0 C. Tubes with U-Al alloy cores failed at about 670 0 C with no applied load. The stresses in fuel tubes during a reactor transient may range up to several hundred psi and are less than 7 psi only in the upper part of the fuel tube

Inverted dipole feature in directional detection of exothermic dark matter

International Nuclear Information System (INIS)

Bozorgnia, Nassim; Gelmini, Graciela B.; Gondolo, Paolo

2017-01-01

Directional dark matter detection attempts to measure the direction of motion of nuclei recoiling after having interacted with dark matter particles in the halo of our Galaxy. Due to Earth's motion with respect to the Galaxy, the dark matter flux is concentrated around a preferential direction. An anisotropy in the recoil direction rate is expected as an unmistakable signature of dark matter. The average nuclear recoil direction is expected to coincide with the average direction of dark matter particles arriving to Earth. Here we point out that for a particular type of dark matter, inelastic exothermic dark matter, the mean recoil direction as well as a secondary feature, a ring of maximum recoil rate around the mean recoil direction, could instead be opposite to the average dark matter arrival direction. Thus, the detection of an average nuclear recoil direction opposite to the usually expected direction would constitute a spectacular experimental confirmation of this type of dark matter.

Low-cost high purity production

Science.gov (United States)

Kapur, V. K.

1978-01-01

Economical process produces high-purity silicon crystals suitable for use in solar cells. Reaction is strongly exothermic and can be initiated at relatively low temperature, making it potentially suitable for development into low-cost commercial process. Important advantages include exothermic character and comparatively low process temperatures. These could lead to significant savings in equipment and energy costs.

Tensile strength of AK7 alloy after treatment by exothermic mixtures

International Nuclear Information System (INIS)

Lipinski, T.

2002-01-01

The paper presents the influence of treatment by chemical compounds giving exothermic effect on the tensile strength of AK7 alloy. The research was carried out on 1100 g of the alloy in classical mould. The chemical mixture was composed of Na 2 B 4 O 7 , NaNO 3 and Cr 2 O 3 + AlNi. The studies were conducted following a mathematical experiment plan. The action of Borax was free from interference whereas the two residual constituents were mass-dependence. Excess NaNO 3 was caused by the reduction of the value of the tensile strength. Cr 2 O 3 + AlNi strengthened the influence of NaNO 3 . It was found that the blending of Na 2 B 4 O 7 and NaNO 3 on weight ratio 1,5 to 1 and of NaNO 3 and Cr 2 O 3 + AlNi on weight ratio 1 to 3 improved the tensile strength of the AK7 alloy after treatment. (author)

Novel Direct Steelmaking by Combining Microwave, Electric Arc, and Exothermal Heating Technologies

Energy Technology Data Exchange (ETDEWEB)

Dr. Xiaodi Huang; Dr. J. Y. Hwang

2005-03-28

Steel is a basic material broadly used by perhaps every industry and individual. It is critical to our nation's economy and national security. Unfortunately, the American steel industry is losing competitiveness in the world steel production field. There is an urgent need to develop the next generation of steelmaking technology for the American steel industry. Direct steelmaking through the combination of microwave, electric arc, and exothermal heating is a revolutionary change from current steelmaking technology. This technology can produce molten steel directly from a shippable agglomerate, consisting of iron oxide fines, powdered coal, and ground limestone. This technology is projected to eliminate many current intermediate steelmaking steps including coking, pellet sintering, blast furnace (BF) ironmaking, and basic oxygen furnace (BOF) steelmaking. This technology has the potential to (a) save up to 45% of the energy consumed by conventional steelmaking; (b) dramatically reduce the emission of CO{sub 2}, SO{sub 2}, NO{sub x}, VOCs, fine particulates, and air toxics; (c) substantially reduce waste and emission control costs; (d) greatly lower capital cost; and (e) considerably reduce steel production costs. This technology is based on the unique capability of microwaves to rapidly heat steelmaking raw materials to elevated temperature, then rapidly reduce iron oxides to metal by volumetric heating. Microwave heating, augmented with electric arc and exothermal reactions, is capable of producing molten steel. This technology has the components necessary to establish the ''future'' domestic steel industry as a technology leader with a strong economically competitive position in world markets. The project goals were to assess the utilization of a new steelmaking technology for its potential to achieve better overall energy efficiency, minimize pollutants and wastes, lower capital and operating costs, and increase the competitiveness of the

The influence of exothermic reactions on the nonequilibrium level of discharge plasma

International Nuclear Information System (INIS)

Chernyak, V.Ya.; Iukhymenko, V.V.; Prysiazhnevych, I.V.; Martysh, Eu.V.

2013-01-01

The comparative analysis of plasma parameters of transverse arc and discharge in the gas channel with liquid wall was made for different working gas and liquids (for air, distilled water and for its mixtures with ethanol). Electronic excitation temperatures Te of atoms, vibrational Tv and rotational Tr temperatures of molecules in the generated plasma were determined by optical emission spectroscopy. It was shown that both discharges generate nonequilibrium plasma in the case of working gas air and working liquid-distilled water. Adding a fuel (ethanol) into the plasma system with O 2 leads to the increasing of rotational and vibrational temperatures of molecules, which became equal to each other within the errors. This may indicate that the exothermic reactions reduce the level of nonthermality of the generated plasma as a result of additional energy supply for heavy components in the process of complete combustion of hydrocarbons.

Boundary-layer development and transition due to free-stream exothermic reactions in shock-induced flows

Science.gov (United States)

Hall, J. L.

1974-01-01

A study of the effect of free-stream thermal-energy release from shock-induced exothermic reactions on boundary-layer development and transition is presented. The flow model is that of a boundary layer developing behind a moving shock wave in two-dimensional unsteady flow over a shock-tube wall. Matched sets of combustible hydrogen-oxygen-nitrogen mixtures and inert hydrogen-nitrogen mixtures were used to obtain transition data over a range of transition Reynolds numbers from 1,100,000 to 21,300,000. The heat-energy is shown to significantly stabilize the boundary layer without changing its development character. A method for application of this data to flat-plate steady flows is included.

Exothermic or Endothermic Decomposition of Disubstituted Tetrazoles Tuned by Substitution Fashion and Substituents.

Science.gov (United States)

Jia, Yu-Hui; Yang, Kai-Xiang; Chen, Shi-Lu; Huang, Mu-Hua

2018-01-11

Nitrogen-rich compounds such as tetrazoles are widely used as candidates in gas-generating agents. However, the details of the differentiation of the two isomers of disubstituted tetrazoles are rarely studied, which is very important information for designing advanced materials based on tetrazoles. In this article, pairs of 2,5- and 1,5-disubstituted tetrazoles were carefully designed and prepared for study on their thermal decomposition behavior. Also, the substitution fashion of 2,5- and 1,5- and the substituents at C-5 position were found to affect the endothermic or exothermic properties. This is for the first time to the best of our knowledge that the thermal decomposition properties of different tetrazoles could be tuned by substitution ways and substitute groups, which could be used as a useful platform to design advanced materials for temperature-dependent rockets. The aza-Claisen rearrangement was proposed to understand the endothermic decomposition behavior.

Evaluation of alternatives of exothermic methanization cycle for combined electricity and heat generation

International Nuclear Information System (INIS)

Balajka, J.; Princova, H.

1987-01-01

The possibilities are discussed of using the ADAM-EVA system for remote heat supply from nuclear heat sources to district heating systems. Attention is devoted to the use of the exothermal methanization process (ADAM station) for the combined power and heat production, this making use of the existing hot water power distribution network. The basic parameter for the evaluation of the over-all efficiency of the combined power and heat production is the maximum methanization cycle temperature which depends on the life of the methanization catalyst. Upon temperature drop below 550 degC, the conversion process can only be secured by means of two-stage methanization, which leads to a simplification of the cycle and a reduction in investment cost. At a temperature lower than 500 degC, combined power and heat production cannot be implemented. On the contrary, a considerable amount of electric power supplied from outside the system would be needed for compression work. (Z.M.)

Long term aging of selenide glasses: evidence of sub-Tg endotherms and pre-Tg exotherms

Science.gov (United States)

Chen, Ping; Boolchand, P.; Georgiev, D. G.

2010-02-01

Long term aging, extending from months to several years, is studied on several families of chalcogenide glasses including the Ge-Se, As-Se, and Ge-As-Se systems. Special attention is given to the As-Se binary, a system that displays a rich variety of aging behavior intimately tied to sample synthesis conditions and the ambient environment in which samples are aged. Calorimetric (modulated DSC) and Raman scattering experiments are undertaken. Our results show all samples display a sub-Tg endotherm typically 10-70 °C below Tg in glassy networks possessing a mean coordination number r in the 2.25 < r < 2.45 range. Two sets of AsxSe100-x samples aged for eight years were compared, set A consisted of slow cooled samples aged in the dark, and set B consisted of melt-quenched samples aged at laboratory environment. Samples of set B in the As concentration range, 35% < x < 60%, display a pre-Tg exotherm, but the feature is not observed in samples of set A. The aging behavior of set A presumably represents intrinsic aging in these glasses, while that of set B is extrinsic due to the presence of light. The reversibility window persists in both sets of samples, but is less well defined in set B. These findings contrast with a recent study by Golovchak et al (2008 Phys. Rev. B 78 014202), which finds the onset of the reversibility window moved up to the stoichiometric composition (x = 40%). Here we show that the up-shifted window is better understood as resulting due to demixing of As4Se4 and As4Se3 molecules from the backbone, i.e., nanoscale phase separation (NSPS). We attribute sub-Tg endotherms to compaction of the flexible part of the networks upon long term aging, while the pre-Tg exotherm is to NSPS. The narrowing and sharpening of the reversibility window upon aging is interpreted as the slow 'self-organizing' stress relaxation of the phases just outside the intermediate phase, which itself is stress free and displays little aging.

Non-thermal desorption from interstellar dust grains via exothermic surface reactions

Science.gov (United States)

Garrod, R. T.; Wakelam, V.; Herbst, E.

2007-06-01

Aims:The gas-phase abundance of methanol in dark quiescent cores in the interstellar medium cannot be explained by gas-phase chemistry. In fact, the only possible synthesis of this species appears to be production on the surfaces of dust grains followed by desorption into the gas. Yet, evaporation is inefficient for heavy molecules such as methanol at the typical temperature of 10 K. It is necessary then to consider non-thermal mechanisms for desorption. But, if such mechanisms are considered for the production of methanol, they must be considered for all surface species. Methods: Our gas-grain network of reactions has been altered by the inclusion of a non-thermal desorption mechanism in which the exothermicity of surface addition reactions is utilized to break the bond between the product species and the surface. Our estimated rate for this process derives from a simple version of classical unimolecular rate theory with a variable parameter only loosely constrained by theoretical work. Results: Our results show that the chemistry of dark clouds is altered slightly at times up to 106 yr, mainly by the enhancement in the gas-phase abundances of hydrogen-rich species such as methanol that are formed on grain surfaces. At later times, however, there is a rather strong change. Instead of the continuing accretion of most gas-phase species onto dust particles, a steady-state is reached for both gas-phase and grain-surface species, with significant abundances for the former. Nevertheless, most of the carbon is contained in an undetermined assortment of heavy surface hydrocarbons. Conclusions: The desorption mechanism discussed here will be better constrained by observational data on pre-stellar cores, where a significant accretion of species such as CO has already occurred.

Linear friction welding for constructing and repairing rail for high speed and intercity passenger service rail : final report.

Science.gov (United States)

2016-08-01

This project developed a solid-state welding process based on linear friction welding (LFW) technology. While resistance flash welding or : thermite techniques are tried and true methods for joining rails and performing partial rail replacement repai...

Simultaneous fingering, double-diffusive convection, and thermal plumes derived from autocatalytic exothermic reaction fronts

Science.gov (United States)

Eskew, Matthew W.; Harrison, Jason; Simoyi, Reuben H.

2016-11-01

Oxidation reactions of thiourea by chlorite in a Hele-Shaw cell are excitable, autocatalytic, exothermic, and generate a lateral instability upon being triggered by the autocatalyst. Reagent concentrations used to develop convective instabilities delivered a temperature jump at the wave front of 2.1 K. The reaction zone was 2 mm and due to normal cooling after the wave front, this generated a spike rather than the standard well-studied front propagation. The reaction front has solutal and thermal contributions to density changes that act in opposite directions due to the existence of a positive isothermal density change in the reaction. The competition between these effects generates thermal plumes. The fascinating feature of this system is the coexistence of plumes and fingering in the same solution which alternate in frequency as the front propagates, generating hot and cold spots within the Hele-Shaw cell, and subsequently spatiotemporal inhomogeneities. The small ΔT at the wave front generated thermocapillary convection which competed effectively with thermogravitational forces at low Eötvös Numbers. A simplified reaction-diffusion-convection model was derived for the system. Plume formation is heavily dependent on boundary effects from the cell dimensions. This work was supported by Grant No. CHE-1056366 from the NSF and a Research Professor Grant from the University of KwaZulu-Natal.

Self-sustained high-temperature reactions : Initiation, propagation and synthesis

NARCIS (Netherlands)

Martinez Pacheco, M.

2007-01-01

Self-Propagating High-Temperature Synthesis (SHS), also called combustion synthesis is an exothermic and self-sustained reaction between the constituents, which has assumed significance for the production of ceramics and ceramic-metallic materials (cermets), because it is a very rapid processing

In situ generation of steam and alkaline surfactant for enhanced oil recovery using an exothermic water reactant (EWR)

Science.gov (United States)

Robertson, Eric P

2011-05-24

A method for oil recovery whereby an exothermic water reactant (EWR) encapsulated in a water soluble coating is placed in water and pumped into one or more oil wells in contact with an oil bearing formation. After the water carries the EWR to the bottom of the injection well, the water soluble coating dissolves and the EWR reacts with the water to produce heat, an alkali solution, and hydrogen. The heat from the EWR reaction generates steam, which is forced into the oil bearing formation where it condenses and transfers heat to the oil, elevating its temperature and decreasing the viscosity of the oil. The aqueous alkali solution mixes with the oil in the oil bearing formation and forms a surfactant that reduces the interfacial tension between the oil and water. The hydrogen may be used to react with the oil at these elevated temperatures to form lighter molecules, thus upgrading to a certain extent the oil in situ. As a result, the oil can flow more efficiently and easily through the oil bearing formation towards and into one or more production wells.

1D/2D analyses of the lower head vessel in contact with high temperature melt

International Nuclear Information System (INIS)

Chang, Jong Eun; Cho, Jae Seon; Suh, Kune Y.; Chung, Chang H.

1998-01-01

One- and two-dimensional analyses were performed for the ceramic/metal melt and the vessel to interpret the temperature history of the outer surface of the vessel wall measured from typical Al 2 O 3 /Fe thermite melt tests LAVA (Lower-plenum Arrested Vessel Attack) spanning heatup and cooldown periods. The LAVA tests were conducted at the Korea Atomic Energy Research Institute (KAERI) during the process of high temperature molten material relocation from the delivery duct down into the water in the test vessel pressurized to 2.0 MPa. Both analyses demonstrated reasonable predictions of the temperature history of the LHV (Lower Head Vessel). The comparison sheds light on the thermal hydraulic and material behavior of the high temperature melt within the hemispherical vessel

Integrated chemical process for exothermic wave synthesis of high luminance YAG:Ce phosphors

International Nuclear Information System (INIS)

Won, C.W.; Nersisyan, H.H.; Won, H.I.; Youn, J.W.

2011-01-01

In this paper, high-luminance yellow-emitting Y 3 Al 5 O 12 :Ce 3+ phosphor (YAG:Ce) microparticles were prepared in a solid flame using a 1.425Y 2 O 3 +2.5Al 2 O 3 +0.15CeO 2 +k(KClO 3 +urea)+mNH 4 F precursor mixture (here k is the number of moles of the KClO 3 +urea red-ox mixture, and m is the number of moles of NH 4 F). The self-sustaining combustion process for the entire reaction sample was provided by the heat generated from the KClO 3 +urea mixture. Parametric studies demonstrated that the maximum temperature in the combustion wave varied from 885 to 1200 deg. C for k=2.0-3.0 mole and m=0-1.5 mole. X-ray analysis results showed that the product obtained in the solid flame consisted of Y 3 Al 5 O 12 :Ce 3+ and KCl phases. Therefore, after dissolving potassium chloride in distillated water, pure-phase YAG:Ce phosphor powder was obtained. The as-prepared YAG:Ce phosphor particles had diameters of 10-25 μm and good dispersity and exhibited luminescence properties comparable to those of YAG:Ce phosphor powders prepared by conventional high-temperature processing. - Highlights: → A new solid-flame strategy was developed for synthesizing high-luminance YAG:Ce phosphor. → Adding KClO 3 +CO(NH 2 ) 2 +NH 4 F mixture to oxide powders provides a low-temperature combustion process. → YAG:Ce phosphor particles 10-25 μm in diameter were obtained at 1000-1100 deg. C within tens of seconds. → As-prepared YAG:Ce emission intensity was 90.1-103.2% compared to that of the reference sample.

Investigation of the physical and numerical foundations of two-fluid representation of sodium boiling with applications to LMFBR experiments

International Nuclear Information System (INIS)

No, H.C.; Kazimi, M.S.

1983-03-01

This work involves the development of physical models for the constitutive relations of a two-fluid, three-dimensional sodium boiling code, THERMIT-6S. The code is equipped with a fluid conduction model, a fuel pin model, and a subassembly wall model suitable for stimulating LMFBR transient events. Mathematically rigorous derivations of time-volume averaged conservation equations are used to establish the differential equations of THERMIT-6S. These equations are then discretized in a manner identical to the original THERMIT code. A virtual mass term is incorporated in THERMIT-6S to solve the ill-posed problem. Based on a simplified flow regime, namely cocurrent annular flow, constitutive relations for two-phase flow of sodium are derived. The wall heat transfer coefficient is based on momentum-heat transfer analogy and a logarithmic law for liquid film velocity distribution. A broad literature review is given for two-phase friction factors. It is concluded that entrainment can account for some of the discrepancies in the literature. Mass and energy exchanges are modelled by generalization of the turbulent flux concept. Interfacial drag coefficients are derived for annular flows with entrainment. Code assessment is performed by simulating three experiments for low flow-high power accidents and one experiment for low flow/low power accidents in the LMFBR. While the numerical results for pre-dryout are in good agreement with the data, those for post-dryout reveal the need for improvement of the physical models. The benefits of two-dimensional non-equilibrium representation of sodium boiling are studied

An experimental study of steam explosions involving CORIUM melts

International Nuclear Information System (INIS)

Millington, R.A.

1984-05-01

An experimental programme to investigate molten fuel coolant interactions involving 0.5 kg thermite-generated CORIUM melts and water has been carried out. System pressures and initial coolant subcoolings were chosen to enhance the probability of steam explosions. Yields and efficiencies of the interactions were found to be very close to those obtained from similar experiments using molten UO 2 generated from a Uranium/Molybdenum Trioxide thermite. (author)

3D Defect Localization on Exothermic Faults within Multi-Layered Structures Using Lock-In Thermography: An Experimental and Numerical Approach.

Science.gov (United States)

Bae, Ji Yong; Lee, Kye-Sung; Hur, Hwan; Nam, Ki-Hwan; Hong, Suk-Ju; Lee, Ah-Yeong; Chang, Ki Soo; Kim, Geon-Hee; Kim, Ghiseok

2017-10-13

Micro-electronic devices are increasingly incorporating miniature multi-layered integrated architectures. However, the localization of faults in three-dimensional structure remains challenging. This study involved the experimental and numerical estimation of the depth of a thermally active heating source buried in multi-layered silicon wafer architecture by using both phase information from an infrared microscopy and finite element simulation. Infrared images were acquired and real-time processed by a lock-in method. It is well known that the lock-in method can increasingly improve detection performance by enhancing the spatial and thermal resolution of measurements. Operational principle of the lock-in method is discussed, and it is represented that phase shift of the thermal emission from a silicon wafer stacked heat source chip (SSHSC) specimen can provide good metrics for the depth of the heat source buried in SSHSCs. Depth was also estimated by analyzing the transient thermal responses using the coupled electro-thermal simulations. Furthermore, the effects of the volumetric heat source configuration mimicking the 3D through silicon via integration package were investigated. Both the infrared microscopic imaging with the lock-in method and FE simulation were potentially useful for 3D isolation of exothermic faults and their depth estimation for multi-layered structures, especially in packaged semiconductors.

Immobilization of simulated radioactive soil waste containing cerium by self-propagating high-temperature synthesis

International Nuclear Information System (INIS)

Mao, Xianhe; Qin, Zhigui; Yuan, Xiaoning; Wang, Chunming; Cai, Xinan; Zhao, Weixia; Zhao, Kang; Yang, Ping; Fan, Xiaoling

2013-01-01

A simulated radioactive soil waste containing cerium as an imitator element has been immobilized by a thermite self-propagating high-temperature synthesis (SHS) process. The compositions, structures, and element leaching rates of products with different cerium contents have been characterized. To investigate the influence of iron on the chemical stability of the immobilized products, leaching tests of samples with different iron contents with different leaching solutions were carried out. The results showed that the imitator element cerium mainly forms the crystalline phases CeAl 11 O 18 and Ce 2 SiO 5 . The leaching rate of cerium over a period of 28 days was 10 −5 –10 −6 g/(m 2 day). Iron in the reactants, the reaction products, and the environment has no significant effect on the chemical stability of the immobilized SHS products

Immobilization of simulated radioactive soil waste containing cerium by self-propagating high-temperature synthesis

Science.gov (United States)

Mao, Xianhe; Qin, Zhigui; Yuan, Xiaoning; Wang, Chunming; Cai, Xinan; Zhao, Weixia; Zhao, Kang; Yang, Ping; Fan, Xiaoling

2013-11-01

A simulated radioactive soil waste containing cerium as an imitator element has been immobilized by a thermite self-propagating high-temperature synthesis (SHS) process. The compositions, structures, and element leaching rates of products with different cerium contents have been characterized. To investigate the influence of iron on the chemical stability of the immobilized products, leaching tests of samples with different iron contents with different leaching solutions were carried out. The results showed that the imitator element cerium mainly forms the crystalline phases CeAl11O18 and Ce2SiO5. The leaching rate of cerium over a period of 28 days was 10-5-10-6 g/(m2 day). Iron in the reactants, the reaction products, and the environment has no significant effect on the chemical stability of the immobilized SHS products.

Abuse behavior of high-power, lithium-ion cells

Science.gov (United States)

Spotnitz, R.; Franklin, J.

Published accounts of abuse testing of lithium-ion cells and components are summarized, including modeling work. From this summary, a set of exothermic reactions is selected with corresponding estimates of heats of reaction. Using this set of reactions, along with estimated kinetic parameters and designs for high-rate batteries, models for the abuse behavior (oven, short-circuit, overcharge, nail, crush) are developed. Finally, the models are used to determine that fluorinated binder plays a relatively unimportant role in thermal runaway.

Feeding Against Gravity with Spot Feeders in High Silicon Ductile Iron

DEFF Research Database (Denmark)

Vedel-Smith, Nikolaj Kjelgaard; Tiedje, Niels Skat

2014-01-01

and classified using X-ray imaging and ultrasound analysis. The effect of the different feeder configurations were classified in reference to defect location, sleeve material, and feeder type, modulus, and location. The analysis showed that exothermal feeder sleeves with the right configurations can feed up......-hill against gravity. This effect may contribute to the thermal expansion created by the exothermal reaction. It was also found that the optimum feeder size does not scale linearly with the casting modulus but that larger casting modulus requires relatively smaller modulus feeders. The thermal gradient created...

KATS experiments to simulate corium spreading in the EPR core catcher concept

International Nuclear Information System (INIS)

Eppinger, B.; Fieg, G.; Schuetz, W.; Stegmaier, U.

2001-01-01

In future Light Water Reactors special devices (core catchers) might be required to prevent containment failure by basement erosion after reactor pressure vessel melt-through during a core meltdown accident. Quick freezing of the molten core masses is desirable to reduce release of radioactivity. Several concepts of core catcher de-vices have been proposed based on the spreading of corium melt onto flat surfaces with subsequent cooling by flooding with water. Therefore a series of experiments to investigate high temperature melt spreading on flat surfaces has been carried out using alumina-iron thermite melts as a simulant. The oxidic thermite melt is conditioned by adding other oxides to simulate a realistic corium melt as close as possible. Spreading of oxidic and metallic melts have been performed in one- and two-dimensional geometry. Substrates were chemically inert ceramic layers, dry concrete and concrete with a shallow water layer on top. (authors)

Microstructure and wear resistance of Al2O3-M7C3/Fe composite coatings produced by laser controlled reactive synthesis

Science.gov (United States)

Tan, Hui; Luo, Zhen; Li, Yang; Yan, Fuyu; Duan, Rui

2015-05-01

Based on the principle of thermite reaction of Al and Fe2O3 powders, the Al2O3 ceramic reinforced Fe-based composite coatings were fabricated on a steel substrate by laser controlled reactive synthesis and cladding. The effects of different additions of thermite reactants on the phase transition, microstructure evolution, microhardness and wear resistance of the composite coatings were investigated by means of X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), Vickers microhardness and block-on-ring wear test, respectively. The results show that Al2O3 ceramic and M7C3 carbide are in situ synthesized via the laser controlled reactive synthesis. The Al2O3 ceramic and M7C3 carbides prefer to distribute along the γ-Fe phase boundary continuously, which separates the γ-Fe matrix and is beneficial to the grain refinement. With the increase of thermite reactants, the amount of Al2O3 ceramic and M7C3 carbide in the composite coatings increases gradually. Moreover the cladding layer changes from dendritic structure to columnar structure and martensite structure in the heat affected zone becomes coarse. The increased thermite reactants improve the microhardness and wear resistance of the in situ composite coatings obviously and enhance the hardness of the heat affected zone, which should be ascribed to the grain refinement, ceramic and carbide precipitation and solid solution strengthening.

Simulationsexperimente zum Ausbreitungsverhalten von Kernschmelzen: KATS-8 bis KATS-17

International Nuclear Information System (INIS)

Eppinger, B; Fieg, G.; Massier, H.; Schuetz, W.; Stegmaier, U.; Stern, G.

2001-03-01

In future Light Water Reactors special devices (core catchers) might be required to prevent containment failure by basement erosion after reactor pressure vessel meltthrough during a core meltdown accident. Quick freezing of the molten core masses is desirable to reduce release of radioactivity. Several concepts of core catcher devices have been proposed based on the spreading of corium melt onto flat surfaces with subsequent water cooling. Therefore, a series of experiments to investigate high temperature melt spreading on flat surfaces has been carried out using alumina-iron thermite melts as a simulant. The oxidic thermite melt is conditioned by adding other oxides to simulate a realistic corium melt as close as possible. Spreading of oxidic and metallic melts have been performed in one- and two-dimensional geometry. Substrates were inert ceramical layer, dry concrete and concrete with a water layer of several millimeters. The influence of a shallow water layer on the surface onto the spreading behaviour has also been studied. (orig.) [de

Simulation experiment on the flooding behaviour of core melts: KATS-9

International Nuclear Information System (INIS)

Fieg, G.; Massier, H.; Schuetz, W.; Stegmaier, U.; Stern, G.

2000-11-01

For future Light Water Reactors special devices (core catchers) are being developed to prevent containment failure by basement erosion after reactor pressure vessel meltthrough during a core meltdown accident. Quick freezing of the molten core masses is desirable to reduce release of radioactivity. Several concepts of core catcher devices have been proposed based on the spreading of corium melt onto flat surfaces with subsequent water cooling. A KATS-experiment has been performed to investigate the flooding behaviour of high temperature melts using alumina-iron thermite melts as a simulant. The oxidic thermite melt is conditioned by adding other oxides to simulate a realistic corium melt as close as possible in terms of liquidus and solidus temperatures. Before flooding with water, spreading of the separate oxidic and metallic melts has been done in one-dimensional channels with a silicate concrete as the substrate. The flooding rate was, in relation to the melt surface, identical to the flooding rate in EPR. (orig.) [de

High-gravity combustion synthesis and in situ melt infiltration: A new method for preparing cemented carbides

International Nuclear Information System (INIS)

Liu, Guanghua; Li, Jiangtao; Yang, Zengchao; Guo, Shibin; Chen, Yixiang

2013-01-01

A new method of high-gravity combustion synthesis and in situ melt infiltration is reported for preparing cemented carbides, where hot nickel melt is in situ synthesized from a highly exothermic combustion reaction and then infiltrated into tungsten carbide powder compacts. The as-prepared sample showed a homogeneous microstructure, and its relative density, hardness and flexural strength were 94.4%, 84 HRA and 1.49 GPa, respectively. Compared with conventional powder metallurgy approaches, high-gravity combustion synthesis offers a fast and furnace-free way to produce cemented carbides

High-strength chromium--molybdenum rails

International Nuclear Information System (INIS)

Smith, Y.E.; Sawhill, J.M. Jr.; Cias, W.W.; Eldis, G.T.

1976-01-01

A laboratory study was conducted with the aim of developing an as-rolled rail of over 100 ksi (689 N/mm 2 ) yield strength. A series of compositions providing both pearlitic and bainitic microstructures was evaluated. A fine pearlitic structure was developed in a 0.73 percent C -- 0.83 percent Mn -- 0.16 percent Si -- 0.75 percent Cr -- 0.21 percent Mo steel by simulating the mill cooling rate of 132-lb/yd (65.5-kg/m) rail. Two 100-ton commercial heats were made of this approximate composition and processed into 132-lb/yd (65.5-kg/m) rail. Samples tested in the laboratory ranged from 109 to 125 ksi (750 to 860 N/mm 2 ) in yield strength. The chromium-molybdenum rails also exhibited excellent fracture toughness and fatigue properties. Sections of the rail were joined by both flash-butt welding and thermite welding. The hardness peaks produced in the flash-butt welds could be reduced by applying either a postweld current or an induction heating cycle. The high-strength chromium-molybdenum rails have been in service for over eight months in curved sections of an ore railway that carries over 55 million gross long tons per year. 7 tables, 18 figs

Characterization of ceramics and intermetallics fabricated by self-propagating high-temperature synthesis

International Nuclear Information System (INIS)

Hurst, J.B.

1989-05-01

Three efforts aimed at investigating the process of self-propagating high temperature synthesis (SHS) for the fabrication of structural ceramics and intermetallics are summarized. Of special interest was the influence of processing variables such as exothermic dopants, gravity, and green state morphology in materials produced by SHS. In the first effort directed toward the fabrication of SiC, exothermic dopants of yttrium and zirconium were added to SiO2 or SiO2 + NiO plus carbon powder mix and processed by SHS. This approach was unsuccessful since it did not produce the desired product of crystalline SiC. In the second effort, the influence of gravity was investigated by examining Ni-Al microstructures which were produced by SHS combustion waves traveling with and opposite the gravity direction. Although final composition and total porosities of the combusted Ni-Al compounds were found to be gravity independent, larger pores were created in those specimens which were combusted opposite to the gravity force direction. Finally, it was found that green microstructure has a significant effect on the appearance of the combusted piece. Severe pressing laminations were observed to arrest the combustion front for TiC samples

High organic containing tanks: Assessing the hazard potential

International Nuclear Information System (INIS)

Hill, R.C.P.; Babad, H.

1991-09-01

Eight Hanford Site tanks contain organic chemicals at concentrations believed to be greater than 10 mole percent sodium acetate equivalent mixed with the oxidizing salts sodium nitrate/sodium nitrite. Also, three of the hydrogen and ferrocyanide tanks appear on the organic tank list. Concentrations of organics that may be present in some tanks could cause an exothermic reaction given a sufficient driving force, such as high temperatures. However, the difference between ignition temperatures and actual tank temperatures measured is so large that the probability of such a reaction is considered very low. The consequences of the postulated reaction are about the same as the scenarios for an explosion in a ''burping'' hydrogen tank. Although work on this issue is just beginning, consideration of hazards associated with heating nitrate-nitrite mixtures containing organic materials is an integral part of both the hydrogen and ferrocyanide tank efforts. High concentrations of organic compounds have been inferred (from tank transfer, flow sheet records, and limited analytical data) in eight single-shell tanks. Many organic chemicals, if present in concentrations above 10 dry weight percent (sodium acetate equivalent), have the potential to react with nitrate-nitrites constituents at temperatures above 200 degree C (392 degree F) in an exothermic manner. The concentrations of organic materials in the listed single-shell tanks, and their chemical identity, is not accurately known at present. A tank sampling program has been planned to provide more information on the contents of these tanks and to serve as a basis for laboratory testing and safety evaluations. 2 refs., 1 fig., 2 tabs

Structural stability of PAN fiber under high electron beam radiation doses

International Nuclear Information System (INIS)

Pino, Eddy S.; Machado, Luci D.B.; Arruda, Clarissa P. Zelinschi de; Carvalho, Alvaro A. Silva de; Giovedi, Claudia

2009-01-01

Fiber-reinforced composite are an important class of engineering material. A relevant task of composite technology in order to produce materials for structures of high mechanical performance is to obtain the best carbon fiber. One of the main ways to produce carbon fibers of high Young's modulus and tensile strength is to use as starting material polyacrylonitrile (PAN) fibers which after a rigorous and carefully thermal process become carbon fibers. Since some chemical modifications produced in the thermal treatment can be induced by ionizing radiation, the aim of this paper is to evaluate the effect of high electron beam (EB) doses on a commercial PAN fiber in order to evaluate the use of this technology as an alternative treatment to improve the properties and characteristics of the produced carbon fiber. The doses applied were: 0.2, 0.4, 0.6, 0.8, 1.0 and 1.2 MGy. The irradiation effects induced on the PAN fiber were evaluated by Fourier transform infrared spectroscopy (FTIR), differential scanning calorimetry (DSC) and thermogravimetry (TG). FTIR obtained data have shown that the main functional groups remain practically unchanged in the non-irradiated and irradiated samples. The single DSC exothermic peak obtained for non-irradiated sample, becomes a double peak after the irradiation, presenting lower initial and higher final temperatures for exothermic DSC curves. The enthalpy involved in the chemical reaction decreases for irradiated samples as compared with the non-irradiated PAN fiber. TG data have shown that irradiated samples start a decomposition process at lower temperatures compared to the non-irradiated sample. (author)

Casting of Hearth Plates from High-chromium Steel

Directory of Open Access Journals (Sweden)

Drotlew A.

2014-12-01

Full Text Available The paper presents the results of studies on the development of manufacturing technologies to cast hearth plates operating in chamber furnaces for heat treatment. Castings made from the heat-resistant G-X40CrNiSi27-4 steel were poured in hand-made green sand molds. The following operations were performed: computer simulation to predict the distribution of internal defects in castings produced by the above mentioned technology with risers bare and coated with exothermic and insulating sleeves, analysis of each variant of the technology, and manufacture of experimental castings. As a result of the conducted studies and analysis it was found that the use of risers with exothermic sleeves does not affect to a significant degree the quality of the produced castings of hearth plates, but it significantly improves the metal yield.

Determination of total cyanide in Hanford Site high-level wastes

Energy Technology Data Exchange (ETDEWEB)

Winters, W.I. [Westinghouse Hanford Co., Richland, WA (United States); Pool, K.H. [Pacific Northwest Lab., Richland, WA (United States)

1994-05-01

Nickel ferrocyanide compounds (Na{sub 2-x}Cs{sub x}NiFe (CN){sub 6}) were produced in a scavenging process to remove {sup 137}Cs from Hanford Site single-shell tank waste supernates. Methods for determining total cyanide in Hanford Site high-level wastes are needed for the evaluation of potential exothermic reactions between cyanide and oxidizers such as nitrate and for safe storage, processing, and management of the wastes in compliance with regulatory requirements. Hanford Site laboratory experience in determining cyanide in high-level wastes is summarized. Modifications were made to standard cyanide methods to permit improved handling of high-level waste samples and to eliminate interferences found in Hanford Site waste matrices. Interferences and associated procedure modifications caused by high nitrates/nitrite concentrations, insoluble nickel ferrocyanides, and organic complexants are described.

Determination of total cyanide in Hanford Site high-level wastes

International Nuclear Information System (INIS)

Winters, W.I.; Pool, K.H.

1994-05-01

Nickel ferrocyanide compounds (Na 2-x Cs x NiFe (CN) 6 ) were produced in a scavenging process to remove 137 Cs from Hanford Site single-shell tank waste supernates. Methods for determining total cyanide in Hanford Site high-level wastes are needed for the evaluation of potential exothermic reactions between cyanide and oxidizers such as nitrate and for safe storage, processing, and management of the wastes in compliance with regulatory requirements. Hanford Site laboratory experience in determining cyanide in high-level wastes is summarized. Modifications were made to standard cyanide methods to permit improved handling of high-level waste samples and to eliminate interferences found in Hanford Site waste matrices. Interferences and associated procedure modifications caused by high nitrates/nitrite concentrations, insoluble nickel ferrocyanides, and organic complexants are described

Multi-dimensional modeling of two-phase flow in rod bundles and interpretation of velocities measured in BWRs by the cross-correlation technique

International Nuclear Information System (INIS)

Analytis, G.Th.; Luebbesmeyer, D.

1984-04-01

The authors present an as precise as possible interpretation of velocity measurements in BWRs by the cross-correlation technique, which is based on the radially non-uniform quality and velocity distribution in BWR type bundles, as well as on our knowledge about the spatial 'field of view' of the in-core neutron detectors. After formulating the three-dimensional two-fluid model volume/time averaged equations and pointing out some problems associated with averaging, they expound a little on the turbulence mixing and void drift effects, as well as on the way they are modelled in advanced subchannel analysis codes like THERMIT or COBRA-TF. Subsequently, some comparisons are made between axial velocities measured in a commercial BWR by neutron noise analysis, and the steam velocities of the four subchannels nearest to the instrument tube of one of the four bundles as predicted by COBRA-III and by THERMIT. Although as expected, for well-known reasons, COBRA-III predicts subchannel steam velocities which are close to each other, THERMIT correctly predicts in the upper half of the core three largely different steam velocities in the three different types of BW0 subchannels (corner, edge and interior). (Auth.)

A new concept for very low energy detonators and torches

Energy Technology Data Exchange (ETDEWEB)

Bickes, Jr., R. W.; Grubelich, M. C.; Romero, J. A.; Staley, D. J.; Buss, R. J.; Ward, P. P.; Erickson, K. L.

1996-03-01

We deposited secondary explosive and multilayer thermite films directly onto semiconductor bridges (SCBs) and other substrates. Methods for the deposition of two thermite films (aluminum/copper oxide and magnesium/fluorocarbon polymer) were developed as part of this study and a new capability was obtained for depositing adherent films on any material, including Teflon and Gore-Tex. Our experimental program determined conditions for the SCB ignition of the deposited films, and with the aluminum/copper oxide film, we observed a lower threshold for ignition of a powder pressed against the bridge. We also looked at other ignition methods including lasers, spark discharges, primers and hot combustion gases.

Test results on direct containment heating by high-pressure melt ejection into the Surtsey vessel: The TDS test series

International Nuclear Information System (INIS)

Allen, M.D.; Blanchat, T.K.; Pilch, M.M.

1994-08-01

The Technology Development and Scoping (TDS) test series was conducted to test and develop instrumentation and procedures for performing steam-driven, high-pressure melt ejection (HPME) experiments at the Surtsey Test Facility to investigate direct containment heating (DCH). Seven experiments, designated TDS-1 through TDS-7, were performed in this test series. These experiments were conducted using similar initial conditions; the primary variable was the initial pressure in the Surtsey vessel. All experiments in this test series were performed with a steam driving gas pressure of ≅ 4 MPa, 80 kg of lumina/iron/chromium thermite melt simulant, an initial hole diameter of 4.8 cm (which ablated to a final hole diameter of ≅ 6 cm), and a 1/10th linear scale model of the Surry reactor cavity. The Surtsey vessel was purged with argon ( 2 ) to limit the recombination of hydrogen and oxygen, and gas grab samples were taken to measure the amount of hydrogen produced

Thermodynamic analysis of ANS binding to partially unfolded α-lactalbumin: correlation of endothermic to exothermic changeover with formation of authentic molten globules.

Science.gov (United States)

Kim, Ki Hyung; Yun, Soi; Mok, K H; Lee, E K

2016-09-01

A fluorescent reporter, 8-anilino-1-naphthalene sulfonic acid (ANS), can serve as a reference molecule for conformational transition of a protein because its aromatic carbons have strong affinity with hydrophobic cores of partially unfolded molten globules. Using a typical calcium-binding protein, bovine α-lactalbumin (BLA), as a model protein, we compared the ANS binding thermodynamics to the decalcified (10 mM EDTA treated) apo-BLA at two representative temperatures: 20 and 40 °C. This is because the authentic molten globule is known to form more heavily at an elevated temperature such as 40 °C. Isothermal titration calorimetry experiments revealed that the BLA-ANS interactions at both temperatures were entropy-driven, and the dissociation constants were similar on the order of 10(-4)  M, but there was a dramatic changeover in the binding thermodynamics from endothermic at 20 °C to exothermic at 40 °C. We believe that the higher subpopulation of authentic molten globules at 40 °C than 20 °C would be responsible for the results, which also indicate that weak binding is sufficient to alter the ANS binding mechanisms. We expect that the thermodynamic properties obtained from this study would serve as a useful reference for investigating the binding of other hydrophobic ligands such as oleic acid to apo-BLA, because oleic acid is known to have tumor-selective cytotoxicity when complexed with partially unfolded α-lactalbumin. Copyright © 2016 John Wiley & Sons, Ltd. Copyright © 2016 John Wiley & Sons, Ltd.

Aceros aluminotérmicos. Nuevas aplicaciones

Directory of Open Access Journals (Sweden)

Duart Blay, J. M.

2004-02-01

Full Text Available The metallothermy is a process based on physical ' chemistry possibility of metallic oxides reduction (Fe, Cr, Mn, Cu for oxygen strong affinity metals, like Al, Mg and Ti. The reaction is highly exothermic giving place to a metallic phase and slag separation by refining and reduction process simultaneously. The technological developed patent initially by Thermit - and improved for other Companies - works well by more than 50 years; today it is employed almost exclusively for obtaining steels and coppers for complex welded joints unions. Particular application or interest presents in the Railways technology for building continuous tracks, practically implanted in all the word and in welding copper cable rope - steel rail employed for traffic signals control. This work displays the fundamental thermodynamic principles of the aluminothermics of iron and their application to the complex weld of crossrail, dilation joints and bypass in Railways, that combine Hadfield steels, stainless steels and pearlitic steels of different mechanical properties. The unions should be compact, with strength and hardness in the levels that are cited in the work, according to requirements demanded by high speed (350 km/ h. lines, now in construction in Spain, but they result of general use to whatever class of less demanding lines and to mining railroads.

La metalotermia es un proceso físicoquímico basado en la posibilidad de reducción de óxidos metálicos (hierro, cromo, manganeso, cobre por metales altamente afines por el oxígeno, como son aluminio, magnesio y titanio. La reacción es altamente exotérmica dando lugar a un caldo metálico separado de su escoria, por un proceso de reducción y afino combinados. La patente tecnológica, desarrollada inicialmente por Thermit y perfeccionada por otras Compañías, lleva en vigor más de 50 años; se aplica hoy, casi exclusivamente, a la obtención de aceros y cobres para uniones soldadas complejas

Effects of annealing on the microstructure and magnetic property of the mechanically alloyed FeSiBAlNiM (M=Co, Cu, Ag) amorphous high entropy alloys

Energy Technology Data Exchange (ETDEWEB)

Zhu, Xiaoxia; Zhou, Xuan; Yu, Shuaishuai; Wei, Congcong; Xu, Jing; Wang, Yan, E-mail: mse_wangy@ujn.edu.cn

2017-05-15

The effects of annealing treatment on the microstructure, thermal stability, and magnetic properties of the mechanical alloyed FeSiBAlNiM (M=Co, Cu, Ag) amorphous high entropy alloys (HEAs) have been investigated in this project. The simple crystallization products in FeSiBAlNi amorphous HEAs with Co and Ag addition reveal the high phase stability during heating process. At high annealing treatment, the crystallized HEAs possess the good semi-hard magnetic property. It can conclude that crystallization products containing proper FeSi-rich and FeB-rich phases are beneficial to improve the magnetic property. Annealing near the exothermic peak temperature presents the best enhancing effect on the semi-hard magnetic property of FeSiBAlNiCo. It performs both large saturated magnetization and remanence ratio of 13.0 emu/g and near 45%, which exhibit 465% and 105% enhancement compared with as-milled state, respectively. - Highlights: • Co, Cu, Ag additions affect crystallization behavior of FeSiBAlNi amorphous HEAs. • Crystallization products in FeSiBAlNi Co/Ag reveal high phase stability. • Proper FeSi-rich and FeB-rich phases are beneficial to improve magnetic property. • Annealing treatment improves semi-hard magnetic property compared to as-milled state. • Annealing near exothermic peak temperature shows best enhancing effect on magnetism.

Development of high capacity, high rate lithium ion batteries utilizing metal fiber conductive additives

Science.gov (United States)

Ahn, Soonho; Kim, Youngduk; Kim, Kyung Joon; Kim, Tae Hyung; Lee, Hyungkeun; Kim, Myung H.

As lithium ion cells dominate the battery market, the performance improvement is an utmost concern among developers and researchers. Conductive additives are routinely employed to enhance electrode conductivity and capacity. Carbon particulates—graphite or carbon black powders—are conventional and popular choices as conductive fillers. However, percolation requirements of particles demand significant volumetric content of impalpable, and thereby high area conductive fillers. As might be expected, the electrode active surface area escalates unnecessarily, resulting in overall increase in reaction with electrolytes and organic solvents. The increased reactions usually manifest as an irreversible loss of anode capacity, gradual oxidation and consumption of electrolyte on the cathode—which causes capacity decline during cycling—and an increased threat to battery safety by gas evolution and exothermic solvent oxidation. In this work we have utilized high aspect ratio, flexible, micronic metal fibers as low active area and high conductivity additives. The metal fibers appear well dispersed within the electrode and to satisfy percolation requirements very efficiently at very low volumetric content compared to conventional carbon-based conductive additives. Results from 18650-type cells indicate significant enhancements in electrode capacity and high rate capability while the irreversible capacity loss is negligible.

Transition from Endothermic to Exothermic Dissolution of Hydroxyapatite Ca5(PO43OH–Johnbaumite Ca5(AsO43OH Solid Solution Series at Temperatures Ranging from 5 to 65 °C

Directory of Open Access Journals (Sweden)

Bartosz Puzio

2018-06-01

Full Text Available Five crystalline members of the hydroxyapatite (HAP; Ca5(PO43OH–johnbaumite (JBM; Ca5(AsO43OH series were crystallized at alkaline pH from aqueous solutions and used in dissolution experiments at 5, 25, 45, and 65 °C. Equilibrium was established within three months. Dissolution was slightly incongruent, particularly at the high-P end of the series. For the first time, the Gibbs free energy of formation ΔGf0, enthalpy of formation ΔHf0, entropy of formation Sf0, and specific heat of formation Copf were determined for HAP–JBM solid solution series. Based on the dissolution reaction, Ca5(AsO4m(PO43−mOH = 5Ca2+(aq + mAsO43−(aq + (3 − mPO43−(aq + OH−(aq, their solubility product Ksp,298.15 was determined. Substitution of arsenic (As for phosphorus (P in the structure of apatite resulted in a linear increase in the value of Ksp: from HAP logKsp,298.15 = −57.90 ± 1.57 to JBM logKsp,298.15 = −39.22 ± 0.56. The temperature dependence of dissolution in this solid solution series is very specific; in the temperature range of 5 °C to 65 °C, the enthalpy of dissolution ΔHr varied around 0. For HAP, the dissolution reaction at 5 °C and 25 °C was endothermic, which transitioned at around 40 °C and became exothermic at 45 °C and 65 °C.

TITAN: an advanced three-dimensional neutronics/thermal-hydraulics code for light water reactor safety analysis

International Nuclear Information System (INIS)

Griggs, D.P.; Kazimi, M.S.; Henry, A.F.

1982-01-01

The initial development of TITAN, a three-dimensional coupled neutronics/thermal-hydraulics code for LWR safety analysis, has been completed. The transient neutronics code QUANDRY has been joined to the two-fluid thermal-hydraulics code THERMIT with the appropriate feedback mechanisms modeled. A detailed steady-state and transient coupling scheme based on the tandem technique was implemented in accordance with the important structural and operational characteristics of QUANDRY and THERMIT. A two channel sample problem formed the basis for steady-state and transient analyses performed with TITAN. TITAN steady-state results were compared with those obtained with MEKIN and showed good agreement. Null transients, simulated turbine trip transients, and a rod withdrawal transient were analyzed with TITAN and reasonable results were obtained

Discontinuously reinforced intermetallic matrix composites via XD synthesis. [exothermal dispersion

Science.gov (United States)

Kumar, K. S.; Whittenberger, J. D.

1992-01-01

A review is given of recent results obtained for discontinuously reinforced intermetallic matrix composites produced using the XD process. Intermetallic matrices investigated include NiAl, multiphase NiAl + Ni2AlTi, CoAl, near-gamma titanium aluminides, and Ll2 trialuminides containing minor amounts of second phase. Such mechanical properties as low and high temperature strength, compressive and tensile creep, elastic modulus, ambient ductility, and fracture toughness are discussed as functions of reinforcement size, shape, and volume fraction. Microstructures before and after deformation are examined and correlated with measured properties. An observation of interest in many of the systems examined is 'dispersion weakening' at high temperatures and high strain rates. This behavior is not specific to the XD process; rather similar observations have been reported in other discontinuous composites. Proposed mechanisms for this behavior are presented.

Surprisingly facile CO2 insertion into cobalt alkoxide bonds: A theoretical investigation

Directory of Open Access Journals (Sweden)

Willem K. Offermans

2015-07-01

Full Text Available Exploiting carbon dioxide as co-monomer with epoxides in the production of polycarbonates is economically highly attractive. More effective catalysts for this reaction are intensively being sought. To promote better understanding of the catalytic pathways, this study uses density functional theory calculations to elucidate the reaction step of CO2 insertion into cobalt(III–alkoxide bonds, which is also the central step of metal catalysed carboxylation reactions. It was found that CO2 insertion into the cobalt(III–alkoxide bond of [(2-hydroxyethoxyCoIII(salen(L] complexes (salen = N,N”-bis(salicyliden-1,6-diaminophenyl is exothermic, whereby the exothermicity depends on the trans-ligand L. The more electron-donating this ligand is, the more exothermic the insertion step is. Interestingly, we found that the activation barrier decreases with increasing exothermicity of the CO2 insertion. Hereby, a linear Brønsted–Evans–Polanyi relationship was found between the activation energy and the reaction energy.

In Situ Imaging of Particle Formation and Dynamics in Reactive Material Deflagrations

Energy Technology Data Exchange (ETDEWEB)

Sullivan, Kyle T. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

2016-12-12

Reactive composites utilizing nanoparticles have been the topic of extensive research in the past two decades. The driver for this is that, as the particle size is decreased, the mixing scale between constituents is greatly reduced, which has long thought to increase the rate of chemical reaction. While a general trend of increased reactivity has been seen for metal / metal oxide, or thermite, reactive materials, some results have demonstrated diminishing returns as the particle size is further decreased. Recent results have shown that nanoparticles, which are typically aggregates of several primary particles, can undergo very rapid coalescence to form micron particles once a critical temperature is reached. Experiments on this topic to date have been performed on very small sample masses, and sometimes under vacuum; conditions which are not representative of the environment during a deflagration. In this feasibility study, a custom burn tube was used to ignite and react 100 mg powdered thermite samples in long acrylic tubes. X-ray imaging at APS Sector 32 was performed to image the particle field as a function of distance and time as the rarefied particle cloud expanded and flowed down the tube. Five different thermite formulations were investigated, Al / CuO, Al / Fe₂O₃, Al / SnO₂, Al / WO₃, and Al / Fe₂O₃, along with Al / CuO formulations with different sizes of Al particles ranging from 80 nm to approximate 10 μm. The results clearly show that the sample powder reacts and unloads into a distribution of larger micron-scale particles (~5-500 μm), which continue to react and propagate as the particle-laden stream flows down the tube. This was the first direct imaging of the particle field during a thermite deflagration, and gives significant insight into the evolution of reactants to products. Analysis of phase is currently being pursued to determine whether this method can be used to extract

Tank waste chemistry: A new understanding of waste aging

International Nuclear Information System (INIS)

Babad, H.; Camaioni, D.M.; Lilga, M.A.; Samuels, W.D.; Strachan, D.M.

1993-02-01

There is concern about the risk of uncontrolled exothermic reactions(s) in Hanford Site waste tanks containing NO 3 minus /NO 2 minus based salts and/or metal hydroxide sludges in combination with organics or ferrocyanides. However, gradual oxidation of the waste in the tanks to less reactive species appears to have reduced the risk. In addition, wastes sampled to date contain sufficiently large quantities of water so that propagation reactions are highly unlikely. This report details an investigation into the risk of an uncontrolled exothermic reaction in Hanford Site high-activity water tanks

New Trends in Research of Energetic Materials (5th Seminar) Held in Pardubice, Czech Republic on 24-25 Apr 2002

Science.gov (United States)

2002-04-01

Zielonka, POLAND CONTA CT COMPA TIRILITYINVESTIGA TIONS OF HIGH-ENER GE TIC MA TERIALS USED IN’MORTAR A UGMENTING PROPELLI7VG CHARGES 200 Joel ...Proceeding of the V. Seminar IRON OXIDE/ALUMINUM FAST THERMITE REACTION USING NITRATE ADITIVES Joel Morgado*, Luisa Durfes**, Jos6 Campos* and Ant6nio...fctwi..0.00400 - ___ ___________ .5. - Cobi _ - 0__ 4.50 C t0C 1. ________-01.6 0.000 0.000 0.010 0.015 0.020 0.025 0.010 0.035 0.040 01045 Mow0

High-Uranium-Loaded U3O8-Al fuel element development program. Part 1

International Nuclear Information System (INIS)

Martin, M.M.

1993-01-01

The High-Uranium-Loaded U 3 O 8 -Al Fuel Element Development Program supports Argonne National Laboratory efforts to develop high-uranium-density research and test reactor fuel to accommodate use of low-uranium enrichment. The goal is to fuel most research and test reactors with uranium of less than 20% enrichment for the purpose of lowering the potential for diversion of highly-enriched material for nonpeaceful usages. The specific objective of the program is to develop the technological and engineering data base for U 3 O 8 -Al plate-type fuel elements of maximal uranium content to the point of vendor qualification for full scale fabrication on a production basis. A program and management plan that details the organization, supporting objectives, schedule, and budget is in place and preparation for fuel and irradiation studies is under way. The current programming envisions a program of about four years duration for an estimated cost of about two million dollars. During the decades of the fifties and sixties, developments at Oak Ridge National Laboratory led to the use of U 3 O 8 -Al plate-type fuel elements in the High Flux Isotope Reactor, Oak Ridge Research Reactor, Puerto Rico Nuclear Center Reactor, and the High Flux Beam Reactor. Most of the developmental information however applies only up to a uranium concentration of about 55 wt % (about 35 vol % U 3 O 8 ). The technical issues that must be addressed to further increase the uranium loading beyond 55 wt % U involve plate fabrication phenomena of voids and dogboning, fuel behavior under long irradiation, and potential for the thermite reaction between U 3 O 8 and aluminum

A novel method for massive synthesis of SnO2 nanowires

Indian Academy of Sciences (India)

Compositions of three reaction systems for synthesizing SnO2 nanowires by thermite reaction. Constituents (g) ... ing voltage and at a magnification of 3000. .... nanowires to obtain the distribution shown in figure 7. SnO2 ... The Sn drop sprayed ...

Application of fluorides as reagents in exothermal reducing processes

International Nuclear Information System (INIS)

Solov'ev, A.I.; Maksimov, Yu.M.; Dedov, N.V.; Malyutina, V.M.; Avramchik, A.N.

2002-01-01

Thermodynamic calculations were made and the process of calcium-thermic reduction of titanium and zirconium tetrafluorides and their mixtures was experimentally studied. Compound TiF 4 and its mixture with ZrF 4 in amount no more than 34.3 % are reduced producing a well-formed ingot. When ZrF 4 content is exceeded in the mixture to be reduced as well as during reduction of pure ZrF 4 and the mixture of unseparated rare earth metal fluorides, metal and alloys are produced as embedded particles in solidified slag. Additional heat should be brought to produce qualitative ingot during the reducing process. Qualitative ingots of metal in weight up to 10 kg were produced during calcium-thermic reduction of zirconium and rare earth fluorides with application of high-frequency induction heating [ru

Planning exercise for the resolution of high level waste tank safety issues

International Nuclear Information System (INIS)

Bunting, J.; Saveland, J.

1992-01-01

Several conditions have been found to exist within high level radioactive waste storage tanks at the Hanford site which could lead to uncontrolled exothermic reactions and/or to the release of tank contents into the environment. These conditions have led to the establishment of four priority 1 safety issues for the Hanford tanks. Resolution of these safety issues will require the coordinated efforts of professionals in chemical, nuclear, operations, safety, and other technical areas. A coordinated and integrated approach is necessary in order to achieve resolution in the shortest possible time, while ensuring that the steps taken do not complicate the later jobs of vitrification and ultimate disposal. This paper describes the purpose, process, and results of an effort to develop a suggested approach. (author)

High-temperature thermal-chemical analysis of nuclear fuel channels

Energy Technology Data Exchange (ETDEWEB)

Nekhamkin, Y; Rosenband, V; Hasan, D; Elias, E; Wacholder, E; Gany, A [Technion-Israel Inst. of Tech., Haifa (Israel)

1996-12-01

In a severe accident situation, e.g., a postulated loss of coolant accident with a coincident loss of emergency core cooling (LOCA/LOECC), the core may become partially uncovered and steam may become the only coolant available. The thermodynamic conditions in the core, in this case, depend on ability of the steam to effectively remove the fuel decay heat and the heat generated by the exothermic steam/Zircaloy reaction., Therefore, it is important to understand the high-temperature behavior of an oxidizing fuel channel. The main objective of this work is to develop a methodology for calculating the clad temperature and rate of oxidation of a partially covered fuel pin. A criterion is derived to define the importance of the chemical reaction in the overall heat balance. The main parameters affecting the fuel thermal behavior are outlined (authors).

Process for producing high purity isoolefins and dimers thereof by dissociation of ethers

Science.gov (United States)

Smith, L.A. Jr.; Jones, E.M. Jr.; Hearn, D.

1984-05-08

Alkyl tertiary butyl ether or alkyl tertiary amyl ether is dissociated by vapor phase contact with a cation acidic exchange resin at temperatures in the range of 150 to 250 F at LHSV of 0.1 to 20 to produce a stream consisting of unreacted ether, isobutene or isoamylene and an alcohol corresponding to the alkyl radical. After the alcohol is removed, the ether/isoolefin stream may be fractionated to obtain a high purity isoolefin (99+%) or the ether/isoolefin stream can be contacted in liquid phase with a cation acidic exchange resin to selectively dimerize the isoolefin in a highly exothermic reaction, followed by fractionation of the dimerization product to produce high purity diisoolefin (97+%). In the case where the alkyl is C[sub 3] to C[sub 6] and the corresponding alcohol is produced on dissociation of the ether, combined dissociation-distillation may be carried out such that isoolefin is the overhead product and alcohol the bottom. 2 figs.

Proceedings of the international meeting on research and test reactor core conversions from HEU to LEU fuels

International Nuclear Information System (INIS)

1983-09-01

Separate abstracts have been prepared for each paper presented in the following areas of interest: (1) fuel development; (2) post-irradiation examinations; (3) reprocessing; (4) thermite reaction; (5) fuel fabrication; (6) element tests; (7) core tests; (8) criticals; (9) shipping; and (10) reactors and methods

High-uranium-loaded U3O8-Al fuel element development program [contributed by N.M. Martin, ORNL

International Nuclear Information System (INIS)

Martin, M.M.

1993-01-01

The High-Uranium-Loaded U 3 O 8 -Al Fuel Element Development Program supports Argonne National Laboratory efforts to develop high-uranium-density research and test reactor fuel to accommodate use of low-uranium enrichment. The goal is to fuel most research and test reactors with uranium of less than 20% enrichment for the purpose of lowering the potential for diversion of highly-enriched material for nonpeaceful usages. The specific objective of the program is to develop the technological and engineering data base for U 3 O 8 -Al plate-type fuel elements of maximal uranium content to the point of vendor qualification for full scale fabrication on a production basis. A program and management plan that details the organization, supporting objectives, schedule, and budget is in place and preparation for fuel and irradiation studies is under way. The current programming envisions a program of about four years duration for an estimated cost of about two million dollars. During the decades of the fifties and sixties, developments at Oak Ridge National Laboratory led to the use of U 3 O 8 -Al plate-type fuel elements in the High Flux Isotope Reactor, Oak Ridge Research Reactor, Puerto Rico Nuclear Center Reactor, and the High Flux Beam Reactor. Most of the developmental information however applies only up to a uranium concentration of about 55 wt % (about 35 vol % U 3 O 8 ). The technical issues that must be addressed to further increase the uranium loading beyond 55 wt % involve plate fabrication phenomena of voids and dogboning, fuel behavior under long irradiation, and potential for the thermite reaction between U 3 O 8 and aluminum. (author)

ALPHA visual data collection. STX005-025: melt drop steam explosion experiments

International Nuclear Information System (INIS)

Moriyama, Kiyofumi; Yamano, Norihiro; Maruyama, Yu; Kudo, Tamotsu; Sugimoto, Jun

1999-03-01

Steam explosion is a phenomenon in which a high temperature liquid gives its internal energy to a low temperature volatile liquid extremely quickly causing rapid evaporation and shock wave generation. In the field of nuclear reactor safety research regarding severe accidents in LWRs, steam explosions involving molten fuel and coolant has been recognized as a potential threat to the integrity of the reactor containment vessel. In the ALPHA (Assessment of Loads and Performance of Containment in Hypothetical Accident) program, experiments were performed to investigate the phenomenology of vapor explosions using iron-alumina thermite melt as a simulant of molten core. This report collects the experimental results especially emphasizing the visual observations by high speed photography. (author)

A new technique for accurately defined deposition of catalyst thin films in deep flow channels of high-temperature gas microreactors

NARCIS (Netherlands)

Tiggelaar, Roald M.; Berenschot, Johan W.; Oosterbroek, R.E.; van Male, P.; de Croon, M.H.J.M.; Schouten, J.C.; van den Berg, Albert

2003-01-01

By using microreactors fabricated with silicon microtechnology, heterogeneous catalyzed gas-phase reactions can be studied which are difficult to control because of their exothermic nature, are explosive or use toxic/hazardous gases. In this type of microreactors, catalytic materials like rhodium or

Evaporated self-supporting foils of enriched iron from the in-situ reduction of Fe2O3

International Nuclear Information System (INIS)

Riel, W.D.

1976-01-01

This paper describes the reduction of isotopically enriched Fe 2 O 3 usng a controlled thermite reaction. The method will produce strain free evaporated films of 100-300 μg/cm 2 which can be floated and mounted, using standard techniques, to make strong self-supporting targets. (author)

Nanodiamond for tuning the properties of energetic composites.

Science.gov (United States)

Pichot, Vincent; Comet, Marc; Miesch, Julien; Spitzer, Denis

2015-12-30

Bismuth oxide (Bi2O3) particles were coated by detonation nanodiamonds. The resulting nanocomposite materials were mixed with an aluminum nanopowder (≈ 100 nm) to prepare nanothermites, with reduced sensitivity to friction and electrostatic discharge (ESD). The use of nanodiamond for this purpose is reported here for the first time. Their numerous qualities such as their small size, antifriction properties and thermal conductivity make them ideal candidates. Small amounts of detonation nanodiamonds allow obtaining impressive desensitization, making thus modified Bi2O3/Al nanothermite safe to handle. A composition containing around 1 wt.% of nanodiamond has a sensitivity threshold to friction superior to 100 N instead of 5 N for the thermite without nanodiamond. Furthermore, the sensitivity threshold to electrostatic discharge increases to 20 times when the nanodiamond content reaches 1.8 wt.%. The antifriction properties of nanodiamond limit the scratching of Bi2O3 surface by Al particles. The desensitization to ESD is observed for a sufficient coverage of the oxide particles (1.8 wt.% of ND), which restrains the effect of the melt dispersion mechanism of aluminum and prevents the mixing of the oxidizing and the reducing parts of the composites. A good reactivity of the thermite could be maintained for nanodiamond content up to 2.6 wt.%. The carburizing of aluminum coming on contact with nanodiamond during the thermite reaction could be evidenced by X-ray Diffraction and calorimetry measurements and also participates to the desensitization of the nanothermite. This kind of desensitization by using detonation nanodiamond can also be applied to other nanothermites having low sensitivity threshold to friction and ESD. Copyright © 2015 Elsevier B.V. All rights reserved.

A catalytically membrane reactor for fast, highly exothermic, heterogeneous gas reactions : a pilot plant study

NARCIS (Netherlands)

Veldsink, J.W.; Veldsink, J.W.; Versteeg, Geert; van Swaaij, Willibrordus Petrus Maria

1995-01-01

Membrane reactors have been frequently studied because of their ability to combine chemical activity and separation properties into one device. Due to their thermal stability and mechanical strength, ceramic membranes are preferred over polymeric ones, but small transmembrane fluxes obstruct a

Design, Construct and Test the Hi-Therm Simulator

National Research Council Canada - National Science Library

Zavitsanos, Peter

1998-01-01

Under the previous SBIR programs, GSI investigated the application of highly exothermic intermetallic reactions with the most energetic of these reactions constituting the basis for the Hi-Therm Simulator...

Thermally induced processes in mixtures of aluminum with organic acids after plastic deformations under high pressure

Science.gov (United States)

Zhorin, V. A.; Kiselev, M. R.; Roldugin, V. I.

2017-11-01

DSC is used to measure the thermal effects of processes in mixtures of solid organic dibasic acids with powdered aluminum, subjected to plastic deformation under pressures in the range of 0.5-4.0 GPa using an anvil-type high-pressure setup. Analysis of thermograms obtained for the samples after plastic deformation suggests a correlation between the exothermal peaks observed around the temperatures of degradation of the acids and the thermally induced chemical reactions between products of acid degradation and freshly formed surfaces of aluminum particles. The release of heat in the mixtures begins at 30-40°C. The thermal effects in the mixtures of different acids change according to the order of acid reactivity in solutions. The extreme baric dependences of enthalpies of thermal effects are associated with the rearrangement of the electron subsystem of aluminum upon plastic deformation at high pressures.

Characterization of Ignition and Combustion Properties of Nanowire-based Energetics

Science.gov (United States)

2013-07-23

cantly improves the overall spatial uniformity of the nano-thermites, and provides an ideal platform for the study of the thermodynamic and kinetic...problem in solids. In addition, heat provided by the Xe lamp is mainly absorbed by the porous Si according to the Beer -Lambert Law, not by the glass slide

Direct containment heating experiments in Zion Nuclear Power Plant geometry using prototypic materials

International Nuclear Information System (INIS)

Binder, J.L.; McUmber, L.M.; Spencer, B.W.

1993-01-01

Direct Containment Heating (DCH) experiments have been completed which utilize prototypic core materials. The experiments reported on here are a continuation of the Integral Effects Testing (IET) DCH program. The experiments incorporated a 1/40 scale model of the Zion Nuclear Power Plant containment structures. The model included representations of the primary system volume, RPV lower head, cavity and instrument tunnel, and the lower containment structures. The experiments were steam driven. Iron-alumina thermite with chromium was used as a core melt stimulant in the earlier IET experiments. These earlier IET experiments at Argonne National Laboratory (ANL) and Sandia National Laboratories (SNL) provided useful data on the effect of scale on DCH phenomena; however, a significant question concerns the potential experiment distortions introduced by the use of non-prototypic iron/alumina thermite. Therefore, further testing with prototypic materials has been carried out at ANL. Three tests have been completed, DCH-U1A, U1B and U2. DCH-U1A and U1B employed an inerted containment atmosphere and are counterpart to the IET-1RR test with iron/alumina thermite. DCH-U2 employed nominally the same atmosphere composition of its counterpart iron/alumina test, IET-6. All tests, with prototypic material, have produced lower peak containment pressure rises; 45, 111 and 185 kPa in U1A, U1B and U2, compared to 150 and 250 kPa IET-1RR and 6. Hydrogen production, due to metal-steam reactions, was 33% larger in U1B and U2 compared to IET-1RR and IET-6. The pressurization efficiency was consistently lower for the corium tests compared to the IET tests

History of Los Alamos Participation in Active Experiments in Space

Energy Technology Data Exchange (ETDEWEB)

Pongratz, Morris B. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2018-02-06

Beginning with the Teak nuclear test in 1958, Los Alamos has a long history of participation in active experiments in space. The last pertinent nuclear tests were the five explosions as part of the Dominic series in 1962. The Partial Test Ban Treaty signed in August 1963 prohibited all test detonations of nuclear weapons except for those conducted underground. Beginning with the “Apple” thermite barium release in June 1968 Los Alamos has participated in nearly 100 non-nuclear experiments in space, the last being the NASA-sponsored “AA-2” strontium and europium doped barium thermite releases in the Arecibo beam in July of 1992. The rationale for these experiments ranged from studying basic plasma processes such as gradientdriven structuring and velocity-space instabilities to illuminating the convection of plasmas in the ionosphere and polar cap to ionospheric depletion experiments to the B.E.A.R. 1-MeV neutral particle beam test in 1989. This report reviews the objectives, techniques and diagnostics of Los Alamos participation in active experiments in space.

A Self-Propagating Foaming Process of Porous Al-Ni Intermetallics Assisted by Combustion Reactions

Directory of Open Access Journals (Sweden)

Makoto Kobashi

2009-12-01

Full Text Available The self-propagating foaming process of porous Al-Ni intermetallics was investigated. Aluminum and nickel powders were blended, and titanium and boron carbide powders were added as reactive exothermic agents. The blended powder was extruded to make a rod-shape precursor. Only one end of the rod precursor was heated to ignite the reaction. The reaction propagated spontaneously throughout the precursor. Pore formation took place at the same time as the reaction occurred. Adding the exothermic agent was effective to increase the porosity. Preheating the precursor before the ignition was also very effective to produce porous Al-Ni intermetallics with high porosity.

Delineation of alternative conformational states in Escherichia coli peptide deformylase via thermodynamic studies for the binding of actinonin.

Science.gov (United States)

Berg, Alexander K; Srivastava, D K

2009-02-24

We investigated the binding of a naturally occurring antibiotic, actinonin, to the Ni(2+)-reconstituted recombinant form of Escherichia coli peptide deformylase (PDF(Ec)) via isothermal titration microcalorimetry. The binding data conformed to both exothermic and endothermic phases with magnitudes of DeltaG degrees , DeltaH degrees , and TDeltaS degrees being equal to -12, -2.7, and 9.3 kcal/mol and -8.7, 3.9, and 12.6 kcal/mol, respectively. Evidently, although both phases are dominated by favorable entropic changes, the exothermic phase has about 6.7 kcal/mol enthalpic advantage over the endothermic phase. We observed that the removal of bound Ni(2+) from PDF(Ec) abolished the exothermic phase without affecting the endothermic phase, but it was regained upon addition of Zn(2+). In conjunction with metal analysis data, we propose that the recombinant form of PDF(Ec) is expressed in two stable conformational states that yield markedly distinct ITC profiles (i.e., exothermic versus endothermic) upon interaction with actinonin. The existence of two conformational states of PDF(Ec) is further supported by the observation of two distinct and independent transitions during the thermal unfolding of the enzyme. In addition, the thermodynamic data reveal that the formation of the PDF(Ec)-actinonin complex results in the transfer of one H(+) from the enzyme phase to the bulk solvent at pH 6.3. Both exothermic and endothermic phases produce highly negative DeltaC(p) degrees values, but there is no apparent enthalpy-entropy compensation effect upon formation of the PDF(Ec)-actinonin complex. In view of the known structural features of the enzyme, arguments are presented that the alternative conformational states of PDF(Ec) are modulated by the metal ligation at the enzyme site.

Experiments on MCCI with oxide and steel

International Nuclear Information System (INIS)

Foit, J.J.; Fischer, M.; Journeau, Ch.; Langrock, G.

2014-01-01

Highlights: • Study of the influence of reinforcement in the concrete on the erosion behaviour. • Prototypic heating of both melt phases (oxide/metal) was achieved. • In contrast to a concrete without rebars, an almost isotropic erosion was obtained. • Tests with UO 2 -containing melt showed a fast oxidation of the stainless steel melt. • Distribution of the metal phase in the oxide melt depends on the heating power. - Abstract: Recently performed experimental programmes at the French VULCANO and the German MOCKA and SICOPS facilities aimed at the further elucidation of various phenomena of molten core-concrete interaction (MCCI). Questions on these phenomena arose during the scientific discussion of MCCI in the last years. The large-scale MOCKA (KIT, Karlsruhe) experiments study the interaction of a simulant oxide (Al 2 O 3 , ZrO 2, CaO) and metal melt (Fe) with concrete. To allow for a long-term interaction, internal heating was provided by alternating additions of alumino-thermite and Zr metal to the upper oxide layer of the stratified melt. Since the heat generated by the thermite reaction and the exothermal oxidation reaction of Zr is mainly deposited in the oxide phase, prototypic heating of both melt phases is achieved. Recent tests in the MOCKA (KIT, Germany) program are focused on assessing the influence of a typical 6 wt.% reinforcement in the concrete on the erosion behaviour. The experiments were performed in siliceous concrete crucibles with an inner diameter of 25 cm and a height of 1.3 m. In these experiments, the overall downward erosion by the metal melt was of the same order as the sideward one. In addition, the lateral erosion in the overlaid oxide melt region was about the same as in the metal melt region. Experiments with prototypic UO 2 -containing melts have been conducted in parallel in the VULCANO (CEA, Cadarache) and SICOPS (AREVA, Erlangen) facilities. In VULCANO a plasma arc furnace melts the oxide corium while three 1-L steel

Microreactors

NARCIS (Netherlands)

Illg, T.; Hessel, V.

2009-01-01

Microreactors open a novel way of chemical synthesis in a highly controlled way. Due to their improved mass and heat transfer, these devices are well suited, e.g., for mixing-sensitive, fast and highly exothermic reactions. Endothermic reactions profit as well from the improved thermal management.

A Catalytically Active Membrane Reactor for Fast, Highly Exothermic, Heterogeneous Gas Reactions. A Pilot Plant Study

NARCIS (Netherlands)

Veldsink, Jan W.; Versteeg, Geert F.; Swaaij, Wim P.M. van

1995-01-01

Membrane reactors have been frequently studied because of their ability to combine chemical activity and separation properties into one device. Due to their thermal stability and mechanical strength, ceramic membranes are preferred over polymeric ones, but small transmembrane fluxes obstruct a

Safer energetic materials by a nanotechnological approach

Science.gov (United States)

Siegert, Benny; Comet, Marc; Spitzer, Denis

2011-09-01

Energetic materials - explosives, thermites, populsive powders - are used in a variety of military and civilian applications. Their mechanical and electrostatic sensitivity is high in many cases, which can lead to accidents during handling and transport. These considerations limit the practical use of some energetic materials despite their good performance. For industrial applications, safety is one of the main criteria for selecting energetic materials. The sensitivity has been regarded as an intrinsic property of a substance for a long time. However, in recent years, several approaches to lower the sensitivity of a given substance, using nanotechnology and materials engineering, have been described. This feature article gives an overview over ways to prepare energetic (nano-)materials with a lower sensitivity.Energetic materials - explosives, thermites, populsive powders - are used in a variety of military and civilian applications. Their mechanical and electrostatic sensitivity is high in many cases, which can lead to accidents during handling and transport. These considerations limit the practical use of some energetic materials despite their good performance. For industrial applications, safety is one of the main criteria for selecting energetic materials. The sensitivity has been regarded as an intrinsic property of a substance for a long time. However, in recent years, several approaches to lower the sensitivity of a given substance, using nanotechnology and materials engineering, have been described. This feature article gives an overview over ways to prepare energetic (nano-)materials with a lower sensitivity. Electronic supplementary information (ESI) available: Experimental details for the preparation of the V2O5@CNF/Al nanothermite; X-ray diffractogram of the V2O5@CNF/Al combustion residue; installation instructions and source code for the nt-timeline program. See DOI: 10.1039/c1nr10292c

Ignition, Combustion and Tuning of Nanocomposite Thermites

Science.gov (United States)

2010-01-01

silver nitrate and potassium 165 iodate or sodium iodate, using a modification of a literature method156. A solution of 30.97 g of AgNO3 in 125...Center Weapons Division (NAWCWD) by precipitation from aqueous solutions of silver nitrate and potassium iodate or sodium iodate, using a modification...adjustable wrench to tighten 1/2 turn past finger tight). -Attach one banana wire to the very top, other to the base. -Test for continuity. If you increase

NEW HIGH STRENGTH AND FASTER DRILLING TSP DIAMOND CUTTERS

Energy Technology Data Exchange (ETDEWEB)

Robert Radtke

2006-01-31

The manufacture of thermally stable diamond (TSP) cutters for drill bits used in petroleum drilling requires the brazing of two dissimilar materials--TSP diamond and tungsten carbide. The ENDURUS{trademark} thermally stable diamond cutter developed by Technology International, Inc. exhibits (1) high attachment (shear) strength, exceeding 345 MPa (50,000 psi), (2) TSP diamond impact strength increased by 36%, (3) prevents TSP fracture when drilling hard rock, and (4) maintains a sharp edge when drilling hard and abrasive rock. A novel microwave brazing (MWB) method for joining dissimilar materials has been developed. A conventional braze filler metal is combined with microwave heating which minimizes thermal residual stress between materials with dissimilar coefficients of thermal expansion. The process results in preferential heating of the lower thermal expansion diamond material, thus providing the ability to match the thermal expansion of the dissimilar material pair. Methods for brazing with both conventional and exothermic braze filler metals have been developed. Finite element modeling (FEM) assisted in the fabrication of TSP cutters controllable thermal residual stress and high shear attachment strength. Further, a unique cutter design for absorbing shock, the densification of otherwise porous TSP diamond for increased mechanical strength, and diamond ion implantation for increased diamond fracture resistance resulted in successful drill bit tests.

Sensitiveness Analysis of Neutronic Parameters Due to Uncertainty in Thermo-hydraulic parameters on CAREM-25 Reactor; Analisis de Sensibilidad de los Parametros Neutronicos ante Incertezas en los Parametros Termohidraulicos en el Reactor CAREM-25

Energy Technology Data Exchange (ETDEWEB)

Serra, Oscar [Comision Nacional de Energia Atomica, Centro Atomico Bariloche (Argentina)

2000-07-01

Some studies were done about the effect of the uncertainty in the values of several thermo-hydraulic parameters on the core behaviour of the CAREM-25 reactor.By using the chain codes CITVAP-THERMIT and the perturbation the reference states, it was found that concerning to the total power, the effects were not very important, but were much bigger for the pressure.Furthermore were hardly significant in the presence of any perturbation on the void fraction calculation and the fuel temperature.The reactivity and the power peaking factor had highly important changes in the case of the coolant flow.We conclude that the use of this procedure is adequate and useful to our purpose.

Fabrication of hard cermets by in-situ synthesis and infiltration of metal melts into WC powder compacts

Directory of Open Access Journals (Sweden)

Guanghua Liu

2017-12-01

Full Text Available Hard carbide cermets are prepared by in-situ synthesis and infiltration of metal melts into WC powder compacts. Ni–W and Ni–W–Cr metal melts are in-situ synthesized from thermite reactions and infiltrated into WC powder compacts under high-gravity. During the infiltration, W in the metal melts reacts with WC to form W2C, and more W2C and W are observed at the upper parts of the cermets than the lower parts. The cermets show a maximum hardness of 15.4 GPa, which is higher than most commercial cemented carbides, although they are not fully dense and have a porosity of 15–20%.

Sensitiveness Analysis of Neutronic Parameters Due to Uncertainty in Thermo-hydraulic parameters on CAREM-25 Reactor

International Nuclear Information System (INIS)

Serra, Oscar

2000-01-01

Some studies were done about the effect of the uncertainty in the values of several thermo-hydraulic parameters on the core behaviour of the CAREM-25 reactor.By using the chain codes CITVAP-THERMIT and the perturbation the reference states, it was found that concerning to the total power, the effects were not very important, but were much bigger for the pressure.Furthermore were hardly significant in the presence of any perturbation on the void fraction calculation and the fuel temperature.The reactivity and the power peaking factor had highly important changes in the case of the coolant flow.We conclude that the use of this procedure is adequate and useful to our purpose

Medium-scale melt-sodium fragmentation experiments

International Nuclear Information System (INIS)

Chu, T.Y.; Beattie, A.G.; Drotning, W.D.; Powers, D.A.

1979-01-01

The results of a series of fragmentation experiments involving up to 20 Kg of thermitically produced high temperature melts and 23 Kg of sodium are presented. Except for one experiment where some centimeter size particles are observed, the fragment distributions seem to be in the range of previous data. Spatial distribution of the fragments in the debris bed appears to be stratified. Scanning electron micrographs of fragments indicate fragmentation to be occurring in the molten state for the more intense interactions observed. Interaction data obtained show quiescent periods of 0.5 to 1.5 second between pressure pulses. The force impulse values per unit mass of melt seems to be in the same range as previous experiments

Wall heat transfer coefficient in a molten salt bubble column: testing the experimental setup

CSIR Research Space (South Africa)

Skosana, PJ

2014-10-01

Full Text Available reactors that are highly exothermic or endothermic. This paper presents the design and operation of experimental setup used for measurement of the heat transfer coefficient in molten salt media. The experimental setup was operated with tap water, heat...

Application of Self-Propagating High Temperature Synthesis to the Fabrication of Actinide Bearing Nitride and Other Ceramic Nuclear Fuels

International Nuclear Information System (INIS)

Moore, John J.; Reigel, Marissa M.; Donohoue, Collin D.

2009-01-01

The project uses an exothermic combustion synthesis reaction, termed self-propagating high-temperature synthesis (SHS), to produce high quality, reproducible nitride fuels and other ceramic type nuclear fuels (cercers and cermets, etc.) in conjunction with the fabrication of transmutation fuels. The major research objective of the project is determining the fundamental SHS processing parameters by first using manganese as a surrogate for americium to produce dense Zr-Mn-N ceramic compounds. These fundamental principles will then be transferred to the production of dense Zr-Am-N ceramic materials. A further research objective in the research program is generating fundamental SHS processing data to the synthesis of (i) Pu-Am-Zr-N and (ii) U-Pu-Am-N ceramic fuels. In this case, Ce will be used as the surrogate for Pu, Mn as the surrogate for Am, and depleted uranium as the surrogate for U. Once sufficient fundamental data has been determined for these surrogate systems, the information will be transferred to Idaho National Laboratory (INL) for synthesis of Zr-Am-N, Pu-Am-Zr-N and U-Pu-Am-N ceramic fuels. The high vapor pressures of americium (Am) and americium nitride (AmN) are cause for concern in producing nitride ceramic nuclear fuel that contains Am. Along with the problem of Am retention during the sintering phases of current processing methods, are additional concerns of producing a consistent product of desirable homogeneity, density and porosity. Similar difficulties have been experienced during the laboratory scale process development stage of producing metal alloys containing Am wherein compact powder sintering methods had to be abandoned. Therefore, there is an urgent need to develop a low-temperature or low-heat fuel fabrication process for the synthesis of Am-containing ceramic fuels. Self-propagating high temperature synthesis (SHS), also called combustion synthesis, offers such an alternative process for the synthesis of Am nitride fuels. Although SHS

Degradation reactions in SONY-type Li-ion batteries

Energy Technology Data Exchange (ETDEWEB)

Roth, E.P.; Nagasubramanian, G.

2000-07-01

Thermal instabilities were identified in SONY-type lithium-ion cells and correlated with interactions of cell constituents and reaction products. Three temperature regions of interaction were identified and associated with the state of charge (degree of Li intercalation) of the cell. Anodes were shown to undergo exothermic reactions as low as 100 C involving the solid electrolyte interface (SEI) layer and the LiPF{sub 6} salt in the electrolyte (EC:PC:DEC/LiPF{sub 6}). These reactions could account for the thermal runaway observed in these cells beginning at 100 C. Exothermic reactions were also observed in the 200 C--300 C region between the intercalated lithium anodes, the LiPF{sub 6} salt, and the PVDF. These reactions were followed by a high-temperature reaction region, 300 C--400 C, also involving the PVDF binder and the intercalated lithium anodes. The solvent was not directly involved in these reactions but served as a moderator and transport medium. Cathode exothermic reactions with the PVDF binder were observed above 200 C and increased with the state of charge (decreasing Li content). This offers an explanation for the observed lower thermal runaway temperatures for charged cells.

Characteristics and mechanism of explosive reactions of Purex solvents with Nitric Acid at elevated temperatures

Energy Technology Data Exchange (ETDEWEB)

Miyata, Teijiro [Radiation Application Development Association, Tokai, Ibaraki (Japan); Takada, Junichi; Koike, Tadao; Tsukamoto, Michio; Watanabe, Koji [Department of Fuel Cycle Safety Research, Nuclear Safety Research Center, Tokai Research Establishment, Japan Atomic Energy Research Institute, Tokai, Ibaraki (Japan); Ida, Masaaki [JGC PLANTECH CO., LTD (Japan); Nakagiri, Naotaka [JGC Corp., Tokyo (Japan); Nishio, Gunji [Research Organization for Information Science and Technology, Tokai, Ibaraki (Japan)

2000-03-01

This investigation was undertaken to make clear the energetic properties and mechanism of explosive decomposition of Purex solvent systems (TBP/n-Dodecane/HNO{sub 3}) by Nitric Acid at elevated temperatures using a calorimetric technique (DSC, ARC) and a chromatographic technique (GC, GC/MS). The measurement of exothermic events of solvent-HNO{sub 3} reactions using DSC with a stainless steel sealed cell showed distinct two peaks with maxima at around 170 and 320degC, respectively. The peak at around 170degC was mainly attributed to the reactions of dealkylation products (n-butyl nitrate) of TBP and the solvent with nitric acid, and the peak at around 320degC was attributed to the exothermic decomposition of nitrated dodecanes formed in the foregoing exothermic reaction of dodecane with nitric acid. By using the data obtained in ARC experiments, activation energies of 123.2 and 152.5 kJ/mol were determined for the exothermic reaction of TBP with nitric acid and for the exothermic pyrolysis of n-butyl nitrate, respectively. Some possible pathways were considered for the explosive decomposition of TBP by nitric acid at elevated temperatures. (author)

The effect of intramolecular quantum modes on free energy relationships for electron transfer reactions

DEFF Research Database (Denmark)

Ulstrup, Jens; Jortner, Joshua

1975-01-01

A general quantum mechanical description of exothermic electron transfer reactions is formulated by treating such reactions as the nonradiative decay of a ''supermolecule'' consisting of the electron donor, the electron acceptor, and the polar solvent. In particular, the role of the high-frequenc...

Research Article

African Journals Online (AJOL)

2017-05-01

May 1, 2017 ... of the final polymer and the conversion has been studied. Keywords: dental ... Available online at http://www.jfas. ... process and the high rate of this reaction As well as the exothermic effect resulting from the reaction may be ...

Small-Scale Coal-Biomass to Liquids Production Using Highly Selective Fischer-Tropsch Synthesis

Energy Technology Data Exchange (ETDEWEB)

Gangwal, Santosh K. [Southern Research Institute, Durham, NC (United States); McCabe, Kevin [Southern Research Institute, Durham, NC (United States)

2015-04-30

The research project advanced coal-to-liquids (CTL) and coal-biomass to liquids (CBTL) processes by testing and validating Chevron’s highly selective and active cobalt-zeolite hybrid Fischer-Tropsch (FT) catalyst to convert gasifier syngas predominantly to gasoline, jet fuel and diesel range hydrocarbon liquids, thereby eliminating expensive wax upgrading operations The National Carbon Capture Center (NCCC) operated by Southern Company (SC) at Wilsonville, Alabama served as the host site for the gasifier slip-stream testing/demonstration. Southern Research designed, installed and commissioned a bench scale skid mounted FT reactor system (SR-CBTL test rig) that was fully integrated with a slip stream from SC/NCCC’s transport integrated gasifier (TRIG^TM). The test-rig was designed to receive up to 5 lb/h raw syngas augmented with bottled syngas to adjust the H₂/CO molar ratio to 2, clean it to cobalt FT catalyst specifications, and produce liquid FT products at the design capacity of 2 to 4 L/day. It employed a 2-inch diameter boiling water jacketed fixed-bed heat-exchange FT reactor incorporating Chevron’s catalyst in Intramicron’s high thermal conductivity micro-fibrous entrapped catalyst (MFEC) packing to efficiently remove heat produced by the highly exothermic FT reaction.

Resolution of the ferrocyanide safety issue for the Hanford site high-level waste tanks

International Nuclear Information System (INIS)

Cash, R.J.

1996-01-01

This paper describes the approach used to resolve the ferrocyanide safety issue, a process that began in 1990 after heightened concern was expressed by various government agencies about the safety of Hanford site high-level waste tanks. At the time, little was known about ferrocyanide-nitrate/nitrite reactions and the potential for offsite releases of radioactivity from the Hanford Site. Recent studies have shown that the combined effects of temperature, radiation, and pH during more than 38 years of storage have destroyed most of the ferrocyanide originally added to tanks. This has been proven in the laboratory using flowsheet-derived waste simulants and confirmed by waste samples obtained from the ferrocyanide tanks. The resulting tank waste sludges are too dilute to support a sustained exothermic reaction, even if dried out and heated to temperatures of at least 250 C. The US Department of Energy (DOE) has been requested to close the ferrocyanide safety issue

Critical velocities for deflagration and detonation triggered by voids in a REBO high explosive

Energy Technology Data Exchange (ETDEWEB)

Herring, Stuart Davis [Los Alamos National Laboratory; Germann, Timothy C [Los Alamos National Laboratory; Jensen, Niels G [Los Alamos National Laboratory

2010-01-01

The effects of circular voids on the shock sensitivity of a two-dimensional model high explosive crystal are considered. We simulate a piston impact using molecular dynamics simulations with a Reactive Empirical Bond Order (REBO) model potential for a sub-micron, sub-ns exothermic reaction in a diatomic molecular solid. The probability of initiating chemical reactions is found to rise more suddenly with increasing piston velocity for larger voids that collapse more deterministically. A void with radius as small as 10 nm reduces the minimum initiating velocity by a factor of 4. The transition at larger velocities to detonation is studied in a micron-long sample with a single void (and its periodic images). The reaction yield during the shock traversal increases rapidly with velocity, then becomes a prompt, reliable detonation. A void of radius 2.5 nm reduces the critical velocity by 10% from the perfect crystal. A Pop plot of the time-to-detonation at higher velocities shows a characteristic pressure dependence.

Nanodiamond for tuning the properties of energetic composites

International Nuclear Information System (INIS)

Pichot, Vincent; Comet, Marc; Miesch, Julien; Spitzer, Denis

2015-01-01

Highlights: • Bismuth oxide (Bi 2 O 3 ) particles were successfully coated by detonation nanodiamond (DND). • Small DND contents strongly desensitize the Bi 2 O 3 /Al nanothermites to friction. • DNDs limit the electrostatic discharge sensitivity of the Bi 2 O 3 /Al nanothermites. • Desensitization can be mainly explained by the barrier role of the nanodiamonds. • Nanothermites sensitivity levels and flame propagation velocities are tuned by DND content. - Abstract: Bismuth oxide (Bi 2 O 3 ) particles were coated by detonation nanodiamonds. The resulting nanocomposite materials were mixed with an aluminum nanopowder (≈100 nm) to prepare nanothermites, with reduced sensitivity to friction and electrostatic discharge (ESD). The use of nanodiamond for this purpose is reported here for the first time. Their numerous qualities such as their small size, antifriction properties and thermal conductivity make them ideal candidates. Small amounts of detonation nanodiamonds allow obtaining impressive desensitization, making thus modified Bi 2 O 3 /Al nanothermite safe to handle. A composition containing around 1 wt.% of nanodiamond has a sensitivity threshold to friction superior to 100 N instead of 5 N for the thermite without nanodiamond. Furthermore, the sensitivity threshold to electrostatic discharge increases to 20 times when the nanodiamond content reaches 1.8 wt.%. The antifriction properties of nanodiamond limit the scratching of Bi 2 O 3 surface by Al particles. The desensitization to ESD is observed for a sufficient coverage of the oxide particles (1.8 wt.% of ND), which restrains the effect of the melt dispersion mechanism of aluminum and prevents the mixing of the oxidizing and the reducing parts of the composites. A good reactivity of the thermite could be maintained for nanodiamond content up to 2.6 wt.%. The carburizing of aluminum coming on contact with nanodiamond during the thermite reaction could be evidenced by X-ray Diffraction and

The impacts of carbon tariff on green supply chain design

NARCIS (Netherlands)

Zhou, Y.; Gong, D.-C.; Huang, B.; Peters, B.A.

Auto-thermal reforming (ATR), a combination of exothermic partial oxidation and endothermic steam reforming of methane, is an important process to produce syngas for petrochemical industries. In a commercial ATR unit, tubular fixed bed reactors are typically used. Pressure drop across the tube, high

High-Frequency Gravitational Wave Induced Nuclear Fusion

International Nuclear Information System (INIS)

Fontana, Giorgio; Baker, Robert M. L. Jr.

2007-01-01

Nuclear fusion is a process in which nuclei, having a total initial mass, combine to produce a single nucleus, having a final mass less than the total initial mass. Below a given atomic number the process is exothermic; that is, since the final mass is less than the combined initial mass and the mass deficit is converted into energy by the nuclear fusion. On Earth nuclear fusion does not happen spontaneously because electrostatic barriers prevent the phenomenon. To induce controlled, industrial scale, nuclear fusion, only a few methods have been discovered that look promising, but net positive energy production is not yet possible because of low overall efficiency of the systems. In this paper we propose that an intense burst of High Frequency Gravitational Waves (HFGWs) could be focused or beamed to a target mass composed of appropriate fuel or target material to efficiently rearrange the atomic or nuclear structure of the target material with consequent nuclear fusion. Provided that efficient generation of HFGW can be technically achieved, the proposed fusion reactor could become a viable solution for the energy needs of mankind and alternatively a process for beaming energy to produce a source of fusion energy remotely - even inside solid materials

Status of containment integrity studies for continued in-tank storage of Hanford defense high-level waste

International Nuclear Information System (INIS)

Baca, R.G.; Beitel, G.A.; Mercier, P.F.; Moore, E.L.; Vollert, F.R.

1978-09-01

Information is provided on the technical studies that have been implemented for evaluating the containment integrity of the single-shell waste storage tanks. The major areas of study are an analysis of storage tank integrity, a failure mode analysis, and storage tank improvements. Evaluations of tank structural integrity include theoretical studies on static and dynamic load responses, laboratory studies on concrete durability, and experimental studies on the potential for exothermic reactions of salt cake. The structural analyses completed to date show that the tanks are in good condition and have a safety margin against overload. Environmental conditions that could cause a loss of durability are limited to the waste chemicals stored (which do not have access to the concrete). Concern that a salt cake exothermic reaction may initiate a loss of containment is not justifiable based on extensive testing completed. A failure mode analysis of a tank liner failure, a sidewall failure, and a dome collapse shows that no radiologic hazard to man results. Storage tank improvement studies completed show that support of a tank dome is achievable. Secondary containment provided by chemical grouts and bentonite clay slurry walls does not appear promising. It is now estimated that the single-shell tanks will be serviceable for the storage of salt cake waste for decades under currently established operating temperature and load limits

Thermodynamic analysis of Bacillus subtilis endospore protonation using isothermal titration calorimetry

Science.gov (United States)

Harrold, Zoë R.; Gorman-Lewis, Drew

2013-05-01

Bacterial proton and metal adsorption reactions have the capacity to affect metal speciation and transport in aqueous environments. We coupled potentiometric titration and isothermal titration calorimetry (ITC) analyses to study Bacillus subtilis spore-proton adsorption. We modeled the potentiometric data using a four and five-site non-electrostatic surface complexation model (NE-SCM). Heats of spore surface protonation from coupled ITC analyses were used to determine site specific enthalpies of protonation based on NE-SCMs. The five-site model resulted in a substantially better model fit for the heats of protonation but did not significantly improve the potentiometric titration model fit. The improvement observed in the five-site protonation heat model suggests the presence of a highly exothermic protonation reaction circa pH 7 that cannot be resolved in the less sensitive potentiometric data. From the log Ks and enthalpies we calculated corresponding site specific entropies. Log Ks and site concentrations describing spore surface protonation are statistically equivalent to B. subtilis cell surface protonation constants. Spore surface protonation enthalpies, however, are more exothermic relative to cell based adsorption suggesting a different bonding environment. The thermodynamic parameters defined in this study provide insight on molecular scale spore-surface protonation reactions. Coupled ITC and potentiometric titrations can reveal highly exothermic, and possibly endothermic, adsorption reactions that are overshadowed in potentiometric models alone. Spore-proton adsorption NE-SCMs derived in this study provide a framework for future metal adsorption studies.

Benzene destruction in claus process by sulfur dioxide: A reaction kinetics study

KAUST Repository

Sinha, Sourab; Raj, Abhijeet Dhayal; Alshoaibi, Ahmed S.; Alhassan, Saeed M.; Chung, Suk-Ho

2014-01-01

interactions. The mechanism begins with SO2 addition to phenyl radical after overcoming an energy barrier of 6.4 kJ/mol. This addition reaction is highly exothermic, where a reaction energy of 182 kJ/mol is released. The most favorable pathway involves O-S bond

The influence of cladding on fission gas release from irradiated U-Mo monolithic fuel

Energy Technology Data Exchange (ETDEWEB)

Burkes, Douglas E., E-mail: Douglas.Burkes@pnnl.gov; Casella, Amanda J.; Casella, Andrew M.

2017-04-01

The monolithic uranium-molybdenum (U-Mo) alloy has been proposed as a fuel design capable of converting the world's highest power research reactors from use of high enriched uranium to low enriched uranium. However, a zirconium (Zr) diffusion barrier must be used to eliminate interactions that form between the U-Mo monolith and aluminum alloy 6061 (AA6061) cladding during fabrication and are enhanced during irradiation. One aspect of fuel development and qualification is to demonstrate an appropriate understanding of the extent of fission product release from the fuel under anticipated service environments. An exothermic reaction has previously been observed between the AA6061 cladding and Zr diffusion layer. In this paper, two fuel segments with different irradiation history were subjected to specified thermal profiles under a controlled atmosphere using a thermogravimetric/differential thermal analyzer coupled with a mass spectrometer inside a hot cell. Samples from each segment were tested with cladding and without cladding to investigate the effect, if any, that the exothermic reaction has on fission gas release mechanisms. Measurements revealed there is an instantaneous effect of the cladding/Zr exothermic reaction, but not necessarily a cumulative effect above approximately 973 K (700 °C). The mechanisms responsible for fission gas release events are discussed. - Highlights: •Complementary fission gas release events are reported for U-Mo fuel with and without cladding. •Exothermic reaction between Zr diffusion layer and cladding influences fission gas release. •Mechanisms responsible for fission gas release are similar, but with varying timing and magnitude. •Behavior of samples is similar after 800 °C signaling the onset of superlattice destabilization.

Fuel rod quenching with oxidation and precursory cooling

International Nuclear Information System (INIS)

Davidi, A.; Elias, E.; Olek, S.

1999-01-01

During a loss-of-coolant-accident in LWR fuel rods may be temporarily exposed thus reaching high temperature levels. The injection of cold water into the core, while providing the necessary cooling to prevent melting may also generate steam inducing exothermal oxidation of the cladding. A number of high temperature quenching experiments [I] have demonstrated that during the early phase of the quenching process, the rate of hydrogen generation increased markedly and the surface temperatures rose rapidly. These effects are believed to result from thermal stresses breaking up the oxide layer on the zircalloy cladding, thus exposing the inner surface to oxidizing atmosphere. Steam reacts exothermally with the metallic components of the newly formed surface causing temporarily local temperature escalation. The main objective of this study is to develop and assess a one-dimensional time-dependent rewetting model to address the problem of quenching of hot surfaces undergoing exothermic oxidation reactions. Addressing a time-dependent problem is an important aspect of the work since it is believed that the progression of a quench-front along a hot oxidizing surface is an unsteady process. Several studies dealing with time-dependent rewetting problems have been published, e.g. [2]-[5], but none considers oxidation reactions downstream of the quench-front. The main difficulty in solving time-dependent rewetting problems stems from the fact that either the quench-front velocity or the quench-front positions constitute a time-dependent eigenvalue of the problem. The model is applied to describe the interrelated processes of cooling and exothermic steam-metal reactions at the vapor zirconium-cladding interface during quenching of degraded fuel rods. A constant heat transfer coefficient is assumed upstream of the quenching front whereas the combined effect of oxidation and post dry-out cooling is described by prescribing a heat flux distribution of general form downstream. The

Complexant stability investigation. Task 2. Organic complexants

International Nuclear Information System (INIS)

Martin, E.C.

1985-06-01

The safety of high-level defense waste operations has always been given highest priority at the Hanford site. This document is part of the continued effort to appraise and reevaluate the safety of the waste stored in underground tanks on the Hanford Reservation. Hanford high-level defense waste consists mainly of moist, inorganic salts, NaNO 3 , NaAl(OH) 4 , Na 2 CO 3 , and other sodium salts. However, in addition to these salts, quantities of organic compounds constitute a significant portion of the waste. The potential reaction of the organic compounds with inorganic salts to form explosive substances is examined and found to be nonexistent or negligible. The concept that the waste mixture might react exothermically is found to be untenable under the present storage conditions. The phenomenon of slurry growth in double-shell waste storage tanks is expected to cause no increase in exothermic reaction potential within the waste. The results of this study indicate that the presence of organic material in the high-level defense waste does not constitute undue hazard under the present storage conditions

Application of TZERO calibrated modulated temperature differential scanning calorimetry to characterize model protein formulations.

Science.gov (United States)

Badkar, Aniket; Yohannes, Paulos; Banga, Ajay

2006-02-17

The objective of this study was to evaluate the feasibility of using T(ZERO) modulated temperature differential scanning calorimetry (MDSC) as a novel technique to characterize protein solutions using lysozyme as a model protein and IgG as a model monoclonal antibody. MDSC involves the application of modulated heating program, along with the standard heating program that enables the separation of overlapping thermal transitions. Although characterization of unfolding transitions for protein solutions requires the application of high sensitive DSC, separation of overlapping transitions like aggregation and other exothermic events may be possible only by use of MDSC. A newer T(ZERO) calibrated MDSC model from TA instruments that has improved sensitivity than previous models was used. MDSC analysis showed total, reversing and non-reversing heat flow signals. Total heat flow signals showed a combination of melting endotherms and overlapping exothermic events. Under the operating conditions used, the melting endotherms were seen in reversing heat flow signal while the exothermic events were seen in non-reversing heat flow signal. This enabled the separation of overlapping thermal transitions, improved data analysis and decreased baseline noise. MDSC was used here for characterization of lysozyme solutions, but its feasibility for characterizing therapeutic protein solutions needs further assessment.

Degradation of phosphorene in air: understanding at atomic level

International Nuclear Information System (INIS)

Wang, Gaoxue; Slough, William J; Pandey, Ravindra; Karna, Shashi P

2016-01-01

Phosphorene is a promising two-dimensional (2D) material with a direct band gap, high carrier mobility, and anisotropic electronic properties. Phosphorene-based electronic devices, however, are found to degrade upon exposure to air. In this paper, we provide an atomic level understanding of the stability of phosphorene in terms of its interaction with O 2 and H 2 O. The results based on density functional theory together with first principles molecular dynamics calculations show that O 2 could the spontaneously dissociate on phosphorene at room temperature. H 2 O will not strongly interact with pristine phosphorene, however, an exothermic reaction could occur if phosphorene is first oxidized. The pathway of oxidation first, followed by exothermic reaction with water is the most likely route for the chemical degradation of phosphorene-based devices in air. (paper)

High-throughput approach to the catalytic combustion of diesel soot

Energy Technology Data Exchange (ETDEWEB)

Iojoiu, Eduard Emil; Bassou, Badr; Guilhaume, Nolven; Farrusseng, David; Desmartin-Chomel, Arnold; Bianchi, Daniel; Mirodatos, Claude [Institut de recherches sur la catalyse et l' environnement de Lyon IRCELYON, UMR5256 CNRS Universite Lyon 1, 2 avenue Albert Einstein, F-69626 Villeurbanne Cedex (France); Lombaert, Karine [Renault, Diesel Innovative Catalytic Materials, Direction de l' Ingenierie Materiaux, 1 Allee Cornuel, 91510 Lardy (France)

2008-08-30

A methodology for the evaluation of diesel soot oxidation catalysts by high-throughput (HT) screening was developed. The optimal experimental conditions (soot amount, catalyst/soot ratio, type of contact, composition and flow rate of gas reactants) ensuring a reliable and reproducible detection of light-off temperatures in a 16 parallel channels reactor were set up. The temperature profile measured in the catalyst/soot bed under TPO conditions when the exothermic combustion of soot takes place was shown to provide an accurate measurement of the ignition. Its reproducibility and relevance were checked. The results obtained with a reference noble metal free catalyst (La{sub 0.8}Cr{sub 0.8}Li{sub 0.2}O{sub 3} perovskite) agree very well with literature data. Qualitative mechanistic features could be derived from these experiments, stressing the likely limiting step of oxygen transfer from catalyst surface to soot particulates to ignite the soot combustion. Ceria material was shown to be more appropriate than perovskite one. From an HT screening of a large diverse library (over 100 mixed oxides catalysts) under optimized conditions, about 10 new formulations were found to perform better than selected noble metal free reference materials. (author)

Thermo-chemical characterization of a Al nanoparticle and NiO nanowire composite modified by Cu powder

International Nuclear Information System (INIS)

Bohlouli-Zanjani, Golnaz; Wen, John Z.; Hu, Anming; Persic, John; Ringuette, Sophie; Zhou, Y. Norman

2013-01-01

Highlights: • First study on the copper modified powder-type Al nanoparticle and NiO nanowire composites. • Experimental findings were unique in identifying the AlNi formation and comparing with the Al/CuO thermite. • Potential applications in material joining and bonding. - Abstract: Thermo-chemical properties of the Al nanoparticle and NiO nanowire composites modified by the micro-sized copper additive were investigated experimentally. Their onset temperatures of ignition and energy release data per mass were characterized using differential thermal analysis measurements. These microstructures and chemical compositions of reaction products were analyzed using scanning electron microscopy, energy dispersive X-ray spectroscopy and X-ray diffraction. The fuel-rich Al/NiO/Cu composites produced two types of metallic spheres. Copper spheres were formed from melting and solidification of the copper additive, while AlNi composite spheres were identified by the energy dispersive X-ray spectroscopy and X-ray diffraction analyses. It was found that the amount of the copper additive did not significantly influence the onset temperature of thermite peaks, but caused a dramatic change in energy release. The aforementioned ignition and energetic properties were compared with these from the Al nanoparticle and CuO nanowire composites

A feasibility experiment for assessing the efficacy of ex-vessel cooling through the external gap structure

International Nuclear Information System (INIS)

Kang, K. H.; Kim, J. H.; Park, L. J.; Kim, S. B.; Hwang, I. S.

1999-01-01

This paper presents the results of a feasibility experiment for assessing the efficacy of ex-vessel cooling through the external gap structure during a severe accident. In this study, a 1/8 linear scale mockup of a lower plenum was used with Al2O3/Fe thermite melt as a corium simulant. The results show that in dry case test conducted without cooling the outside of the vessel, after about thirty second from the thermite ignition the vessel was heated to cause a complete melt penetration at about 30 degree upper position from the bottom. Whereas in wet case test conducted cooling the outside of the vessel with 0.85 kg/s of water flow rate using 2.5 cm of uniform gap structure, the vessel effectively cooled down with 23.7 K/s of cooling rate by nucleate boiling at the surface of the vessel. The results of two-dimensional analyses using FLUENT code show a similar trend of vessel thermal behavior presented in the tests. Synthesized the results of the tests and analyses work, a natural convection of the melt pool could cause the formation of hot spot at the upper portion of the vessel, but the vessel could effectively cool down by heat removal with ex-vessel cooling

Controlling material reactivity using architecture

Science.gov (United States)

Sullivan, Kyle

2017-06-01

The reactivity of thermites can be tailored through selection of several parameters, and can range from very slow burns to rapid deflagrations. 3D printing is a rapidly emerging field, and offers the potential to build architected parts. Here we sought to explore whether controlling such features could be a suitable path forward for gaining additional control of the reactivity. This talk discusses several new methods for preparing thermite samples with controlled architectures using 3D printing. Additionally, we demonstrate that the architecture can play a role in the reactivity of an object. Our results suggest that architecture can be used to tailor the convective and/or advective energy transport during a deflagration, thus enhancing or retarding the reaction. The results are promising in that they give researchers an additional way of controlling the energy release rate without defaulting to the conventional approach of changing the formulation. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under contract DE-AC52-07NA27344. LLNL-ABS-708525. In collaboration with: Cheng Zhu, Eric Duoss, Matt Durban, Alex Gash, Alexandra Golobic, Michael Grapes, David Kolesky, Joshua Kuntz, Jennifer Lewis, Christopher Spadaccini; LAWRENCE LIVERMORE NATIONAL LAB.

Thermal behaviour of agitated gas-liquid reactors with a vaporizing solvent/air oxidation of hydrocarbons

NARCIS (Netherlands)

Westerterp, K.R.; Crombeen, P.R.J.J.

1983-01-01

Many highly exothermic gas-liquid reactions are carried out with a vaporizing solvent, which after condensation is returned to the reactor. In this way the liberated reaction heat for a large part is absorbed by the cooling water flowing through the condenser. In order to determine the influence of

The aluminum-U3O8 exothermic reaction

International Nuclear Information System (INIS)

Copeland, George L.

1983-01-01

The phase assemblage of aluminum-urania is a nonequilibrium mixture and a cermet fuel of this mixture will ultimately tend to change phases. Early studies of this reaction recognized the potentially large energy release accompanying the phase change. This paper reviews the studies of the reaction and concludes that increasing the uranium content to the level necessary for low-enriched fuels will not add significantly to the chemical reaction hazard. (author)

Electro-Static Discharge (ESD) Sensitivity of Reactive Powders and its Mitigation

Science.gov (United States)

2016-03-16

Al+CuO and Al+Bi2O3 by combining them with Viton A and guar gum , respectively [70, 71]. Similarly reduced ESD sensitivity resulted for the thermite...SECURITY CLASSIFICATION OF: This work followed our previous study characterizing ignition of pure metal powders by electrostatic discharge. Here, the...that ignition event for all materials can be described using two stages. First, a fraction of the powder struck by the spark is ignited directly

An experimental study on in-vessel debris retention through gap cooling

International Nuclear Information System (INIS)

Kang, Kyung Ho; Kim, Jong Whan; Cho, Young Ro; Chang, Young Cho; Park, Rae Jun; Gu, Kil Mo; Kim, Sang Baik; Kim, Hee Dong

1999-04-01

LAVA experiments have been performed using high temperature molten material to be relocated into the 1/8 linear scaled vessel of a reactor lower plenum filled with water. An Al 2 O 3 /Fe tehrmite melt (Al 2 O 3 only) was used as a corium simulant. In this study, the influence of various initial conditions, such as internal pressure load across the vessel wall, the material composition of the melt simulant, water subcooling and depth on gap formation were investigated. As well, the thermal and mechanical behaviors of the vessel were examined. In case the internal pressure load was imposed, the gap formation between the continuous solidified debris and the vessel wall was clearly shown with post-test examination. On the other hand, in case the internal pressure load was not imposed, the iron welded to the inner surface of the vessel and the vessel experienced ablation to about 5 mm. The cooling rate of the vessel was very slow in the tests using Al 2 O 3 /Fe thermite melt but it was rather fast using Al 2 O 3 melt. It is postulated that in the Al 2 O 3 /Fe thermite tests, the iron melt layer is so dense that water ingression into the gap is difficult due to the high pressure of escaping steam. On the other hand, in the porosity of an Al 2 O 3 melt layer could enhance water ingression into the gap by giving the flow path of the evaporated steam through the porous media. The water height and subcooling could affect the melt pool formation and the initial thermal attack to the vessel. However, at present stage, the effect of water subcooling on the thermal behavior of the vessel couldn't be generalized. For clear confirmation of the effect of water subcooling, the tests will be performed at the saturated water condition. (author). 19 refs., 3 tabs., 36 figs

Evaluation of the vitreous matrices to include high-level radioactive wastes

International Nuclear Information System (INIS)

Varani, J.L.; Petraitis, E.J.; Pasquali, R.C.

1987-01-01

The Argentine Nuclear Programme considers a fuel cycle with Pu recycle. This will generate high-level liquid wastes, that should be safely eliminated. With this purpose, primary glasses utilizing three prototipe compositions were prepared. Simulated wastes oxides in the rate of about 10% were added to the vitreous matrices. The mixture was melted in ceramic melting pots in a muffle furnace at 1 100 deg C during 8 hours. Resistance leaching tests were made following an adaptation of the DIN 12 111 standard. Quantitative analysis of the leaching solutions were made to evaluate the solubility of the different elements. Glasses were observed with optical microscopy scanning before and after leaching. In the first, glasses, bubbles and crystalline-phase appear; in the second ones, puncture and embrittlement were detected. By means of differential thermoanalysis, endo and exothermal peaks were identified in glasses supporting gradual heating. X ray diffraction analysis were made in samples with and without wastes. The degree of crystallization of samples was evaluated by photographic and diffractometric techniques. Leaching studies showed the existance of a direct relation between leaching and glass alkaline content. (M.E.L.) [es

Experiments for the premixing phase (PREMIX); Experimente zur Vorvermischungsphase (PREMIX)

Energy Technology Data Exchange (ETDEWEB)

Cherdron, W.; Huber, F.; Kaiser, A.; Schuetz, W.; Steinbrueck, M.; Will, H.

1995-08-01

In the PREMIX experiment, the premixing phenomena are studied by means of real high temperature melt jets. Jet fragmentation as well as (coarse) fragmentation of melt drops are being investigated. The objective is to avoid as far as possible a fine fragmentation and thus to help prevent explosions. Therefore water is used close to boiling temperature. The pressure can be varied in a relevant range up to nearly 10 bar. The melt is created by a thermite reaction after which most of the iron is separated from the melt. In this way a predominantly oxide melt with temperatures of about 2700 K is produced. Preliminary experiments showed as a surprising result that melt jets can penetrate into the water as far as nearly 1 m depth before a violant evaporation comes about. (orig.)

Experiments for the premixing phase (PREMIX)

International Nuclear Information System (INIS)

Cherdron, W.; Huber, F.; Kaiser, A.; Schuetz, W.; Steinbrueck, M.; Will, H.

1995-01-01

In the PREMIX experiment, the premixing phenomena are studied by means of real high temperature melt jets. Jet fragmentation as well as (coarse) fragmentation of melt drops are being investigated. The objective is to avoid as far as possible a fine fragmentation and thus to help prevent explosions. Therefore water is used close to boiling temperature. The pressure can be varied in a relevant range up to nearly 10 bar. The melt is created by a thermite reaction after which most of the iron is separated from the melt. In this way a predominantly oxide melt with temperatures of about 2700 K is produced. Preliminary experiments showed as a surprising result that melt jets can penetrate into the water as far as nearly 1 m depth before a violant evaporation comes about. (orig.)

Synthesis, Consolidation and Characterization of Sol-gel Derived Tantalum-Tungsten Oxide Thermite Composites

Energy Technology Data Exchange (ETDEWEB)

Cervantes, O [Univ. of California, Davis, CA (United States)

2010-06-01

Energetic composite powders consisting of sol-gel (SG) derived nanostructured tungsten oxide were produced with various amounts of micrometer-scale tantalum fuel metal. Such energetic composite powders were ignition-tested and results show that the powders are not sensitive to friction, spark and/or impact ignition. Initial consolidation experiments, using the High Pressure Spark Plasma Sintering (HPSPS) technique, on the SG derived nanostructured tungsten oxide produced samples with higher relative density than can be achieved with commercially available tungsten oxide. The SG derived nanostructured tungsten oxide with immobilized tantalum fuel metal (Ta - WO3) energetic composite was consolidated to a density of 9.17 g·cm-3 or 93% relative density. In addition, those samples were consolidated without significant pre-reaction of the constituents, thus retaining their stored chemical energy.

Calorimetric analysis of photopolymerization

International Nuclear Information System (INIS)

Hoyle, C.E.

1992-01-01

This review is divided into several sections. The first section establishes the basis for measurement of the heat evolution during polymerization by focusing on the chemical chain process that results in the exothermic production of heat. The second section describes the types of photocalorimeters and the methods and instrumentation involved in exothermic measurements. Considerable attention is given to the use of the differential scanning calorimeter to record the exothermic curves generated by photopolymerization of monofunctional and multifunctional monomers. The final section presents a thorough coverage of the results obtained by a large number of research groups using photocalorimetric measurements to provide a more accurate description of polymerization processes. 120 refs., 51 figs., 14 tabs

Nanodiamond for tuning the properties of energetic composites

Energy Technology Data Exchange (ETDEWEB)

Pichot, Vincent, E-mail: vincent.pichot@isl.eu; Comet, Marc, E-mail: marc.comet@isl.eu; Miesch, Julien, E-mail: julien.miesch@isl.eu; Spitzer, Denis, E-mail: denis.spitzer@gmail.eu

2015-12-30

Highlights: • Bismuth oxide (Bi{sub 2}O{sub 3}) particles were successfully coated by detonation nanodiamond (DND). • Small DND contents strongly desensitize the Bi{sub 2}O{sub 3}/Al nanothermites to friction. • DNDs limit the electrostatic discharge sensitivity of the Bi{sub 2}O{sub 3}/Al nanothermites. • Desensitization can be mainly explained by the barrier role of the nanodiamonds. • Nanothermites sensitivity levels and flame propagation velocities are tuned by DND content. - Abstract: Bismuth oxide (Bi{sub 2}O{sub 3}) particles were coated by detonation nanodiamonds. The resulting nanocomposite materials were mixed with an aluminum nanopowder (≈100 nm) to prepare nanothermites, with reduced sensitivity to friction and electrostatic discharge (ESD). The use of nanodiamond for this purpose is reported here for the first time. Their numerous qualities such as their small size, antifriction properties and thermal conductivity make them ideal candidates. Small amounts of detonation nanodiamonds allow obtaining impressive desensitization, making thus modified Bi{sub 2}O{sub 3}/Al nanothermite safe to handle. A composition containing around 1 wt.% of nanodiamond has a sensitivity threshold to friction superior to 100 N instead of 5 N for the thermite without nanodiamond. Furthermore, the sensitivity threshold to electrostatic discharge increases to 20 times when the nanodiamond content reaches 1.8 wt.%. The antifriction properties of nanodiamond limit the scratching of Bi{sub 2}O{sub 3} surface by Al particles. The desensitization to ESD is observed for a sufficient coverage of the oxide particles (1.8 wt.% of ND), which restrains the effect of the melt dispersion mechanism of aluminum and prevents the mixing of the oxidizing and the reducing parts of the composites. A good reactivity of the thermite could be maintained for nanodiamond content up to 2.6 wt.%. The carburizing of aluminum coming on contact with nanodiamond during the thermite reaction could

Investigations of the EPR reference concept (KATS experiments); Untersuchungen zum EPR-Referenz-Konzept (KATS-Experimente)

Energy Technology Data Exchange (ETDEWEB)

Fieg, G.; Werle, H.; Huber, F.

1995-08-01

The reference concept of an EPR core catcher envisages the spreading of the melt on a protective layer (150 m{sup 2} area) and water cooling from above. Two variants are considered: Spreading on a dry area and on an area covered by water of condensation (1 cm depth). For the reference concept the KATS experiments are performed with thermite melts. After initial problems had rendered it difficult to interprete the first test, repeated tests have been successful. (orig.)

Investigations of the EPR reference concept (KATS experiments)

International Nuclear Information System (INIS)

Fieg, G.; Werle, H.; Huber, F.

1995-01-01

The reference concept of an EPR core catcher envisages the spreading of the melt on a protective layer (150 m 2 area) and water cooling from above. Two variants are considered: Spreading on a dry area and on an area covered by water of condensation (1 cm depth). For the reference concept the KATS experiments are performed with thermite melts. After initial problems had rendered it difficult to interprete the first test, repeated tests have been successful. (orig.)

Thermal explosion analysis of methyl ethyl ketone peroxide by non-isothermal and isothermal calorimetric applications

International Nuclear Information System (INIS)

Chi, Jen-Hao; Wu, Sheng-Hung; Shu, Chi-Min

2009-01-01

In the past, process incidents attributed to organic peroxides (OPs) that involved near misses, over-pressures, runaway reactions, and thermal explosions occurred because of poor training, human error, incorrect kinetic assumptions, insufficient change management, and inadequate chemical knowledge in the manufacturing process. Calorimetric applications were employed broadly to test organic peroxides on a small-scale because of their thermal hazards, such as exothermic behavior and self-accelerating decomposition in the laboratory. In essence, methyl ethyl ketone peroxide (MEKPO) is highly reactive and exothermically unstable. In recent years, it has undergone many thermal explosions and runaway reaction incidents in the manufacturing process. Differential scanning calorimetry (DSC), vent sizing package 2 (VSP2), and thermal activity monitor (TAM) were employed to analyze thermokinetic parameters and safety index. The intent of the analyses was to facilitate the use of various auto-alarm equipments to detect over-pressure, over-temperature, and hazardous materials leaks for a wide spectrum of operations. Results indicated that MEKPO decomposition is detected at low temperatures (30-40 deg. C), and the rate of decomposition was shown to exponentially increase with temperature and pressure. Determining time to maximum rate (TMR), self-accelerating decomposition temperature (SADT), maximum temperature (T max ), exothermic onset temperature (T 0 ), and heat of decomposition (ΔH d ) was essential for identifying early-stage runaway reactions effectively for industries.

On the Existence of Hydrogen Salts of Monoprotic Acids

Science.gov (United States)

Stojanovska, Marina I.; Petrusevski, Vladimir M.; Soptrajanov, Bojan T.

2012-01-01

The notion that acid salts exist only for diprotic and polyprotic acids is found in many high school and university textbooks, although the "only" condition is not always stated explicitly. A fairly simple experiment shows that there is a pronounced exothermic effect when pure acetic acid is added to potassium acetate. Experiments with similar…

Experimental Study on Impact-Induced Reaction Characteristics of PTFE/Ti Composites Enhanced by W Particles

Directory of Open Access Journals (Sweden)

Yan Li

2017-02-01

Full Text Available Metal/fluoropolymer composites are a category of energetic structural materials that release energy through exothermic chemical reactions initiated under highly dynamic loadings. In this paper, the chemical reaction mechanism of PTFE (polytetrafluoroethylene/Ti/W composites is investigated through thermal analysis and composition analysis. These composites undergo exothermic reactions at 510 °C to 600 °C, mainly producing TiFx. The tungsten significantly reduces the reaction heat due to its inertness. In addition, the dynamic compression properties and impact-induced reaction behaviors of PTFE/Ti/W composites with different W content prepared by pressing and sintering are studied using Split Hopkinson Pressure Bar and high speed photography. The results show that both the mechanical strength and the reaction degree are significantly improved with the increasing strain rate. Moreover, as W content increases, the mechanical strength is enhanced, but the elasticity/plasticity is decreased. The PTFE/Ti/W composites tend to become more inert with the increasing W content, which is reflected by the reduced reaction degree and the increased reaction threshold for the impact ignition.

Complexant stability investigation. Task 2. Organic complexants

Energy Technology Data Exchange (ETDEWEB)

Martin, E.C.

1985-06-01

The safety of high-level defense waste operations has always been given highest priority at the Hanford site. This document is part of the continued effort to appraise and reevaluate the safety of the waste stored in underground tanks on the Hanford Reservation. Hanford high-level defense waste consists mainly of moist, inorganic salts, NaNO/sub 3/, NaAl(OH)/sub 4/, Na/sub 2/CO/sub 3/, and other sodium salts. However, in addition to these salts, quantities of organic compounds constitute a significant portion of the waste. The potential reaction of the organic compounds with inorganic salts to form explosive substances is examined and found to be nonexistent or negligible. The concept that the waste mixture might react exothermically is found to be untenable under the present storage conditions. The phenomenon of slurry growth in double-shell waste storage tanks is expected to cause no increase in exothermic reaction potential within the waste. The results of this study indicate that the presence of organic material in the high-level defense waste does not constitute undue hazard under the present storage conditions.

The COLIMA experiment on aerosol retention in containment leak paths under severe nuclear accidents

Energy Technology Data Exchange (ETDEWEB)

Parozzi, Flavio, E-mail: flavio.parozzi@rse-web.it [RSE, Power Generation Department, via Rubattino 54, I-20134 Milano (Italy); Caracciolo, Eduardo D.J., E-mail: eduardo.caracciolo@rse-web.it [RSE, Power Generation Department, via Rubattino 54, I-20134 Milano (Italy); Journeau, Christophe, E-mail: christophe.journeau@cea.fr [CEA Cadarache (France); Piluso, Pascal, E-mail: pascal.piluso@cea.fr [CEA Cadarache (France)

2013-08-15

Highlights: ► Experiment investigating aerosol retention within concrete containment cracks under nuclear severe accident conditions. ► Provided representative conditions of the aerosols suspended inside the containment of PWRs under a severe accident. ► Prototypical aerosol particles generated with a thermite reaction and transported through the crack sample reproducing surface characteristics, temperature, pressure drop and gas leakage. ► The results indicate the significant retention due to zig-zag path. -- Abstract: CEA and RSE managed an experimental research concerning the investigation of aerosol retention within concrete containment cracks under severe accident conditions. The main experiment was carried out in November 2008 with aerosol generated from the COLIMA facility and a sample of cracked concrete with defined geometric characteristics manufactured by RSE. The facility provided representative conditions of the aerosols suspended inside the containment of PWRs under a severe accident. Prototypical aerosol particles were generated with a thermite reaction and transported through the crack sample, where surface characteristics, temperature, pressure drop and gas leakage were properly reproduced. The paper describes the approach adopted for the preparation of the cracked concrete sample and the dimensioning of the experimental apparatus, the test procedure and the measured parameters. The preliminary results, obtained from this single test, are also discussed in the light of the present knowledge about aerosol phenomena and the theoretical analyses of particle behaviour with the crack path.

Response to Thermal Exposure of Ball-Milled Aluminum-Borax Powder Blends

Science.gov (United States)

Birol, Yucel

2013-04-01

Aluminum-borax powder mixtures were ball milled and heated above 873 K (600 °C) to produce Al-B master alloys. Ball-milled powder blends reveal interpenetrating layers of deformed aluminum and borax grains that are increasingly refined with increasing milling time. Thermal exposure of the ball-milled powder blends facilitates a series of thermite reactions between these layers. Borax, dehydrated during heating, is reduced by Al, and B thus generated reacts with excess Al to produce AlB2 particles dispersed across the aluminum grains starting at 873 K (600 °C). AlB2 particles start to form along the interface of the aluminum and borax layers. Once nucleated, these particles grow readily to become hexagonal-shaped crystals that traverse the aluminum grains with increasing temperatures as evidenced by the increase in the size as well as in the number of the AlB2 particles. Ball milling for 1 hour suffices to achieve a thermite reaction between borax and aluminum. Ball milling further does not impact the response of the powder blend to thermal exposure. The nucleation-reaction sites are multiplied, however, with increasing milling time and thus insure a higher number of smaller AlB2 particles. The size of the AlB2 platelets may be adjusted with the ball milling time.

Thermal abuse performance of high-power 18650 Li-ion cells

Science.gov (United States)

Roth, E. P.; Doughty, D. H.

High-power 18650 Li-ion cells have been developed for hybrid electric vehicle applications as part of the DOE Advanced Technology Development (ATD) program. The thermal abuse response of two advanced chemistries (Gen1 and Gen2) were measured and compared with commercial Sony 18650 cells. Gen1 cells consisted of an MCMB graphite based anode and a LiNi 0.85Co 0.15O 2 cathode material while the Gen2 cells consisted of a MAG10 anode graphite and a LiNi 0.80Co 0.15 Al 0.05O 2 cathode. Accelerating rate calorimetry (ARC) and differential scanning calorimetry (DSC) were used to measure the thermal response and properties of the cells and cell materials up to 400 °C. The MCMB graphite was found to result in increased thermal stability of the cells due to more effective solid electrolyte interface (SEI) formation. The Al stabilized cathodes were seen to have higher peak reaction temperatures that also gave improved cell thermal response. The effects of accelerated aging on cell properties were also determined. Aging resulted in improved cell thermal stability with the anodes showing a rapid reduction in exothermic reactions while the cathodes only showed reduced reactions after more extended aging.

Experimental Studies of Thermal Interactions at AEE Winfrith

International Nuclear Information System (INIS)

Briggs, A.J.

1976-01-01

Assessment of the consequences of very severe reactor accidents in which fuel is melted involves evaluation of the nature of any thermal interaction between molten fuel or cladding and the reactor coolant. Work on these problems has been pursued in many countries, both experimentally and theoretically, but although much progress has been made there is as yet no well established theoretical description of large scale efficient thermal interactions. The need for further experimental data in this area was one of the main reasons for establishing a new range of experimental facilities at Winfrith which provide the ability to carry out experiments involving explosions under safe conditions. Experiments are set up inside a strong test cell situated in the centre of a 200 m exclusion area. Instrumentation is provided for transient measurements of pressure and strain, and for high speed cine photography. The first part of this programme started early in 1975, and is concerned with the propagation of thermal interaction through a metal/water system. This programme is not yet complete but some results of interest have been obtained. The first part of this paper will describe these experiments and discuss the significance of the results currently available. Such studies of large scale metal/water interactions should help to provide an improved understanding of the way in which propagation might occur in the reactor case, but must be complemented by experiments using reactor materials. The second stage of the Winfrith programme will study the UO 2 /Na system directly. Facilities for the production of pure uranium burning thermite charges will be commissioned early in 1976. This chemical technique for producing molten UO 2 will be used in two main types of experiment. Firstly the interaction of a two phase bubble of UO 2 with a surrounding pool of Na will be studied, extending the investigations of this kind started at AWRE Foulness. Secondly, the heat transfer rate from UO 2

Production of hydrogen from organic waste via hydrogen sulfide

International Nuclear Information System (INIS)

McMahon, M.; Davis, B.R.; Roy, A.; Daugulis, A.

2007-01-01

In this paper an integrated process is proposed that converts organic waste to hydrogen via hydrogen sulphide. The designed bioreactor has achieved high volumetric productivities comparable to methanogenic bioreactors. Proposed process has advantages of bio-methane production and is more resilient to process upset. Thermochemical conversion of hydrogen sulphide to hydrogen is exothermic and also requires smaller plant infrastructure

Integrated Modeling and Experimental Studies at the Meso Scale for Advanced Reactive Materials

Science.gov (United States)

2016-07-01

CuO) thermite, and the metal/intermetallic system composed of titanium, silicon, and tita - nium, boron. A typical shock compaction experiment is...intense and weak chemical reactions recurring within a time interval of approximately 100 µ s. Similar results were observed for the tita - nium...region where there is only tita - nium (x < xf), from a region where there is only boron (x > xf). Since Y2 = 0 for x < xf, we find that a1 = −D13, b1

Hydrogen-induced amorphization of SmFe{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Kubis, M.; Handstein, A.; Gebel, B.; Gutfleisch, O.; Mueller, K.-H.; Schultz, L. [Institut fuer Festkoerper- und Werkstofforschung Dresden e.V. (Germany). Inst. fuer Metallische Werkstoffe

2000-07-01

The hydrogen absorption behavior of SmFe{sub 3} (PuNi{sub 3}-type structure) was observed in the range from 0.05 to 4 MPa by differential scanning calorimetry. The structural changes were observed by X-ray diffraction measurements. For pressures below 0.8 MPa two exothermic reactions were found which are attributed (i) to the interstitial absorption and (ii) to the disproportionation into SmH{sub 2} and {alpha}-Fe. For higher hydrogen pressures, the second exothermic peak occured at significantly lower temperatures and splitted into two peaks. The first one was identified as the exothermic signal of the hydrogen-induced amorphization of the SmFe{sub 3} hydride. The second peak is caused by the precipitation of SmH{sub 2} and {alpha}-Fe from the amorphous material. (orig.)

Experimental Assessment of Two Exothermic Systems to Neutralize Landmines

Science.gov (United States)

2006-02-01

quantité d’explosif moindre (mines antipersonnel) et les mines ayant de la bakélite ou des matériaux à enveloppes en plastique . Le produit de CIL...iron oxide melts and flows. The resultant molten slug burns through the casing of a mine/UXO and ignites the explosive contents. The concept is to...l’enveloppe de la mine/ UXO et enflamme les contenus explosifs. Le concept consiste à appliquer la thermique de manière à lui permettre de fondre à

Evidences for incipient hydrothermal event(s) in the Central Indian Basin: A review

Digital Repository Service at National Institute of Oceanography (India)

Iyer, S.D.

that on igniting thermite (Al+Fe 3 O 4 ) melt, a basalt analog in volcanic models, with quartzo-feldspathic materials and water in steel containers irregular aggregates, spheriods and blocky particles of 1 µm to 2 mm with basaltic melt composition are formed... Centers. New York: Plenum Press, 491–502. Bonatti, E., and Honnorez, J., 1976. Sections of the earth’s crust in the equatorial Atlantic. J. Geophys. Res., 81: 4104–4116. Boulegue, J., and Mariotti, A., 1990. Carbonate cements and fluid circulation...

Investigating potential physicochemical errors in polymer gel dosimeters

International Nuclear Information System (INIS)

Sedaghat, Mahbod; Lepage, Martin; Bujold, Rachel

2011-01-01

Measurement errors in polymer gel dosimetry can originate either during irradiation or scanning. One concern related to the exothermic nature of polymerization reaction was that the heat released in polymer gel dosimeters during irradiation modifies their dose response. In this paper, the effect of heat released from the exothermal polymerization reaction on the dose response of a number of dosimeters was studied. In addition, we investigated whether heat-generated geometric distortion existed in newly proposed gel dosimeters that contain highly thermoresponsive polymers. Our results suggest that despite a significant internal temperature increase in some gel compositions, their dose responses are not affected when oxygen is well expelled mechanically from the gel mixture. We also report on significant pre-irradiation instability in some recently developed polymer gel dosimeters but that geometric distortions were not observed. Data obtained by a set of small calibration vials are compared to those obtained from larger phantoms, and potential physicochemical causes of deviations between them are identified.

Investigating potential physicochemical errors in polymer gel dosimeters

Energy Technology Data Exchange (ETDEWEB)

Sedaghat, Mahbod; Lepage, Martin [Centre d' imagerie moleculaire de Sherbrooke, Departement de medecine nucleaire et radiobiologie, Universite de Sherbrooke, Sherbrooke, QC (Canada); Bujold, Rachel, E-mail: martin.lepage@usherbrooke.ca [Service de radio-oncologie, Centre hospitalier universitaire de Sherbrooke, Sherbrooke, QC (Canada)

2011-09-21

Measurement errors in polymer gel dosimetry can originate either during irradiation or scanning. One concern related to the exothermic nature of polymerization reaction was that the heat released in polymer gel dosimeters during irradiation modifies their dose response. In this paper, the effect of heat released from the exothermal polymerization reaction on the dose response of a number of dosimeters was studied. In addition, we investigated whether heat-generated geometric distortion existed in newly proposed gel dosimeters that contain highly thermoresponsive polymers. Our results suggest that despite a significant internal temperature increase in some gel compositions, their dose responses are not affected when oxygen is well expelled mechanically from the gel mixture. We also report on significant pre-irradiation instability in some recently developed polymer gel dosimeters but that geometric distortions were not observed. Data obtained by a set of small calibration vials are compared to those obtained from larger phantoms, and potential physicochemical causes of deviations between them are identified.

Ferrocyanide Safety Project Dynamic X-Ray Diffraction studies of sodium nickel ferrocyanide reactions with equimolar nitrate/nitrite salts

International Nuclear Information System (INIS)

Dodds, J.N.; UNOCAL, Brea, CA

1994-07-01

Dynamic X-ray Diffraction (DXRD) has been to used to identify and quantify the solid state reactions that take place between sodium nickel ferrocyanide, Na 2 NiFe(CN) 6 , and equimolar concentrations of sodium nitrate/nitrite, reactions of interest to the continued environmental safety of several large underground waste storage tanks at the Hanford site in eastern Washington. The results are supportive of previous work, which indicated that endothermic dehydration and melting of the nitrates take place before the occurrence of exothermic reactions that being about 300 degrees C. The DXRD results show that a major reaction set at these temperatures is the occurrence of a series reaction that produces sodium cyanate, NaCNO, as an intermediate in a mildly exothermic first step. In the presence of gaseous oxygen, NaCNO subsequently reacts exothermally and at a faster rate to form metal oxides. Measurements of the rate of this reaction are used to estimate the heat release. Comparisons of this estimated heat release rate with heat transfer rates from a hypothetical ''hot spot'' show that, even in a worst-case scenario, the heat transfer rates are approximately eight times higher than the rate of energy release from the exothermic reactions

Precipitation Processes during Non-Isothermal Ageing of Fine-Grained 2024 Alloy

Directory of Open Access Journals (Sweden)

Kozieł J.

2016-03-01

Full Text Available Mechanical alloying and powder metallurgy procedures were used to manufacture very fine-grained bulk material made from chips of the 2024 aluminum alloy. Studies of solution treatment and precipitation hardening of as-received material were based on differential scanning calorimetry (DSC tests and TEM/STEM/EDX structural observations. Structural observations complemented by literature data lead to the conclusion that in the case of highly refined structure of commercial 2024 alloys prepared by severe plastic deformation, typical multi-step G-P-B →θ” →θ’ →θ precipitation mechanism accompanied with G-P-B →S” →S’ →S precipitation sequences result in skipping the formation of metastable phases and direct growth of the stable phases. Exothermic effects on DSC characteristics, which are reported for precipitation sequences in commercial materials, were found to be reduced with increased milling time. Moreover, prolonged milling of 2024 chips was found to shift the exothermic peak to lower temperature with respect to the material produced by means of common metallurgy methods. This effect was concluded to result from preferred heterogeneous nucleation of particles at subboundaries and grain boundaries, enhanced by the boundary diffusion in highly refined structures.

Direct Measurements of Half-Cycle Reaction Heats during Atomic Layer Deposition by Calorimetry

Energy Technology Data Exchange (ETDEWEB)

Lownsbury, James M. [Department; Gladden, James A. [Department; Campbell, Charles T. [Department; Department; Kim, In Soo [Materials; Martinson, Alex B. F. [Materials

2017-10-05

We introduce a new high-temperature adsorption calorimeter that approaches the ideal limit of a heat detector whereby the signal at any time is proportional to the heat power being delivered to the sample and prove its sensitivity for measuring pulse-to-pulse heats of half-reactions during atomic layer deposition (ALD) at 400 K. The heat dynamics of amorphous Al2O3 growth via sequential self-limiting surface reaction of trimethylaluminum (TMA) and H2O is clearly resolved. Calibration enables quantitation of the exothermic TMA and H2O half-reactions with high precision, -343 kJ/mol TMA and -251 kJ/mol H2O, respectively. A time resolution better than 1 ms is demonstrated, allowing for the deconvolution of at least two distinct surface reactions during TMA microdosing. It is further demonstrated that this method can provide the heat of reaction versus extent of reaction during each precursors half-reaction, thus providing even richer mechanistic information on the surface processes involved. The broad applicability of this novel calorimeter is demonstrated through excellent signal-to-noise ratios of less exothermic ALD half-reactions to produce TiO2 and MnO.

Micro-chip initiator realized by integrating Al/CuO multilayer nanothermite on polymeric membrane

International Nuclear Information System (INIS)

Taton, G; Lagrange, D; Conedera, V; Rossi, C; Renaud, L

2013-01-01

We have developed a new nanothermite based polymeric electro-thermal initiator for non-contact ignition of a propellant. A reactive Al/CuO multilayer nanothermite resides on a 100 µm thick SU-8/PET (polyethyleneterephtalate) membrane to insulate the reactive layer from the silicon bulk substrate. When current is supplied to the initiator, the chemical reaction Al+CuO occurs and sparkles are spread to a distance of several millimeters. A micro-manufacturing process for fabricating the initiator is presented and the electrical behaviors of the ignition elements are also investigated. The characteristics of the initiator made on a 100 µm thick SU-8/PET membrane were compared to two bulk electro-thermal initiators: one on a silicon and one on a Pyrex substrate. The PET devices give 100% of Al/CuO ignition success for an electrical current >250 mA. Glass based reactive initiators give 100% of Al/CuO ignition success for an electrical current >500 mA. Reactive initiators directly on silicon cannot initiate even with a 4 A current. At low currents (<1 A), the initiation time is two orders of magnitude longer for Pyrex initiator compared to those obtained for PET initiator technology. We also observed that, the Al/CuO thermite film on PET membrane reacts within 1 ms (sparkles duration) whereas it reacts within 4 ms on Pyrex. The thermite reaction is 40 times greater in intensity using the PET substrate in comparison to Pyrex. (paper)

Highly efficient one-step synthesis of carbon encapsulated nanocrystals by the oxidation of metal π-complexes

Science.gov (United States)

Liu, Boyang; Shao, Yingfeng; Xiang, Xin; Zhang, Fuhua; Yan, Shengchang; Li, Wenge

2017-08-01

Various carbon encapsulated nanocrystals, including MnS and MnO, Cr2O3, MoO2, Fe7S8 and Fe3O4, and ZrO2, are prepared in one step and in situ by a simple and highly efficient synthesis approach. The nanocrystals have an equiaxed morphology and a median size smaller than 30 nm. Tens and hundreds of these nanocrystals are entirely encapsulated by a wormlike amorphous carbon shell. The formation of a core-shell structure depends on the strongly exothermic reaction of metal π-complexes with ammonium persulfate in an autoclave at below 200 °C. During the oxidation process, the generated significant amounts of heat will destroy the molecular structure of the metal π-complex and cleave the ligands into small carbon fragments, which further transform into an amorphous carbon shell. The central metal atoms are oxidized to metal oxide/sulfide nanocrystals. The formation of a core-shell structure is independent of the numbers of ligands and carbon atoms as well as the metal types, implying that any metal π-complex can serve as a precursor and that various carbon encapsulated nanocrystals can be synthesized by this method.

Investigations for the EPR-concept - KAPOOL and KATS experiments

International Nuclear Information System (INIS)

Engel, G.; Eppinger, B.; Fieg, G.; Schmidt-Stiefel, S.

2000-01-01

The objective of the KAPOOL and KATS experiments is to investigate basic phenomena in connection with the EPR melt spreading and cooling concept. High-temperature Al 2 O 3 - and Fe-melts produced by the thermite reaction are used to simulate the oxidic and metallic components of the core melt. Two KAPOOL tests have been performed to study the interaction of the oxidic melt with the release gate which is situated between the cavity and the spreading compartment. These tests have been analyzed with the HEATING-5 code and compared with the experimental results. With test KATS-17 (spreading onto dry concrete for the oxide melt, spreading onto concrete with 1 mm water level for the metallic melt) the series of two-dimensional spreading experiments has been finished. KATS-15 (2-dim spreading on dry ceramics) has been analyzed with the code CORFLOW. (orig.) [de

Simultaneous measurement of polymerization stress and curing kinetics for photo-polymerized composites with high filler contents.

Science.gov (United States)

Wang, Zhengzhi; Landis, Forrest A; Giuseppetti, Anthony A M; Lin-Gibson, Sheng; Chiang, Martin Y M

2014-12-01

Photopolymerized composites are used in a broad range of applications with their performance largely directed by reaction kinetics and contraction accompanying polymerization. The present study was to demonstrate an instrument capable of simultaneously collecting multiple kinetics parameters for a wide range of photopolymerizable systems: degree of conversion (DC), reaction exotherm, and polymerization stress (PS). Our system consisted of a cantilever beam-based instrument (tensometer) that has been optimized to capture a large range of stress generated by lightly-filled to highly-filled composites. The sample configuration allows the tensometer to be coupled to a fast near infrared (NIR) spectrometer collecting spectra in transmission mode. Using our instrument design, simultaneous measurements of PS and DC are performed, for the first time, on a commercial composite with ≈80% (by mass) silica particle fillers. The in situ NIR spectrometer collects more than 10 spectra per second, allowing for thorough characterization of reaction kinetics. With increased instrument sensitivity coupled with the ability to collect real time reaction kinetics information, we show that the external constraint imposed by the cantilever beam during polymerization could affect the rate of cure and final degree of polymerization. The present simultaneous measurement technique is expected to provide new insights into kinetics and property relationships for photopolymerized composites with high filler content such as dental restorative composites. Published by Elsevier Ltd.

A semi-automatic device for measuring osmotic pressures (1962); Un dispositif semi-automatique pour la mesure des pressions osmotiques (1962)

Energy Technology Data Exchange (ETDEWEB)

Lucarain, C [Commissariat a l' Energie Atomique, Saclay (France). Centre d' Etudes Nucleaires

1962-07-01

A cryoscopic apparatus for measuring osmotic pressure in small samples (0.1 ml) is described. The sample is frozen by air cooled dry ice or liquid nitrogen; the temperature is measured by a thermistor resistance and a recording millivoltmeter. (author) [French] Un appareil cryometrique pour la mesure des pressions osmotiques sur des petits echantillons (0,1 ml) est decrit. L'echantillon est congele par une circulation d'air refroidi par de la carboglace ou de l'azote liquide; sa temperature est mesuree par une thermitance associee a un millivoltmetre enregistreur. (auteur)

Recent technical progress in the French uranium industry

International Nuclear Information System (INIS)

Huet, H.

1961-01-01

This paper reviews the present-day uranium production situation in France. The various stages of the treatment the concentrates receive, leading to the final production of the metal, are described briefly: dissolution, purification by extraction with a mixture of tributyl phosphate and white spirit, precipitation with ammonia, drying and calcination of the trioxide, reduction with hydrogen, cracked ammonia or preferably pure ammonia gas, fluorination with anhydrous hydrofluoric acid, and production of the metal by the calcium thermite process. Recent work of an original nature is discussed in greater detail. (author) [fr

Extension of a Kinetic-Theory Approach for Computing Chemical-Reaction Rates to Reactions with Charged Particles

Science.gov (United States)

Liechty, Derek S.; Lewis, Mark J.

2010-01-01

Recently introduced molecular-level chemistry models that predict equilibrium and nonequilibrium reaction rates using only kinetic theory and fundamental molecular properties (i.e., no macroscopic reaction rate information) are extended to include reactions involving charged particles and electronic energy levels. The proposed extensions include ionization reactions, exothermic associative ionization reactions, endothermic and exothermic charge exchange reactions, and other exchange reactions involving ionized species. The extensions are shown to agree favorably with the measured Arrhenius rates for near-equilibrium conditions.

System Acquires Data On Reactivities Of Foams

Science.gov (United States)

Walls, Joe T.

1994-01-01

Data-acquisition and -plotting system, called DAPS(TM), developed enabling accurate and objective determination of physical properties related to reactivities of polyurethane and polyisocyanurate foams. Automated, computer-controlled test apparatus that acquires data on rates of rise, rise profiles, exothermic temperatures, and internal pressures of foams prepared from both manual and machine-mixed batches. Data used to determine minute differences between reaction kinetics and exothermic profiles of foam formulations, properties of end products which are statistically undifferentiated.

Chlorination of zirconium (0001) surface: A first-principles study.

Energy Technology Data Exchange (ETDEWEB)

Kim, Eunja [Univ. of Nevada, Las Vegas, NV (United States). Dept. of Physics and Astronomy; Weck, Philippe F [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Borjas, Rosendo [Univ. of Nevada, Las Vegas, NV (United States). Dept. of Chemistry; Poineau, Frederic [Univ. of Nevada, Las Vegas, NV (United States). Dept. of Chemistry

2017-01-01

Here, the mechanisms and energetics of Zr(0001) surface chlorination by dissociative adsorption of gaseous Cl₂, and associated speciation and surface degradation processes, have been investigated within the framework of density functional theory. Chlorination of Zr(0001) is predicted to be exothermic by ~3 eV/Cl for dissociative adsorption of a single Cl₂ molecule, followed by exothermic chlorination to 1ML and 2 ML under Cl-rich conditions, with respective energy gains of 1.93 and 2.79 eV/Cl. Calculations also show that exfoliation of the top Cl-Zr-Cl sandwich layers is exothermic and most energetically favorable, and can thus be considered as a leading mechanism for Zr(0001) surface dissolution. Consistent with experimental findings, formation of ZrCl₄ molecular products is also found to be dominant during Zr(0001) chlorination.

Chlorination of zirconium (0001) surface: A first-principles study

Energy Technology Data Exchange (ETDEWEB)

Kim, E. [Univ. of Nevada, Las Vegas, NV (United States). Department of Physics and Astronomy; Weck, Philippe F [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Poineau, F. [Univ. of Nevada, Las Vegas, NV (United States). Department of Chemistry; Paviet, P. [Dept. of Energy (DOE), Washington DC (United States)

2016-12-13

The mechanisms and energetics of Zr(0001) surface chlorination by dissociative adsorption of gaseous Cl₂, and associated speciation and surface degradation processes, have been investigated within the framework of density functional theory. Chlorination of Zr(0001) is predicted to be exothermic by 3 eV/Cl for dissociative adsorption of a single Cl₂ molecule, followed by exothermic chlorination to 1ML and 2 ML under Cl-rich conditions, with respective energy gains of 1.93 and 2.79 eV/Cl. Calculations also show that exfoliation of the top Cl-Zr-Cl sandwich layers is exothermic and most energetically favorable, and can thus be considered as a leading mechanism for Zr(0001) surface dissolution. Finally, consistent with experimental findings, formation of ZrCl₄ molecular products is also found to be dominant during Zr(0001) chlorination.

Results of an experiment in a Zion-like geometry to investigate the effect of water on the containment basement floor on direct containment heating (DCH) in the Surtsey Test Facility: The IET-4 test

International Nuclear Information System (INIS)

Allen, M.D.; Blanchat, T.K.; Pilch, M.; Nichols, R.T.

1992-09-01

This document discusses the fourth experiment of the Integral Effects Test (IET-4) series which was conducted to investigate the effects of high pressure melt ejection on direct containment heating. Scale models (1:10) of the Zion reactor pressure vessel (RPV), cavity, instrument tunnel, and subcompartment structures were constructed in the Surtsey Test Facility at Sandia National Laboratories. ne RPV was modeled with a melt generator that consisted of a steel pressure barrier, a cast MgO crucible, and a thin steel inner liner. The melt generator/crucible had a hemispherical bottom head containing a graphite limitor plate with a 3.5-cm exit hole to simulate the ablated hole in the RPV bottom head that would be tonned by tube ejection in a severe nuclear power plant accident. The reactor cavity model contained 3.48 kg of water with a depth of 0.9 cm that corresponded to condensate levels in the Zion plant. A 43-kg initial charge of iron oxide/aluminum/chromium thermite was used to simulate corium debris on the bottom head of the RPV. Molten thermite was ejected into the scaled reactor cavity by 6.7 MPa steam. IET-4 replicated the third experiment in the IET series (IET-3), except the Surtsey vessel contained slightly more preexisting oxygen (9.6 mol.% vs. 9.0 mol.%), and water was placed on the basement floor inside the crane wall. The cavity pressure measurements showed that a small steam explosion occurred in the cavity at about the same time as the steam explosion in IET-1. The oxygen in the Surtsey vessel in IET-4 resulted in a vigorous hydrogen bum, which caused a significant increase in the peak pressure, 262 kPa compared to 98 kPa in the IET-1 test. EET-3, with similar pre-existing oxygen concentrations, also had a large peak pressure of 246 kPa

Modeling and experimental performance of an intermediate temperature reversible solid oxide cell for high-efficiency, distributed-scale electrical energy storage

Science.gov (United States)

Wendel, Christopher H.; Gao, Zhan; Barnett, Scott A.; Braun, Robert J.

2015-06-01

Electrical energy storage is expected to be a critical component of the future world energy system, performing load-leveling operations to enable increased penetration of renewable and distributed generation. Reversible solid oxide cells, operating sequentially between power-producing fuel cell mode and fuel-producing electrolysis mode, have the capability to provide highly efficient, scalable electricity storage. However, challenges ranging from cell performance and durability to system integration must be addressed before widespread adoption. One central challenge of the system design is establishing effective thermal management in the two distinct operating modes. This work leverages an operating strategy to use carbonaceous reactant species and operate at intermediate stack temperature (650 °C) to promote exothermic fuel-synthesis reactions that thermally self-sustain the electrolysis process. We present performance of a doped lanthanum-gallate (LSGM) electrolyte solid oxide cell that shows high efficiency in both operating modes at 650 °C. A physically based electrochemical model is calibrated to represent the cell performance and used to simulate roundtrip operation for conditions unique to these reversible systems. Design decisions related to system operation are evaluated using the cell model including current density, fuel and oxidant reactant compositions, and flow configuration. The analysis reveals tradeoffs between electrical efficiency, thermal management, energy density, and durability.

Selective separation of cesium from simulated high level liquid waste solution using 1,3-dioctyloxy calix[4]arene-benzo-crown-6

International Nuclear Information System (INIS)

Vikas Kumar; Sharma, J.N.; Hubli, R.C.

2014-01-01

The 25,27-di(octyloxy)calix[4]arenebenzocrown-6 (CBC) in 1,3-alternate conformation was synthesized indigenously starting from its intermediates in good yield and purity. The extraction studies of CBC were carried out by using two different phase modifiers namely isodecyl alcohol and ortho-nitrophenyl hexyl ether. Detailed investigations on the effect of various parameters like, concentration of phase modifiers, aqueous phase acidity, ligand concentration, nitrate ion concentration and effect of temperature on extraction of cesium have been carried out. The concentration of phase modifiers was optimized to be 30 % in n-dodecane to ensure optimum extraction of cesium. Stoichiometry of the extracted complex determined by slope analysis method reveals 1:1:1 molar ratio for CsNO 3 :CBC:HNO 3 . The extraction process was found to be exothermic as determined from the plot of log K ex versus 1/T. The solvent system with a composition 0.01 M CBC/30 % phase modifier/n-dodecane was found to be effective for selective separation of cesium from simulated high level liquid waste solution. (author)

Physical-Chemical Characterization and Formulation Considerations for Solid Lipid Nanoparticles.

Science.gov (United States)

Chauhan, Harsh; Mohapatra, Sarat; Munt, Daniel J; Chandratre, Shantanu; Dash, Alekha

2016-06-01

Pure glyceryl mono-oleate (GMO) (lipid) and different batches of GMO commonly used for the preparation of GMO-chitosan nanoparticles were characterized by modulated differential scanning calorimetry (MDSC), cryo-microscopy, and cryo-X-ray powder diffraction techniques. GMO-chitosan nanoparticles containing poloxamer 407 as a stabilizer in the absence and presence of polymers as crystallization inhibitors were prepared by ultrasonication. The effect of polymers (polyvinyl pyrrolidone (PVP), Eudragits, hydroxyl propyl methyl cellulose (HPMC), polyethylene glycol (PEG)), surfactants (poloxamer), and oils (mineral oil and olive oil) on the crystallization of GMO was investigated. GMO showed an exothermic peak at around -10°C while cooling and another exothermic peak at around -12°C while heating. It was followed by two endothermic peaks between 15 and 30 C, indicative of GMO melting. The results are corroborated by cryo-microscopy and cryo-X-ray. Significant differences in exothermic and endothermic transition were observed between different grades of GMO and pure GMO. GMO-chitosan nanoparticles resulted in a significant increase in particle size after lyophilization. MDSC confirmed that nanoparticles showed similar exothermic crystallization behavior of lipid GMO. MDSC experiments showed that PVP inhibits GMO crystallization and addition of PVP showed no significant increase in particle size of solid lipid nanoparticle (SLN) during lyophilization. The research highlights the importance of extensive physical-chemical characterization for successful formulation of SLN.

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.

Additive-assisted synthesis of boride, carbide, and nitride micro/nanocrystals

International Nuclear Information System (INIS)

Chen, Bo; Yang, Lishan; Heng, Hua; Chen, Jingzhong; Zhang, Linfei; Xu, Liqiang; Qian, Yitai; Yang, Jian

2012-01-01

General and simple methods for the syntheses of borides, carbides and nitrides are highly desirable, since those materials have unique physical properties and promising applications. Here, a series of boride (TiB 2 , ZrB 2 , NbB 2 , CeB 6 , PrB 6 , SmB 6 , EuB 6 , LaB 6 ), carbide (SiC, TiC, NbC, WC) and nitride (TiN, BN, AlN, MgSiN 2 , VN) micro/nanocrystals were prepared from related oxides and amorphous boron/active carbon/NaN 3 with the assistance of metallic Na and elemental S. In-situ temperature monitoring showed that the reaction temperature could increase quickly to ∼850 °C, once the autoclave was heated to 100 °C. Such a rapid temperature increase was attributed to the intense exothermic reaction between Na and S, which assisted the formation of borides, carbides and nitrides. The as-obtained products were characterized by XRD, SEM, TEM, and HRTEM techniques. Results in this report will greatly benefit the future extension of this approach to other compounds. - Graphical abstract: An additive-assisted approach is successfully developed for the syntheses of borides, carbides and nitrides micro/nanocrystals with the assistance of the exothermic reaction between Na and S. Highlights: ► An additive-assisted synthesis strategy is developed for a number of borides, carbides and nitrides. ► The reaction mechanism is demonstrated by the case of SiC nanowires. ► The formation of SiC nanowires is initiated by the exothermic reaction of Na and S.

Breadnut peel as a highly effective low-cost biosorbent for methylene blue: Equilibrium, thermodynamic and kinetic studies

Directory of Open Access Journals (Sweden)

Linda B.L. Lim

2017-05-01

Full Text Available This work reports the potential use of peel of breadnut, Artocarpus camansi, as an effective low-cost biosorbent for the removal of methylene blue (MB. Oven dried A. camansi peel (ACP, which had a point of zero charge at pH = 4.8, showed maximum biosorption capacity which was far superior to most literature reported fruit biomasses, including samples that have been activated. Isotherm studies on biosorption of MB onto ACP gave a maximum biosorption capacity of 409 mg g−1. The Langmuir model was found to give the best fit among various isotherm models investigated and error analyses performed. Kinetics studies were fast with 50% dye being removed in less than 8 min from a 50 mg L−1 dye solution and further, kinetics followed the pseudo second order. Thermodynamic studies indicated that the biosorption process was both spontaneous and exothermic. Fourier transform infrared (FT-IR of ACP before and after MB adsorption was investigated. It can be concluded that oven dried breadnut peel is a highly promising low-cost biosorbent with great potential for the removal of MB.

High-excitation lines of deuterated formaldehyde (HDCO) in the Orion molecular cloud

International Nuclear Information System (INIS)

Loren, R.B.; Wootten, A.

1985-01-01

Five HDCO lines (up to 35 cm -1 ) have been detected in the narrow OMC-1 kinematic component. The best estimate of the [HDCO]/[H 2 CO] abundance ratio in OMC-1 is 0.01-0.03, at least an order of magnitude greater than the observed [DCO + ]/[HCO + ] abundance ratio. The [DCO + ]/[HCO + ] ratio greatly exceeds the [HDCO]/[H 2 CO] radio in cold clouds where the enhancement of both HDCO and DCO + abundances originates from H 2 D + . H 2 D + is abundant only at temperatures lower than found in OMC-1. The combination of a low [DCO + ]/[HCO + ] and high [HDCO]/[H 2 CO] abundance ratio in OMC-1 requires a different HDCO formation route at high temperature. This alternate HDCO formation path can occur because the exothermicity of the ion exchange reaction of HD and CH 3 + is greater than for the HD+H 3 + reaction. The CH 2 D + thus formed survives to higher temperatures than H 2 D + . Subsequent reactions with H 2 lead to CH 4 D + which by electronic recombination forms CH 2 D. The HDCO (H 2 CO) forms in the neutral-neutral reaction of CH 2 D (CH 3 ) and O. These reactions are not competitive in forming a variety of deuterated molecules at low temperatures since electronic recombination rapidly removes CH 2 D + and CH 4 D + ions while the abundant H 2 D + ion is slow to recombine, as reported by Smith and Adam in 1984

Sodium nitrate combustion limit tests

International Nuclear Information System (INIS)

Beitel, G.A.

1976-04-01

Sodium nitrate is a powerful solid oxidant. Energetically, it is capable of exothermically oxidizing almost any organic material. Rate-controlling variables such as temperature, concentration of oxidant, concentration of fuel, thermal conductivity, moisture content, size, and pressure severely limit the possibility of a self-supported exothermic reaction (combustion). The tests reported in this document were conducted on one-gram samples at atmospheric pressure. Below 380 0 C, NaNO 3 was stable and did not support combustion. At moisture concentrations above 22 wt percent, exothermic reactions did not propagate in even the most energetic and reactive compositions. Fresh resin and paraffin were too volatile to enable a NaNO 2 -supported combustion process to propagate. Concentrations of NaNO 3 above 95 wt percent or below 35 wt percent did not react with enough energy release to support combustion. The influence of sample size and confining pressure, both important factors, was not investigated in this study

CO2 Energy Reactor - Integrated Mineral Carbonation: Perspectives on Lab-Scale Investigation and Products Valorization

OpenAIRE

Rafael M Santos; Pol CM Knops; Keesjan L Rijnsburger; Yi Wai eChiang

2016-01-01

To overcome the challenges of mineral CO2 sequestration, Innovation Concepts B.V. is developing a unique proprietary gravity pressure vessel (GPV) reactor technology and has focussed on generating reaction products of high economic value. The GPV provides intense process conditions through hydrostatic pressurization and heat exchange integration that harvests exothermic reaction energy, thereby reducing energy demand of conventional reactor designs, in addition to offering other benefits. In ...

THERMAL STABILITY OF Al-Cu-Fe QUASICRYSTALS PREPARED BY SHS METHOD

OpenAIRE

Pavel Novák; Alena Michalcová; Milena Voděrová; Ivo Marek; Dalibor Vojtěch

2013-01-01

Quasicrystal-containing materials are usually prepared by rapid solidification of the melt (e.g. by melt spinning) or mechanical alloying. In this work, the method using exothermic reactions between compressed metallic powders called SHS (Self-propagating High-temperature Synthesis) was tested. The microstructure and phase composition of the product was described in dependence on cooling regime from the reaction temperature. Thermal stability of prepared Al-Cu-Fe quasicrystals was studied by...

High-temperature resistant MeCrAlY+Al coatings obtained by ARC-PVD method on Ni Base superalloys

International Nuclear Information System (INIS)

Swadzba, L.; Maciejny, A.; Mendala, B.; Supernak, W.

1999-01-01

Investigations of obtaining high temperature coatings on the Ni base superalloys by the ARC-PVD method, using exothermic reaction processes between Ni and Al with NiAl intermetallic formation are presented in the article. By the diffusion heating at 1050 o C NiAl high temperature diffusion coating containing 21% at. Al and 50 μm thick was obtained. In the next stage coatings with more complex chemical composition NiCoCrAlY were formed. The two targets were applied for formation of complex NiCoCrAlY coatings. The good consistence between the chemical composition of the targets and the coatings and an uniform distribution of elements in the coatings were shown. Then the surface was covered with aluminium also by the ARC-PVD method. In the vacuum chamber of the equipment a synthesis reaction between NiCoCrAlY and Al with the formation NiAl intermetallics of high Co, Cr, Y content was initiated by the changes in process parameters. The final heat treatment of coatings was conducted in the air and vacuum at 1050 o C. The strong segregation of yttrium in to the oxide scale in the specimens heated in the air was shown. It was possible to obtain NiAl intermetallic phase coatings modified by Co, Cr and Y by the ARC-PVD method. An example of the application of this method for the aircraft engine turbine blades was presented. Method of ARC-PVD gives the possibility chemical composition and high resistance to oxidizing and hot corrosion. (author)

System and method for regeneration and recirculation of a reducing agent using highly exothermic reactions induced by mixed industrial slags

Science.gov (United States)

Nakano, Jinichiro; Bennett, James P.; Nakano, Anna

2017-12-12

Embodiments relate to systems and methods for regenerating and recirculating a CO, H.sub.2 or combinations thereof utilized for metal oxide reduction in a reduction furnace. The reduction furnace receives the reducing agent, reduces the metal oxide, and generates an exhaust of the oxidized product. The oxidized product is transferred to a mixing vessel, where the oxidized product, a calcium oxide, and a vanadium oxide interact to regenerate the reducing agent from the oxidized product. The regenerated reducing agent is transferred back to the reduction furnace for continued metal oxide reductions.

CONDENSED MATTER: STRUCTURE, MECHANICAL, AND THERMAL PROPERTIES: Observation of β-Relaxation in Sub-Tg Isothermally Annealed Al-Based Metallic Glasses

Science.gov (United States)

Yang, Hong-Wang; Tong, Wei-Ping; Zhao, Xiang; Zuo, Liang; Wang, Jian-Qiang

2008-09-01

Al85 Ni5 Y8 C02 and Al 85 Ni5 Y6 C02 Fe2 metallic glasses are fabricated by melt spinning. A kink or a small exothermic peak is observed for both the samples isothermally annealed at sub-glass transition temperatures. Temperature modulated differential scanning calorimetry (TMDSC) data disapprove amorphous phase separation. The activation energies derived from Kissinger plots of the exothermic process on DSC curve around glass transition temperature are consistent with those of β -relaxation of metallic glasses.

Method for producing bio-fuel that integrates heat from carbon-carbon bond-forming reactions to drive biomass gasification reactions

Science.gov (United States)

Cortright, Randy D [Madison, WI; Dumesic, James A [Verona, WI

2011-01-18

A low-temperature catalytic process for converting biomass (preferably glycerol recovered from the fabrication of bio-diesel) to synthesis gas (i.e., H.sub.2/CO gas mixture) in an endothermic gasification reaction is described. The synthesis gas is used in exothermic carbon-carbon bond-forming reactions, such as Fischer-Tropsch, methanol, or dimethylether syntheses. The heat from the exothermic carbon-carbon bond-forming reaction is integrated with the endothermic gasification reaction, thus providing an energy-efficient route for producing fuels and chemicals from renewable biomass resources.

Combustion of environmentally altered molybdenum trioxide nanocomposites

Energy Technology Data Exchange (ETDEWEB)

Moore, Kevin; Pantoya, Michelle L. [Mechanical Engineering Department, Texas Tech University, 2500 Broadway, Lubbock, TX 79409 (United States)

2006-06-15

Nanocomposite thermite mixtures are currently under development for many primer applications due to their high energy densities, high ignition sensitivity, and low release of toxins into the environment. However, variability and inconsistencies in combustion performance have not been sufficiently investigated. Environmental interactions with the reactants are thought to be a contributing factor to these variabilities. Combustion velocity experiments were conducted on aluminum (Al) and molybdenum trioxide (MoO{sub 3}) mixtures to investigate the role of environmental interactions such as light exposure and humidity. While the Al particles were maintained in an ambient, constant environment, the MoO{sub 3} particles were exposed to UV or fluorescent light, and highly humid environments. Results show that UV and fluorescent lighting over a period of days does not significantly contribute to performance deterioration. However, a humid environment severely decreases combustion performance if the oxidizer particles are not heat-treated. Heat treatment of the MoO{sub 3} greatly increases the material's ability to resist water absorption, yielding more repeatable combustion performance. This work further quantifies the role of the environment in the decrease of combustion performance of nanocomposites over time. (Abstract Copyright [2006], Wiley Periodicals, Inc.)

GAS-PHASE SYNTHESIS OF PRECURSORS OF INTERSTELLAR GLYCINE: A COMPUTATIONAL STUDY OF THE REACTIONS OF ACETIC ACID WITH HYDROXYLAMINE AND ITS IONIZED AND PROTONATED DERIVATIVES

Energy Technology Data Exchange (ETDEWEB)

Barrientos, Carmen; Redondo, Pilar; Largo, Laura; Rayon, Victor M.; Largo, Antonio, E-mail: alargo@qf.uva.es [Departamento de Quimica Fisica y Quimica Inorganica, Facultad de Ciencias, Universidad de Valladolid, 47005 Valladolid (Spain)

2012-04-01

A computational study of the reactions of hydroxylamine and its ionized and protonated derivatives with acetic acid is provided. The reaction of neutral hydroxylamine with acetic acid, despite being clearly exothermic, involves a very large energy barrier. The reaction of ionized hydroxylamine with acetic acid is also clearly exothermic, but again a significant energy barrier is found (around 24 kcal mol{sup -1} at the CCSD(T) level). The reaction of the most stable protonated isomer of hydroxylamine, NH{sub 3}OH{sup +}, with acetic acid also involves a high barrier (more than 27 kcal mol{sup -1} at the CCSD(T) level). Only the higher energy isomer, NH{sub 2}OH{sup +}{sub 2}, leads to a sensibly lower energy barrier (about 2.3 kcal mol{sup -1} at the CCSD(T) level). Nevertheless, an estimate of the reaction coefficient at low temperatures such as those reigning in the interstellar medium gives very low values. Therefore, it seems that precursors of interstellar glycine could not be efficiently produced from the reactions of hydroxylamine-derived ions with acetic acid.

GAS-PHASE SYNTHESIS OF PRECURSORS OF INTERSTELLAR GLYCINE: A COMPUTATIONAL STUDY OF THE REACTIONS OF ACETIC ACID WITH HYDROXYLAMINE AND ITS IONIZED AND PROTONATED DERIVATIVES

International Nuclear Information System (INIS)

Barrientos, Carmen; Redondo, Pilar; Largo, Laura; Rayón, Víctor M.; Largo, Antonio

2012-01-01

A computational study of the reactions of hydroxylamine and its ionized and protonated derivatives with acetic acid is provided. The reaction of neutral hydroxylamine with acetic acid, despite being clearly exothermic, involves a very large energy barrier. The reaction of ionized hydroxylamine with acetic acid is also clearly exothermic, but again a significant energy barrier is found (around 24 kcal mol –1 at the CCSD(T) level). The reaction of the most stable protonated isomer of hydroxylamine, NH 3 OH + , with acetic acid also involves a high barrier (more than 27 kcal mol –1 at the CCSD(T) level). Only the higher energy isomer, NH 2 OH + 2 , leads to a sensibly lower energy barrier (about 2.3 kcal mol –1 at the CCSD(T) level). Nevertheless, an estimate of the reaction coefficient at low temperatures such as those reigning in the interstellar medium gives very low values. Therefore, it seems that precursors of interstellar glycine could not be efficiently produced from the reactions of hydroxylamine-derived ions with acetic acid.

Evaluation of HWVP feed preparation chemistry for an NCAW simulant -- Fiscal Year 1991: Evaluation of offgas generation, reductant requirements and thermal stability: Technical report

International Nuclear Information System (INIS)

Wiemers, K.D.; Langowski, M.H.; Powell, M.R.; Larson, D.E.

1996-03-01

The Hanford Waste Vitrification Plant (HWVP) is being designed for the Department of Energy to immobilize pretreated radioactive high-level waste and transuranic waste as glass for permanent disposal. Laboratory studies were conducted to characterize HWVP slurry chemistry during selected processing steps, using pretreated Neutralized Current Acid Waste (NCAW) simulant. Laboratory tests were designed to provide bases for determining the potential for hazardous gas generation, making chemical adjustments for glass redox control, and assessing the potential for rapid exothermic reactions of dried NCAW slurry. Offgas generation rates and the total moles of gas released as a function of selected pretreated NCAW components and process variables were measured. An emphasis was placed on identifying conditions that initiate significant H 2 generation. Glass redox measurements, using Fe +2 /ΣFe as an indicator of the glass oxidation state, were made to develop guidelines for HCOOH addition. Thermal analyses of dried NCAW simulant were conducted to assess the potential of a rapid uncontrollable exothermic reaction in the chemical processing cell tanks

Miniature thermal matches: from nanoheaters to reactive fractals

International Nuclear Information System (INIS)

Rebholz, Claus; Gunduz, Ibrahim Emre; Ando, Teiichi; Doumanidis, Charalabos C

2015-01-01

Fine thermal actuation by miniature heat sources enables applications from electronics fabrication to tumor cauterization. This paper introduces the concept of nanoheaters, i.e., reactive bimetallic material dots (0D), ignited electrically to exothermically release precise heat amounts where and when needed. This concept is extended to nanoheater wires (1D) and foils (2D), as well as bulk nanoheaters (3D) manufactured via ball milling and ultrasonic consolidation of nickel and aluminum powders. The fractal structure of such powders and consolidates, with self-similar, multiscale Apollonian or lamellar packaging, is discovered to hold the key for their ignition sensitivity: nanoscale structures ignite first, to produce enough heat and raise the temperature of submicron formations, which then ignite microscale regions and so on; while inert areas quench and arrest the self-propagating exothermic reaction. Therefore, such engineered fractal reactive heaters lend themselves to affordable, high-throughput manufacture and controllable, safe, efficient, supplyless in situ thermal release. This can be transformative for innovations from self-healing composites and self-heating packages to underwater construction and mining. (paper)

Critical ignition conditions in exothermically reacting systems: first-order reactions

Science.gov (United States)

Filimonov, Valeriy Yu.

2017-10-01

In this paper, the comparative analysis of the thermal explosion (TE) critical conditions on the planes temperature-conversion degree and temperature-time was conducted. It was established that the ignition criteria are almost identical only at relatively small values of Todes parameter. Otherwise, the results of critical conditions analysis on the plane temperature-conversion degree may be wrong. The asymptotic method of critical conditions calculation for the first-order reactions was proposed (taking into account the reactant consumption). The degeneration conditions of TE were determined. The calculation of critical conditions for specific first-order reaction was made. The comparison of the analytical results obtained with the results of numerical calculations and experimental data showed that they are in good agreement.

Critical ignition conditions in exothermically reacting systems: first-order reactions.

Science.gov (United States)

Filimonov, Valeriy Yu

2017-10-01

In this paper, the comparative analysis of the thermal explosion (TE) critical conditions on the planes temperature-conversion degree and temperature-time was conducted. It was established that the ignition criteria are almost identical only at relatively small values of Todes parameter. Otherwise, the results of critical conditions analysis on the plane temperature-conversion degree may be wrong. The asymptotic method of critical conditions calculation for the first-order reactions was proposed (taking into account the reactant consumption). The degeneration conditions of TE were determined. The calculation of critical conditions for specific first-order reaction was made. The comparison of the analytical results obtained with the results of numerical calculations and experimental data showed that they are in good agreement.

Temperature stabilisation in Fischer–Tropsch reactors using phase change material (PCM)

International Nuclear Information System (INIS)

Odunsi, Ademola O.; O'Donovan, Tadhg S.; Reay, David A.

2016-01-01

The Fischer–Tropsch (FT) reaction is highly exothermic. The exothermicity combined with a high sensitivity of product selectivity to temperature constitute the main challenges in the design of FT reactors. Temperature control is particularly critical to the process in order to ensure longevity of the catalyst, optimise the product distribution, and to ensure thermo-mechanical reliability of the entire process. The use of encapsulated, Phase Change Material (PCM), in conjunction with a supervisory temperature control mechanism, could help mitigate these challenges and intensify the heat transport from the reactor. A 2D-axisymmetric, pseudo-homogeneous, steady-state model, with the dissipation of the enthalpy of reaction into an isothermal PCM sink, in a wall-cooled, single-tube fixed bed reactor is presented. Effective temperature control shows a shift in thermodynamic equilibrium, favouring the selectivity of longer chain hydrocarbons (C_5_+) to the disadvantage of CH_4 selectivity-a much desired outcome in the hydrocarbon Gas-to-Liquid (GTL) industry. - Highlights: • Phase change material is used to control temperature in a Fischer–Tropsch reactor. • Effective temperature control favours the production of C_5_+ over CH_4. • A 2D-axisymmetric, steady-state model is presented. • The model is verified against similar experimental work done in literature.

Influence of cobalt and chromium additions on the precipitation processes in a Cu-4Ti alloys; Influencia de la adicion de cobalto y cromo en el proceso de precipitacion en una aleacion de Cu-4Ti

Energy Technology Data Exchange (ETDEWEB)

Donoso, E.

2010-07-01

The influence of 0.5% atomic cobalt and 1% atomic chromium additions on the precipitation hardening of Cu-4Ti alloy was studied by differential scanning calorimetry (DSC) and microhardness measurements. The analysis of the calorimetric curves, for binary alloy, shows the presence of two overlapping exothermic reactions (stages 1 and 2) attributed to the formation of Cu{sub 4}Ti and Cu{sub 3}Ti particles in the copper matrix, respectively. DSC curves for Cu-4Ti-0.5Co alloy shows three exothermic effects (overlapping stages 3 and 4 and stage 5) associated to the formation of phases Ti{sub 2}Co, TiCo and Cu{sub 4}Ti, respectively. DSC curves for Cu-4Ti1Cr alloy shows three exothermic reactions (stages 6, 7 and 9) and one endothermic peak (stage 8). The exothermic reactions correspond to the formation of phases Cr{sub 2}Ti, Cu{sub 4}Ti and Cu{sub 3}Ti, respectively, and the endothermic reactions are attributed to the Cr{sub 2}Ti dissolution. The activation energies calculated using the modified Kissinger method were lower than the ones corresponding to diffusion of cobalt, chromium, and titanium in copper. Kinetic parameters were obtained by a convolution method based on the Johnson-Mehl-Avrami (JMA) formalism. Microhardness measurements confirmed the formation of the mentioned phases. Also, these measurements confirmed the effect of cobalt and chromium addition on the binary alloy hardness. (Author). 31 refs.

Modelling transient energy release from molten fuel coolant interaction debris

International Nuclear Information System (INIS)

Fletcher, D.F.

1984-05-01

A simple model of transient energy release in a Molten Fuel Coolant Interaction is presented. A distributed heat transfer model is used to examine the effect of heat transfer coefficient, time available for rapid energy heat transfer and particle size on transient energy release. The debris is assumed to have an Upper Limit Lognormal distribution. Model predictions are compared with results from the SUW series of experiments which used thermite-generated uranium dioxide molybdenum melts released below the surface of a pool of water. Uncertainties in the physical principles involved in the calculation of energy transfer rates are discussed. (author)

Simulated fuel melt movement and relocation in two seven-pin-bundle geometries (SIMBATH out-of-pile experiments Vsub(Th) 74; Vsub(Th) 79)

International Nuclear Information System (INIS)

Peppler, W.; Menzenhauer, P.; Will, H.

1983-11-01

The SIMBATH program was initiated to investigate the physical phenomena of transient material movement and relocation during transient overpower (TOP) and loss of flow (LOF) driven TOP accidents in LMFBR's. The energy release during the accident is simulated out of pile by the reaction of a thermite mixture. Two 7-pin experiments have been performed using flowing sodium. In both tests the transient material movement has been recorded by X-ray-cinematography at about 1000 frames per second. The tests have been analysed. The dominant physical phenomena governing the material movement have been estimated. (orig.) [de

Molten core debris-sodium interactions: M-Series experiments

International Nuclear Information System (INIS)

Sowa, E.S.; Gabor, J.D.; Pavlik, J.R.; Cassulo, J.C.; Cook, C.J.; Baker, L. Jr.

1979-01-01

Five new kilogram-scale experiments have been carried out. Four of the experiments simulated the situation where molten core debris flows from a breached reactor vessel into a dry reactor cavity and is followed by a flow of sodium (Ex-vessel case) and one experiment simulated the flow of core debris into an existing pool of sodium (In-vessel case). The core debris was closely simulated by a thermite reaction which produced a molten mixture of UO 2 , ZrO 2 , and stainless steel. There was efficient fragmentation of the debris in all experiments with no explosive interactions observed

Use of Crystalline Boron as a Burn Rate Retardant Toward the Development of Green-Colored Handheld Signal Formulations

Science.gov (United States)

2011-01-01

emitter and formed magnesium oxide (MgO) in a highly exothermic process upon reacting with barium nitrate. Although it served as a low-energy fuel...nitric acid under boiling conditions, it fails to react when treated with boiling hydrofluoric and hydrochloric acids [13]. Table 3 Performance of...fuel. It is believed that amorphous boron, when reacted with oxygen, forms metastable boron oxide (BO2) in the excited state, which is responsible for

A feasibility study for high-temperature titanium reduction from TiCl4 using a magnesiothermic process

Science.gov (United States)

Ivanov, S. L.; Zablotsky, D.

2018-05-01

The current industrial practice for titanium extraction is a complex procedure, which produces a porous reaction mass of sintered titanium particulates fused to a steel retort wall with magnesium and MgCl2 trapped in the interstices. The reactor temperature is limited to approx. 900 °C due to the formation of fusible TiFe eutectic, which corrodes the retort and degrades the quality of titanium sponge. Here we examine the theoretical foundations and technological possibilities to design a shielded retort of niobium-zirconium alloy NbZr(1%), which is resistant to corrosion by titanium at high temperature. We consider the reactor at a temperature of approx. 1150 °C. Supplying stoichiometric quantities of reagents enables the reaction in the gas phase, whereas the exothermic process sustains the combustion of the reaction zone. When the pathway to the condenser is open, vacuum separation and evacuation of vaporized magnesium dichloride and excess magnesium into the water-cooled condenser take place. As both the reaction and the evacuation occur within seconds, the yield of the extraction is improved. We anticipate new possibilities for designing a device combining the retort function to conduct the reduction in the gas phase with fast vacuum separation of the reaction products and distillation of magnesium dichloride.

Effects of Fuel to Synthesis of CaTiO3 by Solution Combustion Synthesis for High-Level Nuclear Waste Ceramics.

Science.gov (United States)

Jung, Choong-Hwan; Kim, Yeon-Ku; Han, Young-Min; Lee, Sang-Jin

2016-02-01

A solution combustion process for the synthesis of perovskite (CaTiO3) powders is described. Perovskite is one of the crystalline host matrics for the disposal of high-level radioactive wastes (HLW) because it immobilizes Sr and Lns elements by forming solid solutions. Solution combustion synthesis, which is a self-sustaining oxi-reduction reaction between nitrate and organic fuel, the exothermic reaction, and the heat evolved convert the precursors into their corresponding oxide products above 1100 degrees C in air. To investigate the effects of amino acid on the combustion reaction, various types of fuels were used; a glycine, amine and carboxylic ligand mixture. Sr, La and Gd-nitrate with equivalent amounts of up to 20% of CaTiO3 were mixed with Ca and Ti nitrate and amino acid. X-ray diffraction analysis, SEM and TEM were conducted to confirm the formed phases and morphologies. While powders with an uncontrolled shape are obtained through a general oxide-route process, Ca(Sr, Lns)TiO3 powders with micro-sized soft agglomerates consisting of nano-sized primary particles can be prepared using this method.

Strategy for designing stable and powerful nitrogen-rich high-energy materials by introducing boron atoms.

Science.gov (United States)

Wu, Wen-Jie; Chi, Wei-Jie; Li, Quan-Song; Li, Ze-Sheng

2017-06-01

One of the most important aims in the development of high-energy materials is to improve their stability and thus ensure that they are safe to manufacture and transport. In this work, we theoretically investigated open-chain N 4 B 2 isomers using density functional theory in order to find the best way of stabilizing nitrogen-rich molecules. The results show that the boron atoms in these isomers are aligned linearly with their neighboring atoms, which facilitates close packing in the crystals of these materials. Upon comparing the energies of nine N 4 B 2 isomers, we found that the structure with alternating N and B atoms had the lowest energy. Structures with more than one nitrogen atom between two boron atoms had higher energies. The energy of N 4 B 2 increases by about 50 kcal/mol each time it is rearranged to include an extra nitrogen atom between the two boron atoms. More importantly, our results also show that boron atoms stabilize nitrogen-rich molecules more efficiently than carbon atoms do. Also, the combustion of any isomer of N 4 B 2 releases more heat than the corresponding isomer of N 4 C 2 does under well-oxygenated conditions. Our study suggests that the three most stable N 4 B 2 isomers (BN13, BN24, and BN34) are good candidates for high-energy molecules, and it outlines a new strategy for designing stable boron-containing high-energy materials. Graphical abstract The structural characteristics, thermodynamic stabilities, and exothermic properties of nitrogen-rich N 4 B 2 isomers were investigated by means of density functional theory.

Biomass pyrolysis and combustion integral and differential reaction heats with temperatures using thermogravimetric analysis/differential scanning calorimetry.

Science.gov (United States)

Shen, Jiacheng; Igathinathane, C; Yu, Manlu; Pothula, Anand Kumar

2015-06-01

Integral reaction heats of switchgrass, big bluestem, and corn stalks were determined using thermogravimetric analysis/differential scanning calorimetry (TGA/DSC). Iso-conversion differential reaction heats using TGA/DSC pyrolysis and combustion of biomass were not available, despite reports available on heats required and released. A concept of iso-conversion differential reaction heats was used to determine the differential reaction heats of each thermal characteristics segment of these materials. Results showed that the integral reaction heats were endothermic from 30 to 700°C for pyrolysis of switchgrass and big bluestem, but they were exothermic for corn stalks prior to 587°C. However, the integral reaction heats for combustion of the materials followed an endothermic to exothermic transition. The differential reaction heats of switchgrass pyrolysis were predominantly endothermic in the fraction of mass loss (0.0536-0.975), and were exothermic for corn stalks (0.0885-0.850) and big bluestem (0.736-0.919). Study results provided better insight into biomass thermal mechanism. Published by Elsevier Ltd.

Reactive chemicals and process hazards

International Nuclear Information System (INIS)

Surianarayanan, M.

2016-01-01

Exothermic chemical reactions are often accompanied by significant heat release, and therefore, need a thorough investigation before they are taken to a plant scale. Sudden thermal energy releases from exothermic decompositions and runaway reactions have contributed to serious fire and explosions in several chemical process plants. Similarly, thermal runaway had also occurred in storage and transportation of reactive chemicals. The secondary events of thermal runaway reactions can be rupture of process vessel, toxic spills and release of explosive vapor clouds or combination of these also. The explosion hazards are governed by the system thermodynamics and kinetics of the thermal process. Theoretical prediction of limiting temperature is difficult due to process complexities. Further, the kinetic data obtained through classical techniques, at conditions far away from runaway situation, is often not valid for assessing the runaway behavior of exothermic processes. The main focus of this lecture is to discuss the causes and several contributing factors for thermal runaway and instability and present analyses of the methodologies of the new instrumental techniques for assessing the thermal hazards of reactive chemicals during processing, storage and transportation. (author)

Microstructure and strain rate effects on the mechanical behavior of particle reinforced epoxy-based reactive materials

Science.gov (United States)

White, Bradley William

The effects of reactive metal particles on the microstructure and mechanical properties of epoxy-based composites is investigated in this work. Particle reinforced polymer composites show promise as structural energetic materials that can provide structural strength while simultaneously being capable of releasing large amounts of chemical energy through highly exothermic reactions occurring between the particles and with the matrix. This advanced class of materials is advantageous due to the decreased amount of high density inert casings needed for typical energetic materials and for their ability to increase payload expectancy and decrease collateral damage. Structural energetic materials can be comprised of reactive particles that undergo thermite or intermetallic reactions. In this work nickel (Ni) and aluminum (Al) particles were chosen as reinforcing constituents due to their well characterized mechanical and energetic properties. Although, the reactivity of nickel and aluminum is well characterized, the effects of their particle size, volume fractions, and spatial distribution on the mechanical behavior of the epoxy matrix and composite, across a large range of strain rates, are not well understood. To examine these effects castings of epoxy reinforced with 20--40 vol.% Al and 0--10 vol.% Ni were prepared, while varying the aluminum nominal particle size from 5 to 50 mum and holding the nickel nominal particle size constant at 50 mum. Through these variations eight composite materials were produced, possessing unique microstructures exhibiting different particle spatial distributions and constituent makeup. In order to correlate the microstructure to the constitutive response of the composites, techniques such as nearest-neighbor distances, and multiscale analysis of area fractions (MSAAF) were used to quantitatively characterize the microstructures. The composites were investigated under quasi-static and dynamic compressive loading conditions to characterize

Endohedral complexes of Polyhedral Oligomeric Silsesquioxane (POSS) cages with transition metal dihydrides

Energy Technology Data Exchange (ETDEWEB)

Wang, Xiqiao; Corn, John; Hagelberg, Frank, E-mail: hagelber@etsu.edu

2013-11-29

Highlights: • Comparative studies of POSS cages with endohedral metal dihydrides. • Exothermic inclusion was found for the T{sub 10} cage with MH{sub 2}, M = Ti, Ru, Os, Pt. • Within this group of metal atoms, the only exothermic MH{sub 4}@T{sub m} unit is that with M = Os. • Enhanced hydrogen atom density, as compared to free MH{sub 4}, was found in the cage. • No exothermic solutions were identified for MH{sub 6}@T{sub 10}. - Abstract: Polyhedral Oligomeric Silsesquioxane (POSS) cages are investigated in terms of their potential to enclose small metal hydrides, with the objective of defining conditions that maximize the number of encapsulated hydrogen atoms. Systems of the form MH{sub 2n}@T{sub m}, where n = 1–3, m = 8, 10, and M comprises metal atom species of the groups IV, VI, VIII, X, and XII, are studied by methods of ab initio and density functional theory (DFT). The resulting composites are categorized with respect to their structural and energetic features. For MH{sub 2}@T{sub 8}, it is found in all cases considered that including MH{sub 2} into the POSS cage is an endothermic process. For MH{sub 2}@T{sub 10} and M = Ti, Ru, Os, Pt, inclusion of the MH{sub 2} guest into the cage turns out to be exothermic, and also leaves the cage intact. For MH{sub 4}@T{sub m}, this behavior is only observed for one system, OsH{sub 4}@T{sub 10}.

Influencia de la adición de estaño en el proceso de precipitación en una aleación de Cu-Ni-Zn

OpenAIRE

Donoso, Eduardo C.; Diánez, Mª Jesús; Criado, José M.; Espinoza, Rodrigo; Mosquera, Edgar

2016-01-01

The influence of 1.1 wt% tin additions on the precipitation hardening of Cu-11 wt% Ni-20 wt% Zn alloy was studied by Differential Scanning Calorimetry (DSC), microhardeness measurements and High Resolution Transmission Electron Microscopy (HRTEM). The calorimetric curves, in the range of temperatures analyzed, show the presence of two exothermic reactions in the ternary alloy, associated to the short-range-order development assisted by migration of excess vacancies. On the other hand, one exo...

Thermodynamic calculation of a district energy cycle

International Nuclear Information System (INIS)

Hoehlein, B.; Bauer, A.; Kraut, G.; Scherberich, F.D.

1975-08-01

This paper presents a calculation model for a nuclear district energy circuit. Such a circuit means the combination of a steam reforming plant with heat supply from a high-temperature nuclear reactor and a methanation plant with heat production for district heating or electricity production. The model comprises thermodynamic calculations for the endothermic methane reforming reaction as well as the exothermic CO-hydrogenation in adiabatic reactors and allows the optimization of the district energy circuit under consideration. (orig.) [de

Analysis of potential hazards associated with 241Am loaded resins from nitrate media

International Nuclear Information System (INIS)

Schulte, Louis D.; Rubin, Jim; Fife, Keith William; Ricketts, Thomas Edgar; Tappan, Bryce C.; Chavez, David E.

2016-01-01

LANL has been contacted to provide possible assistance in safe disposition of a number of 241 Am-bearing materials associated with local industrial operations. Among the materials are ion exchange resins which have been in contact with 241 Am and nitric acid, and which might have potential for exothermic reaction. The purpose of this paper is to analyze and define the resin forms and quantities to the extent possible from available data to allow better bounding of the potential reactivity hazard of the resin materials. An additional purpose is to recommend handling procedures to minimize the probability of an uncontrolled exothermic reaction.

Joining of parts via magnetic heating of metal aluminum powders

Science.gov (United States)

Baker, Ian

2013-05-21

A method of joining at least two parts includes steps of dispersing a joining material comprising a multi-phase magnetic metal-aluminum powder at an interface between the at least two parts to be joined and applying an alternating magnetic field (AMF). The AMF has a magnetic field strength and frequency suitable for inducing magnetic hysteresis losses in the metal-aluminum powder and is applied for a period that raises temperature of the metal-aluminum powder to an exothermic transformation temperature. At the exothermic transformation temperature, the metal-aluminum powder melts and resolidifies as a metal aluminide solid having a non-magnetic configuration.

Self-propagating high-temperature synthesis of nonstoichiometric wuestite

Energy Technology Data Exchange (ETDEWEB)

Hiramoto, Maki [Graduate School of Engineering, Hokkaido University, Sapporo 060-8628 (Japan); Okinaka, Noriyuki [Center for Advanced Research of Energy and Materials, Faculty of Engineering, Hokkaido University, Sapporo 060-8628 (Japan); Akiyama, Tomohiro, E-mail: takiyama@eng.hokudai.ac.jp [Center for Advanced Research of Energy and Materials, Faculty of Engineering, Hokkaido University, Sapporo 060-8628 (Japan)

2012-04-15

Highlights: Black-Right-Pointing-Pointer The manuscript describes an SHS method of producing Fe{sub x}O. Black-Right-Pointing-Pointer Focus on the effects of nonstoichiometric Fe content and diluent addition on the phase of the SHS product. Black-Right-Pointing-Pointer Without the NaCl diluent, the lattice parameter of SHS Fe{sub 0.947}O corresponded to the theoretical lattice parameter. Black-Right-Pointing-Pointer Nonstoichiometric compounds of Fe{sub x}O (0.942 {<=} x {<=} 0.952) were obtained through SHS without additional external heating. - Abstract: This paper describes the self-propagating high-temperature synthesis (SHS) of nonstoichiometric Fe{sub x}O (x = 0.833-1), with particular focus on the effects of nonstoichiometric Fe content and diluent addition on the phase of the SHS product. In the SHS process, the raw materials Fe, NaClO{sub 4} (oxidizer), and NaCl (diluent) were thoroughly mixed in the desired ratio by ball milling, and the lower surfaces of the disk-shaped green compacts were subsequently electrically ignited to produce Fe{sub x}O through the propagation of the sustainable exothermic reaction. X-ray diffraction analysis showed that the SHS products comprised double phases of Fe{sub x}O and Fe{sub 3}O{sub 4}. The peaks of products with 0.947 {<=} x {<=} 1.00 shifted to lower angles in comparison to those of the product with x = 0.833 attributed to the lattice parameter distortion of the crystal structure because of the Fe defects. In the presence of the NaCl diluent, the raw materials were converted to high-purity Fe{sub x}O powders during the SHS process. Without the NaCl diluent, the lattice parameter of SHS Fe{sub 0.947}O corresponded to the theoretical lattice parameter. Nonstoichiometric compounds of Fe{sub x}O (0.942 {<=} x {<=} 0.952) were obtained through SHS without additional external heating.

The processing of simulated high-level radioactive waste sludges containing nitrites and mercury

International Nuclear Information System (INIS)

Zamecnik, J.R.; Hutson, N.D.; Ritter, J.A.; Carter, J.T.

1991-01-01

The reaction of formic acid with simulated alkaline sludge containing mercury and nitrite was studied in an engineering-scale facility. Quantification of offgas production was performed, with the major offgases being CO 2 and NO x . A small amount of CO was also found. The NO x was scrubbed in the offgas condenser and formed very acidic solutions of nitrous and nitric acids. These acids dissolved mercury that was stripped from the sludge. However, the overall efficiency of mercury stripping was greater than expected, and the final mercury concentration in the sludge was lower than expected. The NO x in the offgas also caused large temperature rises in the offgas system due to the exothermic reaction of NO with O 2 . This temperature rise had a detrimental effect on the performance of the Formic Acid Vent Condenser, such that redesign is being contemplated. 6 refs., 6 figs., 3 tabs

Application of density functional theory to the nitric oxide heterogeneous reduction mechanism in the presence of hydroxyl and carbonyl groups

International Nuclear Information System (INIS)

Zhang, Hai; Jiang, Xiumin; Liu, Jiaxun; Shen, Jun

2014-01-01

Highlights: • The role of hydroxyl and carbonyl groups are studied on two modified zigzag models. • Energetics and kinetics for the proposed pathways are chiefly investigated. • New active sites are beneficial for NO adsorption and N-O bond dissociation. • The highly exothermicity of C(NCO) formation is helpful for CO 2 and N 2 elimination. - Abstract: Comprehensive theoretical calculations are carried out to investigate the nitric oxide (NO) heterogeneous reduction mechanism in the presence of hydroxyl (-OH) and carbonyl (>C=O) groups. Energetics (activation energy and thermochemistry data) and kinetics (thermal rate constant) for the proposed pathways are provided by density functional theory (DFT) and conventional transition state theory (TST), respectively. The role played by -OH and >C=O has been clarified. In the presence of -OH, four stepwise reactions with the highest energy barrier of 251.7 kJ/mol are found to produce new active sites. Subsequently, a number of elementary reactions with energy barrier below 116.1 kJ/mol take place to reduce NO. The role of > C=O is to yield NCO intermediate. The formation of NCO is highly exothermic with 709.4 kJ/mol, which contributes to the elimination of carbon dioxide (CO 2 ) and nitrogen (N 2 ). The discovered mechanism is consistent with previous experimental observation that NO heterogeneous reduction is enhanced due to the presence of oxygen

GAP pre-polymer, as an energetic binder and high performance additive for propellants and explosives: A review

Directory of Open Access Journals (Sweden)

Mehmet S. Eroglu

2017-08-01

Full Text Available In preparation of energetic composite formulations, functionally terminated pre-polymers have been used as binder. After physically mixing the pre-polymers with oxidizing components, metallic fuel, burning rate modifier and other minor ingredients, they are cured with a suitable curing agent to provide physical and chemical stability. These pre-polymers could be functionalized with carboxyl, epoxide or hydroxyl groups at varying average chain functionalities. For carboxyl-terminated pre-polymers, an epoxy functional curing agents could be used. If the pre-polymer possesses hydroxyl groups, isocyanate functional curing agents are the most suitable curing agents in terms of easy and efficient processing. Glycidyl azide polymer (GAP is one of the well-known low-molecular weight energetic liquid pre-polymer, which was developed to use as energetic binder, high performance additive and gas generator for high performance smokeless composite propellant and explosive formulations. Linear or branched GAP can be synthesized by nucleophilic substitution reaction of corresponding poly(epichlorohydrin (PECH with sodium azide through replacement of chloromethyl groups of PECH with pendant energetic azido-methyl groups on the polyether main chain. Positive heat of formation (+957 kJ/kg enables exothermic and rapid decomposition of GAP producing fuel rich gases. Its polyether main chain provides GAP with relatively low glass transition temperature (Tg= - 48 oC and presence of hydroxyl functional groups allows it to have easy processing in curing with isocyanate curing agents to form covalently crosslinked polyurethane structure. These outstanding properties of GAP enable it to be used as energetic polymeric binder and high performance additive in preparation of energetic materials and low vulnerable explosives.

LiFSI vs. LiPF6 electrolytes in contact with lithiated graphite: Comparing thermal stabilities and identification of specific SEI-reinforcing additives

International Nuclear Information System (INIS)

Eshetu, Gebrekidan Gebresilassie; Grugeon, Sylvie; Gachot, Grégory; Mathiron, David; Armand, Michel; Laruelle, Stephane

2013-01-01

Lithium bis(fluorosulfonyl) imide (LiFSI) is regarded as an alternative to the classical LiPF 6 salt in today's LiFePO 4 /graphite-based Li-ion batteries electrolyte owing to its slightly higher conductivity and lower fluorine content. In an attempt to better evaluate the safety issues, here we report the comparative study of the LiFSI and LiPF 6 based electrolyte/lithiated graphite interface thermal behavior. DSC measurements with LiFSI-based electrolyte reveal a sharp exotherm with large heat release though at higher onset and peak temperatures compared to LiPF 6 -based electrolyte. With the help of GC/MS, 19 F NMR and ESI-HRMS analyses, we assume that this highly energetic peak around 200 °C, which is dependant upon the lithium content, is mainly related to electrochemical reduction of FSI − anion. In a strategy to limit the probability and damage of thermal runaway event, electrolyte additives such as vinylene carbonate (VC), fluoro ethylene carbonate (FEC), di-isocyanato hexane (DIH) and toluene di-isocyanate (TDI) have been investigated and shown to significantly lower the energy associated with the exothermic phenomenon

Hanford Site organic waste tanks: History, waste properties, and scientific issues

International Nuclear Information System (INIS)

Strachan, D.M.; Schulz, W.W.; Reynolds, D.A.

1993-01-01

Eight Hanford single-shell waste tanks are included on a safety watch list because they are thought to contain significant concentrations of various organic chemical. Potential dangers associated with the waste in these tanks include exothermic reaction, combustion, and release of hazardous vapors. In all eight tanks the measured waste temperatures are in the range 16 to 46 degree C, far below the 250 to 380 degree C temperatures necessary for onset of rapid exothermic reactions and initiation of deflagration. Investigation of the possibility of vapor release from Tank C-103 has been elevated to a top safety priority. There is a need to obtain an adequate number of truly representative vapor samples and for highly sensitive and capable methods and instruments to analyze these samples. Remaining scientific issues include: an understanding of the behavior and reaction of organic compounds in existing underground tank environments knowledge of the types and amounts of organic compounds in the tanks knowledge of selected physical and chemical properties of organic compounds source, composition, quality, and properties of the presently unidentified volatile organic compound(s) apparently evolving from Tank C-103

A Novel Composite PMMA-based Bone Cement with Reduced Potential for Thermal Necrosis.

Science.gov (United States)

Lv, Yang; Li, Ailing; Zhou, Fang; Pan, Xiaoyu; Liang, Fuxin; Qu, Xiaozhong; Qiu, Dong; Yang, Zhenzhong

2015-06-03

Percutaneous vertebroplasty (VP) and balloon kyphoplasty (BKP) are now widely used to treat patients who suffer painful vertebral compression fractures. In each of these treatments, a bone cement paste is injected into the fractured vertebral body/bodies, and the cement of choice is a poly(methyl methacrylate) (PMMA) bone cement. One drawback of this cement is the very high exothermic temperature, which, it has been suggested, causes thermal necrosis of surrounding tissue. In the present work, we prepared novel composite PMMA bone cement where microcapsules containing a phase change material (paraffin) (PCMc) were mixed with the powder of the cement. A PCM absorbs generated heat and, as such, its presence in the cement may lead to reduction in thermal necrosis. We determined a number of properties of the composite cement. Compared to the values for a control cement (a commercially available PMMA cement used in VP and BKP), each composite cement was found to have significantly lower maximum exothermic temperature, increased setting time, significantly lower compressive strength, significantly lower compressive modulus, comparable biocompatibility, and significantly smaller thermal necrosis zone. Composite cement containing 20% PCMc may be suitable for use in VP and BKP and thus deserves further evaluation.

Fuel behaviour in the case of severe accidents and potential ATF designs. Fuel Behavior in Severe Accidents and Potential Accident Tolerance Fuel Designs

International Nuclear Information System (INIS)

Cheng, Bo

2013-01-01

This presentation reviews the conditions of fuel rods under severe loss of coolant conditions, approaches that may increase coping time for plant operators to recover, requirements of advanced fuel cladding to increase tolerance in accident conditions, potential candidate alloys for accident-tolerant fuel cladding and a novel design of molybdenum (Mo) -based fuel cladding. The current Zr-alloy fuel cladding will lose all its mechanical strength at 750-800 deg. C, and will react rapidly with high-pressure steam, producing significant hydrogen and exothermic heat at 700-1000 deg. C. The metallurgical properties of Zr make it unlikely that modifications of the Zr-alloy will improve the behaviour of Zr-alloys at temperatures relevant to severe accidents. The Mo-based fuel cladding is designed to (1) maintain fuel rod integrity, and reduce the release rate of hydrogen and exothermic heat in accident conditions at 1200-1500 deg. C. The EPRI research has thus far completed the design concepts, demonstration of feasibility of producing very thin wall (0.2 mm) Mo tubes. The feasibility of depositing a protective coating using various techniques has also been demonstrated. Demonstration of forming composite Mo-based cladding via mechanical reduction has been planned

High-performance magnetic carbon materials in dye removal from aqueous solutions

International Nuclear Information System (INIS)

Gao, Xiaoming; Zhang, Yu; Dai, Yuan; Fu, Feng

2016-01-01

To obtain a novel adsorbent with excellent adsorption capacity and convenient magnetic separation property, magnetic activated semi-coke was prepared by KOH activation method and further modified by FeCl 3 . The surface morphology, physical structure, chemical properties and textural characteristics of unmodified semi-coke, KOH-modified semi-coke and magnetic activated semi-coke were characterized by scanning electron microscopy, X-ray powder diffraction, N 2 adsorption-desorption measurement, and electronic differential system. The adsorption characteristics of the magnetic activated semi-coke were explored for the removal of methyl orang (MO), methylene blue (MB), congo red (CR), acid fuchsin (AF), and rhodamine B (RB) from aqueous solution. The effects of adsorption parameters, including adsorbent dosage, pH and contact time, were investigated by comparing the adsorption properties of the magnetic activated semi-coke to RB. The result showed that the magnetic activated semi-coke displayed excellent dispersion, convenient separation and high adsorption capacity. The adsorption experiment data indicated that the pseudosecond order model and the Langmuir model could well explain the adsorption processes of RB on the magnetic activated semi-coke, and the maximum adsorption capacity (q m ) was 526.32 mg/g. The values of thermodynamic parameters (ΔG°, ΔH° and ΔS°) indicated that the adsorption process depended on the temperature of the aqueous phase, and it was spontaneous and exothermic in nature. As the addition of the magnetic activated semi-coke, the color of the solution significantly faded. Subsequently, fast aggregation of the magnetic activated semi-coke from their homogeneous dispersion in the presence of an external magnetic field could be happened. So, the magnetic activated semi-coke displayed excellent dispersion, convenient separation and high adsorption capacity. - Graphical abstract: As the addition of the magnetic activated semi-coke, the color

ECO steam explosion experiments on the conversion of thermal into mechanical energy

International Nuclear Information System (INIS)

Cherdron, W.; Kaiser, A.; Schuetz, W.; Will, H.

2001-01-01

In case of a steam explosion, e.g. as a consequence of a severe reactor accident, part of the thermal energy of the melt is transferred into mechanical energy. At Forschungszentrum Karlsruhe, so-called ECO experiments, are being directed to measure the conversion factor under well-defined conditions. In ECO, alumina from a thermite reaction is used as a simulating material instead of corium. Dimensions of the test facility as well as major test conditions, e.g. temperature and release mode of the melt, water inventory and test procedure, are based on the former PREMIX experimental series. In the paper, results of the first test, ECO 01, are given. (orig.)

A model of frontal polymerization using complex initiation

Directory of Open Access Journals (Sweden)

P. M. Goldfeder

1999-01-01

Full Text Available Frontal polymerization is a process in which a spatially localized reaction zone propagates into a monomer, converting it into a polymer. In the simplest case of free-radical polymerization, a mixture of monomer and initiator is placed in a test tube. A reaction is then initiated at one end of the tube. Over time, a self-sustained thermal wave, in which chemical conversion occurs, is produced. This phenomenon is possible because of the highly exothermic nature of the polymerization reactions.

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.

Elaboration and Characterization of Nano-Sized AlxMoyOz/Al Thermites

National Research Council Canada - National Science Library

Comet, M; Spitzer, D

2006-01-01

...) has been developed at the Institut franco-allemand de recherches de Saint Louis (ISL). This process consists of a new sol-gel method nano-sized mixed AlxMoyOz phases whose structure is correlated to the chemical composition...

The Mechanical and Reaction Behavior of PTFE/Al/Fe2O3 under Impact and Quasi-Static Compression

Directory of Open Access Journals (Sweden)

Jun-yi Huang

2017-01-01

Full Text Available Quasi-static compression and drop-weight test were used to characterize the mechanical and reaction behavior of PTFE/Al/Fe2O3 composites. Two kinds of PTFE/Al/Fe2O3 composites were prepared with different mass of PTFE, and the reaction phenomenon and stress-strain curves were recorded; the residuals after reaction were analyzed by X-ray diffraction (XRD. The results showed that, under quasi-static compression condition, the strength of the materials is increased (from 37.1 Mpa to 77.2 Mpa with the increase of PTFE, and the reaction phenomenon occurred only in materials with high PTFE content. XRD analysis showed that the reaction between Al and Fe2O3 was not triggered with identical experimental conditions. In drop-weight tests, PTFE/Al/Fe2O3 specimens with low PTFE content were found to be more insensitive by high-speed photography, and a High Temperature Metal Slag Spray (HTMSS phenomenon was observed in both kinds of PTFE/Al/Fe2O3 composites, indicating the existence of thermite reaction, which was confirmed by XRD. In PTFE/Al/Fe2O3 system, the reaction between PTFE and Al precedes the reaction between Al and Fe2O3.

Intercalation studies of zinc hydroxide chloride: Ammonia and amino acids

International Nuclear Information System (INIS)

Arízaga, Gregorio Guadalupe Carbajal

2012-01-01

Zinc hydroxide chloride (ZHC) is a layered hydroxide salt with formula Zn 5 (OH) 8 Cl 2 ·2H 2 O. It was tested as intercalation matrix for the first time and results were compared with intercalation products of the well-known zinc hydroxide nitrate and a Zn/Al layered double hydroxide. Ammonia was intercalated into ZHC, while no significant intercalation occurred in ZHN. Aspartic acid intercalation was only achieved by co-precipitation at pH=10 with ZHC and pH=8 with zinc hydroxide nitrate. Higher pH resistance in ZHC favored total deprotonation of both carboxylic groups of the Asp molecule. ZHC conferred more thermal protection against Asp combustion presenting exothermic peaks even at 452 °C while the exothermic event in ZHN was 366 °C and in the LDH at 276 °C. - Graphical abstract: The zinc hydroxide chloride (ZHC) with formula Zn 5 (OH) 8 Cl 2 ·2H 2 O was tested as intercalation matrix. In comparison with the well-known zinc hydroxide nitrate (ZHN) and layered double hydroxides (LDH), ZHC was the best matrix for thermal protection of Asp combustion, presenting exothermic peaks even at 452 °C, while the highest exothermic event in ZHN was at 366 °C, and in the LDH it was at 276 °C. Highlights: ► Zinc hydroxide chloride (ZHC) was tested as intercalation matrix for the first time. ► ZHC has higher chemical and thermal stability than zinc hydroxide nitrate and LDH. ► NH 3 molecules can be intercalated into ZHC. ► The amino group of amino acids limits the intercalation by ion-exchange.

Tank characterization data report: Tank 241-C-112

Energy Technology Data Exchange (ETDEWEB)

Simpson, B.C.; Borsheim, G.L.; Jensen, L.

1993-09-01

Tank 241-C-112 is a Hanford Site Ferrocyanide Watch List tank that was most recently sampled in March 1992. Analyses of materials obtained from tank 241-C-112 were conducted to support the resolution of the Ferrocyanide Unreviewed Safety Question (USQ) and to support Hanford Federal Facility Agreement and Consent Order (Tri-Party Agreement) Milestone M-10-00. Analysis of core samples obtained from tank 241-C-112 strongly indicates that the fuel concentration in the tank waste will not support a propagating exothermic reaction. Analysis of the process history of the tank as well as studies of simulants provided valuable information about the physical and chemical condition of the waste. This information, in combination with the analysis of the tank waste, sup ports the conclusion that an exothermic reaction in tank 241-C-112 is not plausible. Therefore, the contents of tank 241-C-112 present no imminent threat to the workers at the Hanford Site, the public, or the environment from its forrocyanide inventory. Because an exothermic reaction is not credible, the consequences of this accident scenario, as promulgated by the General Accounting Office, are not applicable.

Thermal analysis of precipitation reactions in a Ti-25Nb-3Mo-3Zr-2Sn alloy

International Nuclear Information System (INIS)

Kent, Damon; Wang, Gui; Dargusch, Matthew S.; Pas, Steven; Zhu, Suming

2012-01-01

A study was undertaken on a Ti-25Nb-3Mo-3Zr-2Sn alloy using differential scanning calorimetry (DSC) in order to improve understanding of the precipitation reactions occurring during aging heat treatments. The investigation showed that isothermal ω phase can be formed in the cast and solution treated alloy at low aging temperatures. An exothermic peak in the temperature range of 300 to 400 C was detected for precipitation of the ω phase, with approximate activation energy of 176 kJ/mol. The ω phase begins to dissolve at temperatures around 400 C and precipitation of the α phase is favoured at higher temperatures between 400 C and 600 C. An exothermic peak with activation energy of 197 kJ/mol was measured for precipitation of the α phase. Deformation resulting in the formation of the stress induced α'' phase altered the DSC heating profile for the solution treated alloy. The exothermic peak associated with precipitation of the ω phase was not detected during heating of the deformed material and increased endothermic heating associated with recovery and recrystallisation was observed. (orig.)

Tank characterization data report: Tank 241-C-112

International Nuclear Information System (INIS)

Simpson, B.C.; Borsheim, G.L.; Jensen, L.

1993-09-01

Tank 241-C-112 is a Hanford Site Ferrocyanide Watch List tank that was most recently sampled in March 1992. Analyses of materials obtained from tank 241-C-112 were conducted to support the resolution of the Ferrocyanide Unreviewed Safety Question (USQ) and to support Hanford Federal Facility Agreement and Consent Order (Tri-Party Agreement) Milestone M-10-00. Analysis of core samples obtained from tank 241-C-112 strongly indicates that the fuel concentration in the tank waste will not support a propagating exothermic reaction. Analysis of the process history of the tank as well as studies of simulants provided valuable information about the physical and chemical condition of the waste. This information, in combination with the analysis of the tank waste, sup ports the conclusion that an exothermic reaction in tank 241-C-112 is not plausible. Therefore, the contents of tank 241-C-112 present no imminent threat to the workers at the Hanford Site, the public, or the environment from its forrocyanide inventory. Because an exothermic reaction is not credible, the consequences of this accident scenario, as promulgated by the General Accounting Office, are not applicable

Laser reactor

International Nuclear Information System (INIS)

Bellak, J.G.

1976-01-01

A device is described for producing reactions in the chemical to thermonuclear range and beyond. Physical principles entail pressures, kinetic temperatures, and electromagnetic field strengths obtainable from convergent electromagnetic energy. Process converges closed electromagnetic wave on reactants thereby heating, compressing and confining, and stressing reactants under focal electromagnetic intensities, inducing endothermic, equithermic, exothermic or combination reactions, all types furnishing energy useful externally and the exothermic type furnishing energy useful as feedback for generating new electromagnetic waves for process cyclic operation. Embodiment consists of closed shell lasing element enclosing reaction chamber, source of reactants, sink for reactant by-products, and a source of initial energy for priming the lasing element

Analysis of potential hazards associated with ²⁴¹Am loaded resins from nitrate media

Energy Technology Data Exchange (ETDEWEB)

Schulte, Louis D. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Rubin, Jim [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Fife, Keith William [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Ricketts, Thomas Edgar [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Tappan, Bryce C. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Chavez, David E. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2016-02-19

LANL has been contacted to provide possible assistance in safe disposition of a number of ²⁴¹Am-bearing materials associated with local industrial operations. Among the materials are ion exchange resins which have been in contact with ²⁴¹Am and nitric acid, and which might have potential for exothermic reaction. The purpose of this paper is to analyze and define the resin forms and quantities to the extent possible from available data to allow better bounding of the potential reactivity hazard of the resin materials. An additional purpose is to recommend handling procedures to minimize the probability of an uncontrolled exothermic reaction.

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

Energy Technology Data Exchange (ETDEWEB)

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

2000-02-01

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

Thermal stability of Al-Cu-Fe quasicrystals prepared by SHS method

Directory of Open Access Journals (Sweden)

Pavel Novak

2013-02-01

Full Text Available Quasicrystal-containing materials are usually prepared by rapid solidification of the melt (e.g. by melt spinning or mechanical alloying. In this work, the method using exothermic reactions between compressed metallic powders called SHS (Self-propagating High-temperature Synthesis was tested. The microstructure and phase composition of the product was described in dependence on cooling regime from the reaction temperature. Thermal stability of prepared Al-Cu-Fe quasicrystals was studied by annealing at the temperatures of 300 and 500 °C.

THERMAL STABILITY OF Al-Cu-Fe QUASICRYSTALS PREPARED BY SHS METHOD

Directory of Open Access Journals (Sweden)

Pavel Novák

2013-04-01

Full Text Available Quasicrystal-containing materials are usually prepared by rapid solidification of the melt (e.g. by melt spinning or mechanical alloying. In this work, the method using exothermic reactions between compressed metallic powders called SHS (Self-propagating High-temperature Synthesis was tested. The microstructure and phase composition of the product was described in dependence on cooling regime from the reaction temperature. Thermal stability of prepared Al-Cu-Fe quasicrystals was studied by annealing at the temperatures of 300 and 500 °C.

Thermal analysis of physical and chemical changes occuring during regeneration of activated carbon

Directory of Open Access Journals (Sweden)

Radić Dejan B.

2017-01-01

Full Text Available High-temperature thermal process is a commercial way of regeneration of spent granular activated carbon. The paper presents results of thermal analysis conducted in order to examine high-temperature regeneration of spent activated carbon, produced from coconut shells, previously used in drinking water treatment. Results of performed thermogravimetric analysis, derivative thermogravimetric analysis, and differential thermal analysis, enabled a number of hypotheses to be made about different phases of activated carbon regeneration, values of characteristic parameters during particular process phases, as well as catalytic impact of inorganic materials on development of regeneration process. Samples of activated carbon were heated up to 1000°C in thermogravimetric analyser while maintaining adequate oxidizing or reducing conditions. Based on diagrams of thermal analysis for samples of spent activated carbon, temperature intervals of the first intense mass change phase (180-215°C, maximum of exothermic processes (400-450°C, beginning of the second intense mass change phase (635-700°C, and maximum endothermic processes (800-815°C were deter-mined. Analysing and comparing the diagrams of thermal analysis for new, previously regenerated and spent activated carbon, hypothesis about physical and chemical transformations of organic and inorganic adsorbate in spent activated carbon are given. Transformation of an organic adsorbate in the pores of activated carbon, results in loss of mass and an exothermic reaction with oxygen in the vapour phase. The reactions of inorganic adsorbate also result the loss of mass of activated carbon during its heating and endothermic reactions of their degradation at high temperatures.

Scalable synthesis of nano-silicon from beach sand for long cycle life Li-ion batteries.

Science.gov (United States)

Favors, Zachary; Wang, Wei; Bay, Hamed Hosseini; Mutlu, Zafer; Ahmed, Kazi; Liu, Chueh; Ozkan, Mihrimah; Ozkan, Cengiz S

2014-07-08

Herein, porous nano-silicon has been synthesized via a highly scalable heat scavenger-assisted magnesiothermic reduction of beach sand. This environmentally benign, highly abundant, and low cost SiO₂ source allows for production of nano-silicon at the industry level with excellent electrochemical performance as an anode material for Li-ion batteries. The addition of NaCl, as an effective heat scavenger for the highly exothermic magnesium reduction process, promotes the formation of an interconnected 3D network of nano-silicon with a thickness of 8-10 nm. Carbon coated nano-silicon electrodes achieve remarkable electrochemical performance with a capacity of 1024 mAhg(-1) at 2 Ag(-1) after 1000 cycles.

Hydrogen sorption properties of ball-milled Mg-C nanocomposites

Energy Technology Data Exchange (ETDEWEB)

Spassov, Tony; Zlatanova, Zlatina; Spassova, Maya; Todorova, Stanislava [Faculty of Chemistry, University of Sofia ' ' St.Kl.Ohridski' ' , 1 James Bourchier str. 1164 Sofia (Bulgaria)

2010-10-15

MgH{sub 2} 75 at.%-C 25 at.% composites are synthesized by ball milling using different kinds of carbon additives: carbon black (CB), nanodiamonds (ND) and amorphous carbon soot (AC). X-ray diffraction analysis showed that the MgH{sub 2} phase in the as-obtained composite powders is nanocrystalline (80-100 nm). The SEM observations revealed that the samples consist of 5-15 {mu}m MgH{sub 2} particles, surrounded and in some cases coated by carbon flakes. The composite containing nanodiamonds revealed strong decrease of the MgH{sub 2} decomposition temperature with more than 100 C, compared to ball-milled pure MgH{sub 2}. Important issue of the present study is also the low temperature hydriding of the ball-milled Mg-C nanocomposites, investigated by high-pressure DSC. The process starts at about 200 C for all materials studied, but the hydriding mechanism looks different for the composites with different kinds of carbon additives. Whereas for Mg-carbon black it takes place in a relatively narrow temperature range, expressed by a single exothermic peak (200-300 C) for the other two composites the hydriding is a multi-step process, featured by two overlapped exothermic peaks for Mg-nanodiamonds and by two well separated exothermic effects (at about 300 C and 400 C) for Mg-amorphous carbon soot. The observed difference in the hydriding behavior of the Mg-C composites is attributed to the different kind of carbon component, which is supposed to play a catalytic role as well as protects magnesium from oxidation. The incorporation of carbon into the MgH{sub 2} particles results in the formation of high density of defects (dislocations and grain boundaries), which is supposed to be among the most possible reasons for the decreased hydride decomposition temperature. The Mg-C nanocomposites show reproducible hydriding/dehydriding behavior (thermodynamics and kinetics) during multiple cycling. Among the composites in the present study ''Mg-carbon black

Analysis on the sequence of formation of Ti{sub 3}SiC{sub 2} and Ti{sub 3}SiC{sub 2}/SiC composites

Energy Technology Data Exchange (ETDEWEB)

Radhakrishnan, R.; Bhaduri, S.B. [Idaho Univ., Moscow, ID (United States). Dept. of Mining and Metallurgy; Henager, C.H. Jr. [Pacific Northwest Lab., Richland, WA (United States)

1995-05-01

Ti{sub 3}SiC{sub 2}, a compound in the ternary Ti-Si-C system, is reported to be ductile. This paper reports the sequence of formation of Ti{sub 3}SiC{sub 2} and Ti{sub 3}SiC{sub 2}/SiC composites involving either combustion synthesis or by displacement reaction, respectively. Onset of exothermic reaction temperatures were determined using Differential Thermal Analysis (DTA). Phases present after the exothermic temperatures were analyzed by X-Ray diffraction. Based on these observations, a route to formation of Ti{sub 3}SiC{sub 2} and Ti{sub 3}SiC{sub 2}/SiC composites is proposed for the two`s thesis methods.

Silver as an electron source for photodissociation of hydronium

Energy Technology Data Exchange (ETDEWEB)

Papas, B. N.; Whitten, J. L. [Department of Chemistry, North Carolina State University, Raleigh, North Carolina 27695 (United States)

2011-11-28

The photochemistry of a solvated hydronium ion near a silver surface is investigated using ab initio self-consistent field and configuration interaction theory. Photoinduced electron attachment can occur at energies in the range of 1.1-1.2 eV depending upon the initial orientation of the hydronium relative to the silver surface. Rearrangement of solvating waters considerably reduces transition state barriers to dissociation on the excited-state potential energy surface, such that fast dissociation of the neutralized hydronium would occur with no barrier. Both the H and H{sub 2} product channels are exothermic pathways on the excited state surface and in several instances exothermic compared to the energy of the initial structure.

Heat recovery from sorbent-based CO.sub.2 capture

Science.gov (United States)

Jamal, Aqil; Gupta, Raghubir P

2015-03-10

The present invention provides a method of increasing the efficiency of exothermic CO.sub.2 capture processes. The method relates to withdrawing heat generated during the exothermic capture of CO.sub.2 with various sorbents via heat exchange with a working fluid. The working fluid is provided at a temperature and pressure such that it is in the liquid state, and has a vaporization temperature in a range such that the heat arising from the reaction of the CO.sub.2 and the sorbent causes a phase change from liquid to vapor state in whole or in part and transfers heat from to the working fluid. The resulting heated working fluid may subsequently be used to generate power.

Dynamics of anion-molecule reactions at low energy

International Nuclear Information System (INIS)

Mikosch, J.

2007-11-01

Anion-molecule reactions must find their way through deeply bound entrance and exit channel complexes separated by a central barrier. This results in low reaction rates and rich dynamics since direct pathways compete with the formation of transient intermediates. In this thesis we examine the probability of proton transfer to a small anion and transient lifetimes of a thermoneutral bimolecular nucleophilic substitution (S N 2) reaction at well defined variable temperature down to 8 Kelvin in a multipole trap. The observed strong inverse temperature dependence is attributed to the deficit of available quantum states in the entrance channel at decreasing temperature. Furthermore we investigate scattering dynamics of S N 2 reactions at defined relative energy between 0.4 and 10 eV by crossed beam slice imaging. A weakly exothermic reaction with high central barrier proceeds via an indirect, complex-mediated mechanism at low relative energies featuring high internal product excitation in excellent quantitative agreement with a statistical model. In contrast, direct backward scattering prevails for higher energies with product velocities close to the kinematical cutoff. For a strongly exothermic reaction, competing S N 2-, dihalide- and proton transfer-channels are explored which proceed by complex mediation for low energy and various rebound-, grazing- and collision induced bond rupture-mechanisms at higher energy. From our data and a collaboration with theory we identify a new indirect roundabout S N 2 mechanism involving CH 3 -rotation. (orig.)

Mechanism of NH{sub 3} desorption during the reaction of H{sub 2} with nitrogen containing carbonaceous materials

Energy Technology Data Exchange (ETDEWEB)

Juan F. Espinal; Thanh N. Truong; Fanor Mondragon [University of Antioquia, Medellin (Colombia). Institute of Chemistry

2005-07-01

The continued increase in demand for natural gas has stimulated the interest in coal conversion to methane as synthetic natural gas by hydropyrolysis of coal (pyrolysis in a H{sub 2} atmosphere). Because the produced raw gas contains considerable amounts of gaseous N-containing products that have to be removed before delivering to final users, the information on distribution of coal-N is important for designing purification processes. It has been reported in the literature that NH{sub 3} is the main nitrogen containing gas that is released during the hydropyrolysis process. Other gases such as HCN and N{sub 2} are also released but in a much smaller amount. To the best of our knowledge, the mechanism for NH{sub 3} desorption during hydrogen reaction with carbonaceous materials has not been studied. We carried out a molecular modeling study using Density Functional Theory in order to get an insight of the mechanism and thermodynamics for NH{sub 3} evolution using pyridinic nitrogen as a model of N-containing carbonaceous material. We propose a mechanism that involves consecutive hydrogenation steps that lead to C-N bond breakage and NH{sub 3} desorption to the gas phase. It was found that the first hydrogenation reaction is highly exothermic. However, further hydrogenations are endothermic. Several pathways for NH{sub 3} evolution were proposed and most of them show high exothermicity. 17 refs., 2 figs.

Dynamics of anion-molecule reactions at low energy

Energy Technology Data Exchange (ETDEWEB)

Mikosch, J.

2007-11-15

Anion-molecule reactions must find their way through deeply bound entrance and exit channel complexes separated by a central barrier. This results in low reaction rates and rich dynamics since direct pathways compete with the formation of transient intermediates. In this thesis we examine the probability of proton transfer to a small anion and transient lifetimes of a thermoneutral bimolecular nucleophilic substitution (S{sub N}2) reaction at well defined variable temperature down to 8 Kelvin in a multipole trap. The observed strong inverse temperature dependence is attributed to the deficit of available quantum states in the entrance channel at decreasing temperature. Furthermore we investigate scattering dynamics of S{sub N}2 reactions at defined relative energy between 0.4 and 10 eV by crossed beam slice imaging. A weakly exothermic reaction with high central barrier proceeds via an indirect, complex-mediated mechanism at low relative energies featuring high internal product excitation in excellent quantitative agreement with a statistical model. In contrast, direct backward scattering prevails for higher energies with product velocities close to the kinematical cutoff. For a strongly exothermic reaction, competing S{sub N}2-, dihalide- and proton transfer-channels are explored which proceed by complex mediation for low energy and various rebound-, grazing- and collision induced bond rupture-mechanisms at higher energy. From our data and a collaboration with theory we identify a new indirect roundabout S{sub N}2 mechanism involving CH{sub 3}-rotation. (orig.)

Final report on investigation of stability of organic materials in salt cake

International Nuclear Information System (INIS)

Beitel, G.A.

1976-04-01

On the basis of this work the following conclusions, which all contribute to confidence that salt cake is stable against exothermic reactions, were reached. Organics added to the waste tanks were not nitrated at the time of addition and cannot have been subsequently transformed to detonatable nitrated organics. Whatever organic has found its way into the tanks has been and will be essentially unaffected by radiation. Mixtures of the types of organics which could have been added to the waste tanks with either simulated salt cake or pure sodium nitrate are not detonatable. The maximum amount of organic which could have been added to the waste tanks is less than 0.9 weight percent of the salt cake, a concentration far below the concentration required to support combustion. The many years during which the liquid high-level waste was boiling, and the subsequent evaporation-crystallization processing, have allowed many of the more volatile organics to be distilled off, further reducing the maximum expected concentration of organics. The occurrence of an explosive exothermic reaction of an organic in the waste tanks would require concentration and mixing by an unknown and uncontrolled means. The mixture would then have to remain in its concentrated state long enough to be triggered by an explosion, a totally unreasonable hypothesis

Electrochemical and Thermal Studies of Prepared Conducting Chitosan Biopolymer Film

International Nuclear Information System (INIS)

Hlaing Hlaing Oo; Kyaw Naing; Kyaw Myo Naing; Tin Tin Aye; Nyunt Wynn

2005-09-01

In this paper, chitosan based conducting bipolymer films were prepared by casting and solvent evaporating technique. All prepared chitosan films were of pale yellow colour, transparent, and smooth. Sulphuric acid was chosen as the cross-linking agent. It enhanced conduction pathway in cross-linked chitosan films. Mechanical properties, solid-state, and thermal behavior of prepared chitosan fimls were studied by means of a material testing machine, powder X-ray diffractometry (XRD), thermogravimetric analysis (TG-DTG), and differential scanning calorimetry (DSC). By the XRD diffraction pattern, high molecular weight of chitosan product indicates the semi-crystalline nature, but the prepared chitosan film and doped chitosan film indicate significantly lower in crystallinity prove which of the amorphous characteristics. In addition, DSC thermogram of pure chitosan film exhibited exothermic peak around at 300 C, indicating polymer decomposition of chitosan molecules in chitosan films. Furthermore, these DSC thermograms clearly showed that while pure chitosan film display exothermal decomposition, the doped chitosan films mainly endothermic characteristics. The ionic conductivity of doped chitosan films were in the order of 10 to 10 S cm , which is in the range of semi-conductor. These results showed that cross-linked chitoson films may be used as polymer electrolyte film to fabricate solid state electrochemical cells

Direct dimethyl ether (DME) synthesis through a thermally coupled heat exchanger reactor

International Nuclear Information System (INIS)

Vakili, R.; Pourazadi, E.; Setoodeh, P.; Eslamloueyan, R.; Rahimpour, M.R.

2011-01-01

Compared to some of the alternative fuel candidates such as methane, methanol and Fischer-Tropsch fuels, dimethyl ether (DME) seems to be a superior candidate for high-quality diesel fuel in near future. The direct synthesis of DME from syngas would be more economical and beneficial in comparison with the indirect process via methanol synthesis. Multifunctional auto-thermal reactors are novel concepts in process intensification. A promising field of applications for these concepts could be the coupling of endothermic and exothermic reactions in heat exchanger reactors. Consequently, in this study, a double integrated reactor for DME synthesis (by direct synthesis from syngas) and hydrogen production (by the cyclohexane dehydrogenation) is modelled based on the heat exchanger reactors concept and a steady-state heterogeneous one-dimensional mathematical model is developed. The corresponding results are compared with the available data for a pipe-shell fixed bed reactor for direct DME synthesis which is operating at the same feed conditions. In this novel configuration, DME production increases about 600 Ton/year. Also, the effects of some operational parameters such as feed flow rates and the inlet temperatures of exothermic and endothermic sections on reactor behaviour are investigated. The performance of the reactor needs to be proven experimentally and tested over a range of parameters under practical operating conditions.

Investigation of oxygen vibrational relaxation by quasi-classical trajectory method

International Nuclear Information System (INIS)

Andrienko, Daniil; Boyd, Iain D.

2015-01-01

Highlights: • Importance of attraction for the O 2 –O energy exchange in hypersonic flows. • O 2 –O vibrational relaxation time cannot be described by the Millikan–White equation. • Weak dependence of exothermic transition rates on translational temperature. • Multiquantum jumps in molecular oxygen occur mostly via the exchange reaction. - Abstract: O 2 –O collisions are studied by the quasi-classical trajectory method. A full set of cross sections for the vibrational ladder is obtained utilizing an accurate O 3 potential energy surface. Vibrational relaxation is investigated at temperatures between 1000 and 10,000 K, that are relevant to hypersonic flows. The relaxation time is derived based on the removal rate for the first excited vibrational level. A significant deviation from the formula by Millikan and White is observed for temperatures beyond those reported in experimental work. Relaxation becomes less efficient at high temperatures, suggesting that the efficiency of the energy randomization is strongly to the attractive component of the O 3 potential energy surface. These results are explained by analyzing the microscopic parameter of collisions that reflects the number of exchanges in the shortest interatomic distance. The rates of exothermic transitions are found to be nearly independent of the translational temperature in the range of interest.

Control method for light deterioration of amorphous solar cell. Temperature effect method; Amorphous taiyo denchi no hikari rekka yokuseiho. Ondo kokaho

Energy Technology Data Exchange (ETDEWEB)

Fujimoto, H.; Yokoyama, S.; Itsumi, J. [Kumamoto Institute of Technology, Kumamoto (Japan)

1996-10-27

This paper describes a proposed method for suppressing light deterioration (temperature effect method), in which an annealing effect was always expected by laminating an NEM element and a heat insulation material on the back side of a-Si solar cell module and thereby raising the temperature in the back side of the module, and also describes an outdoor exposure test device completed for the method. The NEM element consisted of conductive potassium titanate and high molecular polymer and was a self temperature-controlling organic exothermic body that required no outside temperature control device. It was provided with a heat generating temperature of 45-75{degree}C as the exothermic property of the element and capable of generating heating temperature arbitrarily according to the purpose. The NEM element varied a resistance value against the ambient temperature and kept the element temperature constant. Measurement was commenced starting April 19, 1996, using the completed outdoor exposure test device and a measuring circuit. The deterioration phenomenon was and from then on continuously examined under the following conditions: (1) measurements were those of clear days only, and (2) measurements to be used were those between 10:00 and 14:00 with the quantity of solar radiation on a constant level. 4 refs., 4 figs., 1 tab.

Effect of Y addition on crystallization behavior and soft-magnetic properties of Fe{sub 78}Si{sub 9}B{sub 13} ribbons

Energy Technology Data Exchange (ETDEWEB)

Zhanwei, Liu; Dunbo, Yu, E-mail: yudb2008@126.com; Kuoshe, Li; Yang, Luo; Chao, Yuan; Zilong, Wang; Liang, Sun; Kuo, Men

2017-08-15

Highlights: • Thermal stability of Fe-Si-B amorphous alloy is enhanced by Y addition. • Y addition can improve soft magnetic properties of Fe-Si-B amorphous alloy. • Decomposition of metastable Fe{sub 3}B phase is related to Y content in Fe-Si-B matrix. - Abstract: A series of amorphous Fe-Si-B ribbons with various Y addition were prepared by melt-spinning. The effect of Y addition on crystallization behavior, thermal and magnetic properties was systematically investigated. With the increase of Y content, the initial crystallization temperature shifted to a higher temperature, indicating that the thermal stability of amorphous state in Fe-Si-B-Y ribbon is enhanced compared to that of Fe-Si-B alloy. Meanwhile, compared to the two exothermic peaks in the samples with lower Y content, a new exothermic peak was found in the ribbons with Y content higher than 1 at%, which corresponded to the decomposition of metastable Fe{sub 3}B phase. Among all the alloys, Fe{sub 76.5}Si{sub 9}B{sub 13}Y{sub 1.5} alloy exhibits optimized magnetic properties, with high saturation magnetization M{sub s} of 187 emu/g and low coercivity H{sub cJ} of 7.6 A/m.

Quark-level analogue of nuclear fusion with doubly heavy baryons.

Science.gov (United States)

Karliner, Marek; Rosner, Jonathan L

2017-11-01

The essence of nuclear fusion is that energy can be released by the rearrangement of nucleons between the initial- and final-state nuclei. The recent discovery of the first doubly charmed baryon , which contains two charm quarks (c) and one up quark (u) and has a mass of about 3,621 megaelectronvolts (MeV) (the mass of the proton is 938 MeV) also revealed a large binding energy of about 130 MeV between the two charm quarks. Here we report that this strong binding enables a quark-rearrangement, exothermic reaction in which two heavy baryons (Λ c ) undergo fusion to produce the doubly charmed baryon and a neutron n (), resulting in an energy release of 12 MeV. This reaction is a quark-level analogue of the deuterium-tritium nuclear fusion reaction (DT → 4 He n). The much larger binding energy (approximately 280 MeV) between two bottom quarks (b) causes the analogous reaction with bottom quarks () to have a much larger energy release of about 138 MeV. We suggest some experimental setups in which the highly exothermic nature of the fusion of two heavy-quark baryons might manifest itself. At present, however, the very short lifetimes of the heavy bottom and charm quarks preclude any practical applications of such reactions.

Coated kapok fiber for removal of spilled oil

International Nuclear Information System (INIS)

Wang, Jintao; Zheng, Yian; Wang, Aiqin

2013-01-01

Highlights: ► A low-cost and biodegradable oil absorbent based on kapok fiber was prepared. ► The polymer-coated kapok fiber showed higher oil sorption capacity. ► Coated kapok fiber can be reused and the absorbed oil can be easily recovered. ► Adsorption of oil is spontaneous and exothermic physisorption and chemisorption. -- Abstract: Based on raw kapok fiber, two kinds of oil absorbers with high sorption capacity were prepared by a facile solution–immersion process. The coated polymer with low surface energy and rough fiber surface play important role in the retention of oil. The as-prepared fiber can quickly absorb gasoline, diesel, soybean oil, and paraffin oil up to above 74.5%, 66.8%, 64.4% and 47.8% of oil sorption capacity of raw fiber, respectively. The absorbed oils can be easily recovered by a simple vacuum filtration and the recovered coated-fiber still can be used for several cycles without obvious loss in oil sorption capacity. The thermodynamic study indicates that the adsorption process is spontaneous and exothermic, with complex physisorption and chemisorption. The results suggest that the coated fiber can be used as a low-cost alternative for the removal of oil spilled on water surface

[Adsorption behavior and influence factors of p-nitroaniline on high surface area activated carbons prepared from plant stems].

Science.gov (United States)

Li, Kun-quan; Zheng, Zheng; Luo, Xing-zhang

2010-08-01

Low-cost and high surface area microporous activated carbons were prepared from Spartina alternilora and cotton stalk with KOH activation under the conditions of impregnation ratio of 3.0, activation temperature at 800 degrees C and activation time of 1.5 h. The adsorption behavior of p-nitroaniline on the activated carbons was investigated by batch sorption experiments. The influences of solution pH value, adsorbent dose and temperature were investigated. The adsorption isotherm and thermodynamic characteristics were also discussed. The Spartina alterniflora activated carbon (SA-AC) has a high surface area of 2825 m2 x g(-1) and a micropore volume of 1.192 cm3 x g(-1). The BET surface area and micropore volume of the cotton stalk activated carbon (CS-AC) are 2135 m2 x g(-1) and 1.011 cm3 x g(-1), respectively. The sorption experiments show that both the activated carbons have high sorption capacity for p-nitroaniline. The Langmuir maximum sorption amount was found to be 719 mg x g(-1) for SA-AC and 716 mg x g(-1) for CS-AC, respectively. The sorption was found to depend on solution pH, adsorbent dose, and temperature. The optimum pH for the removal of p-nitroaniline was found to be 7.0. The Freundlich model and Redlich-Peterson model can describe the experimental data effectively. The negative changes in free energy (delta G0) and enthalpy (delta H0) indicate that the sorption is a spontaneous and exothermic procedure. The negative values of the adsorption entropy delta S0 indicate that the mobility of p-nitroaniline on the carbon surface becomes more restricted as compared with that of those in solution.

In-operando elucidation of bimetallic CoNi nanoparticles during high-temperature CH 4 /CO 2 reaction

KAUST Repository

Al-Sabban, Bedour

2017-05-02

Dry reforming of methane (DRM) proceeds via CH4 decomposition to leave surface carbon species, followed by their removal with CO2-derived species. Reactivity tuning for stoichiometric CH4/CO2 reactants was attempted by alloying the non-noble metals Co and Ni, which have high affinity with CO2 and high activity for CH4 decomposition, respectively. This study was focused on providing evidence of the capturing surface coverage of the reactive intermediates and the associated structural changes of the metals during DRM at high temperature using in-operando X-ray absorption spectroscopy (XAS). On the Co catalysts, the first-order effects with respect to CH4 pressure and negative-order effects with respect to CO2 pressure on the DRM rate are consistent with the competitive adsorption of the surface oxygen species on the same sites as the CH4 decomposition reaction. The Ni surface provides comparatively higher rates of CH4 decomposition and the resultant DRM than the Co catalyst but leaves some deposited carbon on the catalyst surface. In contrast, the bimetallic CoNi catalyst exhibits reactivity towards the DRM but with kinetic orders resembling Co catalyst, producing negligible carbon deposition by balancing CH4 and CO2 activation. The in-operando X-ray absorption near edge structure (XANES) and extended X-ray absorption fine structure (EXAFS) measurements confirmed that the Co catalyst was progressively oxidized from the surface to the bulk with reaction time, whereas CoNi and Ni remained relatively reduced during DRM. Density functional theory (DFT) calculation considering the high reaction temperature for DRM confirmed the unselective site arrangement between Co and Ni atoms in both the surface and bulk of the alloy nanoparticle (NP). The calculated heat of oxygen chemisorption became more exothermic in the order of Ni, CoNi, Co, consistent with the catalytic behavior. The comprehensive experimental and theoretical evidence provided herein clearly suggests

DSC and HRTEM investigation of the precipitates in Al-1.0%Mg{sub 2} Si-0.5%Ag alloy

Energy Technology Data Exchange (ETDEWEB)

Gaber, A.; Ali, A.M.; Zou, Y. [Toyama University (Japan). Venture Business Laboratory; Matsuda, K.; Ikeno, S. [Toyama University (Japan). Faculty of Engineering

2004-12-15

The understanding and control of nanoscale precipitation in an Al-1.0 wt-%Mg{sub 2} Si-0.5 wt-% Ag alloy during artificial aging is critical for achieving optimum mechanical properties. To achieve this objective, both differential scanning calorimetry (DSC) and high resolution transmission electron microscopy (HRTEM) have been utilised. The non-isothermal DSC thermograms exhibited eight reaction peaks; six are exothermic (precipitation) and two are endothermic (dissolution) reactions. The activation energies associated with the individual precipitates are determined. With the aid of HRTEM, the evolved precipitates have been characterised. (author)

Single-electron capture in He2+-D2 collisions

International Nuclear Information System (INIS)

Bordenave-Montesquieu, D.; Dagnac, R.

1994-01-01

Doubly differential cross sections of single-electron capture were measured for He 2+ impinging on a molecular deuterium target. The investigated collision energies are 4, 6 and 8 keV and the scattering angles range from 10' to 2 o 30' (laboratory frame). The exothermic capture leading to He + (1s) + D 2 +* was found to be the most important process at low energies and angles, whereas the endothermic channels leading to dissociative capture become the main processes at high scattering angles, i.e. at small impact parameters. (author)

Thermal characteristics of Lithium-ion batteries

Science.gov (United States)

Hauser, Dan

2004-01-01

Lithium-ion batteries have a very promising future for space applications. Currently they are being used on a few GEO satellites, and were used on the two recent Mars rovers Spirit and Opportunity. There are still problem that exist that need to be addressed before these batteries can fully take flight. One of the problems is that the cycle life of these batteries needs to be increased. battery. Research is being focused on the chemistry of the materials inside the battery. This includes the anode, cathode, and the cell electrolyte solution. These components can undergo unwanted chemical reactions inside the cell that deteriorate the materials of the battery. During discharge/ charge cycles there is heat dissipated in the cell, and the battery heats up and its temperature increases. An increase in temperature can speed up any unwanted reactions in the cell. Exothermic reactions cause the temperature to increase; therefore increasing the reaction rate will cause the increase of the temperature inside the cell to occur at a faster rate. If the temperature gets too high thermal runaway will occur, and the cell can explode. The material that separates the electrode from the electrolyte is a non-conducting polymer. At high temperatures the separator will melt and the battery will be destroyed. The separator also contains small pores that allow lithium ions to diffuse through during charge and discharge. High temperatures can cause these pores to close up, permanently damaging the cell. My job at NASA Glenn research center this summer will be to perform thermal characterization tests on an 18650 type lithium-ion battery. High temperatures cause the chemicals inside lithium ion batteries to spontaneously react with each other. My task is to conduct experiments to determine the temperature that the reaction takes place at, what components in the cell are reacting and the mechanism of the reaction. The experiments will be conducted using an accelerating rate calorimeter

Experiments to investigate direct containment heating phenomena with scaled models of the Zion Nuclear Power Plant in the Surtsey Test Facility

International Nuclear Information System (INIS)

Allen, M.D.; Pilch, M.M.; Blanchat, T.K.; Griffith, R.O.; Nichols, R.T.

1994-05-01

The Surtsey Facility at Sandia National Laboratories (SNL) is used to perform scaled experiments that simulate hypothetical high-pressure melt ejection (HPME) accidents in a nuclear power plant (NPP). These experiments are designed to investigate the effect of specific phenomena associated with direct containment heating (DCH) on the containment load, such as the effect of physical scale, prototypic subcompartment structures, water in the cavity, and hydrogen generation and combustion. In the Integral Effects Test (IET) series, 1:10 linear scale models of the Zion NPP structures were constructed in the Surtsey vessel. The RPV was modeled with a steel pressure vessel that had a hemispherical bottom head, which had a 4-cm hole in the bottom head that simulated the final ablated hole that would be formed by ejection of an instrument guide tube in a severe NPP accident. Iron/alumina/chromium thermite was used to simulate molten corium that would accumulate on the bottom head of an actual RPV. The chemically reactive melt simulant was ejected by high-pressure steam from the RPV model into the scaled reactor cavity. Debris was then entrained through the instrument tunnel into the subcompartment structures and the upper dome of the simulated reactor containment building. The results of the IET experiments are given in this report

Experiments to investigate direct containment heating phenomena with scaled models of the Zion Nuclear Power Plant in the Surtsey Test Facility

Energy Technology Data Exchange (ETDEWEB)

Allen, M.D.; Pilch, M.M.; Blanchat, T.K.; Griffith, R.O. [Sandia National Labs., Albuquerque, NM (United States); Nichols, R.T. [Ktech Corp., Albuquerque, NM (United States)

1994-05-01

The Surtsey Facility at Sandia National Laboratories (SNL) is used to perform scaled experiments that simulate hypothetical high-pressure melt ejection (HPME) accidents in a nuclear power plant (NPP). These experiments are designed to investigate the effect of specific phenomena associated with direct containment heating (DCH) on the containment load, such as the effect of physical scale, prototypic subcompartment structures, water in the cavity, and hydrogen generation and combustion. In the Integral Effects Test (IET) series, 1:10 linear scale models of the Zion NPP structures were constructed in the Surtsey vessel. The RPV was modeled with a steel pressure vessel that had a hemispherical bottom head, which had a 4-cm hole in the bottom head that simulated the final ablated hole that would be formed by ejection of an instrument guide tube in a severe NPP accident. Iron/alumina/chromium thermite was used to simulate molten corium that would accumulate on the bottom head of an actual RPV. The chemically reactive melt simulant was ejected by high-pressure steam from the RPV model into the scaled reactor cavity. Debris was then entrained through the instrument tunnel into the subcompartment structures and the upper dome of the simulated reactor containment building. The results of the IET experiments are given in this report.

Deformation and structure evolution of glassy poly(lactic acid) below the glass transition temperature

DEFF Research Database (Denmark)

Zhou, Chengbo; Li, Hongfei; Zhang, Yao

2015-01-01

, the onset of the mesocrystal formation is delayed to a higher strain value, whereas corresponding to the same critical orientation degree of amorphous chains (f(am) approximate to 0.45). The DSC results indicated that the post-T-g endothermic peak corresponding to the melting of mesocrystal appears...... and shifts to a higher temperature with increasing stretching temperature, followed by the down-shifts (to a lower temperature) of the exothermic peak of cold crystallization of PLA. The appearance of a small exothermic peak just before the melting peak related to the transition of the alpha' to alpha...... crystal implies the formation of an alpha' crystal during cold crystallization in the drawn PLA samples. The structure evolution of glassy PLA stretched below T-g was discussed in details....

A Demonstration of Le Chatelier’s Principle on the Nanoscale

Science.gov (United States)

2017-01-01

Photothermal desorption of molecules from plasmonic nanoparticles is an example of a light-triggered molecular release due to heating of the system. However, this phenomenon ought to work only if the molecule–nanoparticle interaction is exothermic in nature. In this study, we compare protein adsorption behavior onto gold nanoparticles for both endothermic and exothermic complexation reactions, and demonstrate that Le Chatelier’s principle can be applied to predict protein adsorption or desorption on nanomaterial surfaces. Polyelectrolyte-wrapped gold nanorods were used as adsorption platforms for two different proteins, which we were able to adsorb/desorb from the nanorod surface depending on the thermodynamics of their interactions. Furthermore, we show that the behaviors hold up under more complex biological environments such as fetal bovine serum. PMID:29104926

Treatability Studies Used to Test for Exothermic Reactions of Plutonium Decontamination Chemicals

Energy Technology Data Exchange (ETDEWEB)

Ewalt, John R.; Minette, Michael J.; Hopkins, Andrea M.; Cooper, Thurman D.; Simiele, Connie J.; Scott, Paul A.; Scheele, Randall D.; Charboneau, Stacy L.

2005-08-07

Fluor Hanford is decommissioning the PFP at the Hanford Site and is considering using agressive chemicals to remove transuranium contaminants. As part of the evaluation of these methods, Fluor is considering the path for disposal and the thermal stability of the waste products from the decontamination process. This paper provides the results of our studies on cerium nitrate and RadPro(TM), a nitric acid based complexant.

Self-propagating high-temperature synthesis of Sr-doped LaMnO3 perovskite as oxidation catalyst

International Nuclear Information System (INIS)

Hirano, T.; Purwanto, H.; Watanabe, T.; Akiyama, T.

2007-01-01

Sr-doped LaMnO 3 perovskite oxide has been focused on as one of the alternative catalysts to precious metals such as platinum that are used for cleaning automotive emission gas. The conventional Solid-state reaction method is a popular productive process for perovskite oxide, however, it is time and energy consuming process because it requires repeated prolonged heat treatment at high temperatures. Therefore, the purposes of this work are to produce Sr-doped LaMnO 3 perovskite by using Self-propagating high-temperature synthesis (SHS) and experimentally examine the oxidation catalytic activity of the product for cleaning automotive emission gas. In the SHS, powders of La 2 O 3 , SrCO 3 , Mn and NaClO 4 were well mixed at the desired ratio and poured in a graphite crucible, where at one end it was ignited by using an electrically heated carbon foil. The wave of exothermic reaction due to oxidation of manganese propagated to the other end in a short time. The obtained products were characterized by means of XRD, FE-SEM, BET and particle size distribution analysis and then evaluated via catalytic oxidation tests by using propane in a fixed bed reactor at several temperatures. From the XRD analysis, the products had the desired composition of La 1-x Sr x MnO 3 (x = 0, 0.1, 0.2 and 0.4) perovskite, in which the replacing ratio x of La and Sr in the products was easily controlled by changing the mixing ratio of raw materials. The catalytic activity test showed that the samples exhibited good catalytic activity for propane oxidation over 200 deg. C , although the products had a relatively small surface area. SHS showed the potential for the production of a relatively inexpensive catalytic converter

Production of Hydrogen from Bio-ethanol

International Nuclear Information System (INIS)

Fabrice Giroudiere; Christophe Boyer; Stephane His; Robert Sanger; Kishore Doshi; Jijun Xu

2006-01-01

IFP and HyRadix are collaborating in the development of a new hydrogen production system from liquid feedstock such as bio-ethanol. Reducing greenhouse gas (GHG) emissions along with high hydrogen yield are the key objectives. Market application of the system will be hydrogen refueling stations as well as medium scale hydrogen consumers including the electronics, metals processing, and oils hydrogenation industries. The conversion of bio-ethanol to hydrogen will be performed within a co-developed process including an auto-thermal reformer working under pressure. The technology will produce high-purity hydrogen with ultralow CO content. The catalytic auto-thermal reforming technology combines the exothermic and endothermic reaction and leads to a highly efficient heat integration. The development strategy to reach a high hydrogen yield target with the bio-ethanol hydrogen generator is presented. (authors)

Combustion synthesis of inorganic materials; Muki zairyo no nensho gose

Energy Technology Data Exchange (ETDEWEB)

Oyanagi, M. [Ryukoku University, Kyoto (Japan)

1999-11-01

Combustion synthesis of porous titan carbide is outlined. In combustion synthesis, exothermic chain reaction, which is induced by igniting at one point of the simple substance mixture, propagates the combustion wave, and the compound is synthesized, which can be sintered by it. By this method, to this day intermetallic compounds, ceramics and high melting point composite materials have been synthesized, and synthetics can be made compact by adding pressure during or just after the reaction. Recently, applying the induction heating jointly, preheating before the reaction and heat treatment after the reaction can be controlled, accordingly, many high melting point inorganic compounds and composite materials can be made by combustion synthesis under pressure. (NEDO)

Possible penetration of nuclear power in fuel and energy demand structure in chemical industry

International Nuclear Information System (INIS)

Balajka, J.

1986-01-01

Three basic technologies based on methane steam reforming using nuclear heating were assessed with respect of a simplified diagram of a link between a high temperature reactor and chemical technology. They included the technologies of production of methanol, hydrogen and ammonia which differ in the gradually increasing exothermal character of the fission gas processing into the resulting synthesis gas (methanol, ammonia) or the gaseous product (hydrogen). In dependence on the degree of available power from the high temperature reactor for steam reforming, the efficiency of the cycle of the synthesis gas preparation, the power demand, and the balance of the associated electric power generation and the capacity of the production unit were evaluated. (author)

The particle size distribution of fragmented melt debris from molten fuel coolant interactions

International Nuclear Information System (INIS)

Fletcher, D.F.

1984-04-01

Results are presented of a study of the types of statistical distributions which arise when examining debris from Molten Fuel Coolant Interactions. The lognormal probability distribution and the modifications of this distribution which result from the mixing of two distributions or the removal of some debris are described. Methods of fitting these distributions to real data are detailed. A two stage fragmentation model has been developed in an attempt to distinguish between the debris produced by coarse mixing and fine scale fragmentation. However, attempts to fit this model to real data have proved unsuccessful. It was found that the debris particle size distributions from experiments at Winfrith with thermite generated uranium dioxide/molybdenum melts were Upper Limit Lognormal. (U.K.)

Uniform Cu2Cl(OH)3 hierarchical microspheres: A novel adsorbent for methylene blue adsorptive removal from aqueous solution

International Nuclear Information System (INIS)

Wei, Wei; Gao, Pin; Xie, Jimin; Zong, Sekai; Cui, Henglv; Yue, Xuejie

2013-01-01

Using the solution phase method without any surfactants or templates, the hierarchical of Cu 2 Cl(OH) 3 microspheres were synthesized by freeze drying. The size and surface area of the microspheres are ca. 1–2 µm and 76.61 m 2 g −1 , respectively. A possible formation mechanism is presented based on the experimental results. Methylene blue was chosen to investigate the adsorption capacity of the as-prepared adsorbent. The effects of various experimental parameters, such as pH, initial dye concentration, and contact time were investigated. The results showed that the dye removal increased with the increasing in the initial concentration of the dye and also increased in the amount of microspheres used and initial pH. Adsorption data fitted well with the Freundlich adsorption isotherm. The thermodynamic analysis presented the exothermic, spontaneous and more ordered arrangement process. The microspheres could be employed effective for removal of dyes from aqueous solution. - Graphical abstract: The single-crystalline hierarchical Cu 2 Cl(OH) 3 spheres can be prepared for the first time by using a template-free process through freeze-drying. Meanwhile, the hierarchical spheres exhibited high adsorption capacity to methylene blue. Display Omitted - Highlights: • Cu 2 Cl(OH) 3 microspheres were successfully synthesized through a freeze drying process. • A possible formation mechanism of hierarchical microspheres was presented. • The Cu 2 Cl(OH) 3 microspheres have high methylene blue adsorption capacity. • Methylene blue adsorption is a spontaneous and exothermic process. • The adsorption mechanism of microspheres onto dye was proposed in detail

Thermodynamic study of (alkyl esters+{alpha},{omega}-alkyl dihalides) V. H{sub m}{sup E}andV{sub m}{sup E} for 25 binary mixtures {l_brace}xC{sub u-1}H{sub 2u-1}CO{sub 2}CH{sub 3}+(1-x){alpha},{omega}-ClCH{sub 2}(CH{sub 2}){sub v-2}CH{sub 2}Cl{r_brace}, where u=1 to 5, {alpha}=1 and v={omega}=2 to 6

Energy Technology Data Exchange (ETDEWEB)

Ortega, J. [Laboratorio de Termodinamica y Fisicoquimica de Fluidos, Parque Cientifico-Tecnologico, Campus Universitario de Tafira, Universidad de Las Palmas de Gran Canaria, 35071 Las Palmas de Gran Canaria, Canary Islands (Spain)]. E-mail: jortega@dip.ulpgc.es; Marrero, E. [Laboratorio de Termodinamica y Fisicoquimica de Fluidos, Parque Cientifico-Tecnologico, Campus Universitario de Tafira, Universidad de Las Palmas de Gran Canaria, 35071 Las Palmas de Gran Canaria, Canary Islands (Spain)

2007-05-15

The experimental data of excess molar enthalpies H{sub m}{sup E} and excess molar volumes V{sub m}{sup E} are presented for a set of 25 binary mixtures comprised of the first five methyl esters C{sub u-1}H{sub 2u-1}COOCH{sub 3} (u=1 to 5) and five {alpha},{omega}-dichloroalkanes, ClCH{sub 2}(CH{sub 2}){sub v-2}CH{sub 2}Cl (v=2 to 6), obtained at a temperature of 298.15K and atmospheric pressure. Except for the mixtures with u=1 and v=2 to 6, which are all endothermic and with u=5 and v=2 to 6, which are all exothermic, the others present net endo/exothermic effects and these mixing effects evolve quasiregularly, from endothermic to exothermic, depending on the dichloroalkane present. However, the V{sub m}{sup E} are positive in most mixtures except for those corresponding to u=4,5 and v=5,6, which present contraction effects. These results indicate a set of specific interactions with simultaneous effects for V{sub m}{sup E} of expansion/contraction and for exothermic/endothermic H{sub m}{sup E} for this set of mixtures. The change in V{sub m}{sup E} with the chain length of the compounds is irregular. To achieve a good application of the UNIFAC model using the version of Dang and Tassios, parameters of the ester (G)/dichloride (G') interaction were calculated again, making a distinction, during its application, dependent on the acid part of the ester u. Hence, interaction parameters are presented as a function of u, and of the dichloroalkane chain length v. The most appropriate general expression was of the type:a{sub G/G{sup '}}={phi}(u,v)={sigma}sub(i=0)sup(n)a{sub i-1}u{sup i-1}+{sigma}sub(i=0= )sup(n)b{sub i-1}v{sup i-1}and with this proposal good estimations of enthalpies were obtained with the UNIFAC model.

Polymerization stress evolution of a bulk-fill flowable composite under different compliances.

Science.gov (United States)

Guo, Yongwen; Landis, Forrest A; Wang, Zhengzhi; Bai, Ding; Jiang, Li; Chiang, Martin Y M

2016-04-01

To use a compliance-variable instrument to simultaneously measure and compare the polymerization stress (PS) evolution, degree of conversion (DC), and exotherm of a bulk-fill flowable composite to a packable composite. A bulk-fill flowable composite (Filtek Bulk-fill, FBF) and a conventional packable composite (Filtek Z250, Z250) purchased from 3M ESPE were investigated. The composites were studied using a cantilever-beam based instrument equipped with an in situ near infrared (NIR) spectrometer and a microprobe thermocouple. The measurements were carried out under various instrumental compliances (ranging from 0.3327μm/N to 12.3215μm/N) that are comparable to the compliances of clinically prepared tooth cavities. Correlations between the PS and temperature change as well as the DC were interpreted. The maximum PS of both composites at 10min after irradiation decreased with the increase in the compliance of the cantilever beam. The FBF composite generated a lower final stress than the Z250 sample under instrumental compliances less than ca. 4μm/N; however, both materials generated statistically similar PS values at higher compliances. The reaction exotherm and the DC of both materials were found to be independent of compliance. The DC of the FBF sample was slightly higher than that of the packable Z250 composite while the peak exotherm of FBF was almost double that of the Z250 composite. For FBF, a characteristic drop in the PS was observed during the early stage of polymerization for all compliances studied which was not observed in the Z250 sample. This drop was shown to relate to the greater exotherm of the less-filled FBF sample relative to the Z250 composite. While the composites with lower filler content (low viscosity) are generally considered to have lower PS than the conventional packable composites, a bulk-fill flowable composite was shown to produce lower PS under a lower compliance of constraint as would be experienced if the composite was used as

Multi-Model Adaptive Fuzzy Controller for a CSTR Process

Directory of Open Access Journals (Sweden)

Shubham Gogoria

2015-09-01

Full Text Available Continuous Stirred Tank Reactors are intensively used to control exothermic reactions in chemical industries. It is a very complex multi-variable system with non-linear characteristics. This paper deals with linearization of the mathematical model of a CSTR Process. Multi model adaptive fuzzy controller has been designed to control the reactor concentration and temperature of CSTR process. This method combines the output of multiple Fuzzy controllers, which are operated at various operating points. The proposed solution is a straightforward implementation of Fuzzy controller with gain scheduler to control the linearly inseparable parameters of a highly non-linear process.

State-to-state quantum dynamics of the F + HCl (vi = 0, ji = 0) → HF(vf, jf) + Cl reaction on the ground state potential energy surface.

Science.gov (United States)

Li, Anyang; Guo, Hua; Sun, Zhigang; Kłos, Jacek; Alexander, Millard H

2013-10-07

The state-to-state reaction dynamics of the title reaction is investigated on the ground electronic state potential energy surface using two quantum dynamical methods. The results obtained using the Chebyshev real wave packet method are in excellent agreement with those obtained using the time-independent method, except at low translational energies. It is shown that this exothermic hydrogen abstraction reaction is direct, resulting in a strong back-scattered bias in the product angular distribution. The HF product is highly excited internally. Agreement with available experimental data is only qualitative. We discuss several possible causes of disagreement with experiment.

Single-electron capture in He[sup 2+]-D[sub 2] collisions

Energy Technology Data Exchange (ETDEWEB)

Bordenave-Montesquieu, D.; Dagnac, R. (Toulouse-3 Univ., 31 (France))

1994-02-14

Doubly differential cross sections of single-electron capture were measured for He[sup 2+] impinging on a molecular deuterium target. The investigated collision energies are 4, 6 and 8 keV and the scattering angles range from 10' to 2[sup o]30' (laboratory frame). The exothermic capture leading to He[sup +] (1s) + D[sub 2][sup +*] was found to be the most important process at low energies and angles, whereas the endothermic channels leading to dissociative capture become the main processes at high scattering angles, i.e. at small impact parameters. (author).

Simulation of pulsed accidental energy release in a reactor core

International Nuclear Information System (INIS)

Ryshanskii, V.A.; Ivanov, A.G.; Uskov, A.A.

1995-01-01

At the present time the strength of the load-bearing members of VVER and fast reactors during a hypothetical accident is ordinarily investigated in model experiments [1]. A power burst during an accident is simulated by a nonnuclear exothermal reaction in water, which simulates the coolant and fills the model. The problem is to make the correct choice of the simulator of the accidental energy burst as an effective (i.e., sufficiently high working capacity) source of dangerous loads, corresponding to the conditions of an accident. What factors and parameters determine the energy release? The answers to these questions are contradictory

Transfer Hydrogenation in Open-Shell Nucleotides — A Theoretical Survey

Directory of Open Access Journals (Sweden)

Florian Achrainer

2014-12-01

Full Text Available The potential of a larger number of sugar models to act as dihydrogen donors in transfer hydrogenation reactions has been quantified through the calculation of hydrogenation energies of the respective oxidized products. Comparison of the calculated energies to hydrogenation energies of nucleobases shows that many sugar fragment radicals can reduce pyrimidine bases such as uracil in a strongly exothermic fashion. The most potent reducing agent is the C3' ribosyl radical. The energetics of intramolecular transfer hydrogenation processes has also been calculated for a number of uridinyl radicals. The largest driving force for such a process is found for the uridin-C3'-yl radical, whose rearrangement to the C2'-oxidized derivative carrying a dihydrouracil is predicted to be exothermic by 61.1 kJ/mol in the gas phase.

(Amino acid + silica) adsorption thermodynamics: Effects of temperature

International Nuclear Information System (INIS)

Sebben, Damien; Pendleton, Phillip

2015-01-01

Highlights: • High resolution, low concentration Gly, Lys and Glu solution adsorption isotherms. • All isotherms fitted with Langmuir–Freundlich isotherm model. • Gly, Lys and Glu show exothermic adsorption processes. • Isosteric heat analyses reveal changes in interaction strength with surface coverage. - Abstract: A thorough understanding of amino acid adsorption by mineral and oxide surfaces has a major impact on a variety of industrial and biomedical applications. Little information currently exists regarding temperature effects on most of these adsorption processes. Deeper thermodynamic analyses of their multiple temperature adsorption isotherms would aid the interpretation of the interfacial interactions. Low solution concentration adsorption isotherms for glycine, lysine and glutamic acid on a silica adsorbent were generated for T = (291, 298 and 310) K. Data analysis via the Clausius–Clapeyron method yielded the isosteric heat of adsorption as a function of fractional monolayer coverage for each adsorptive. Each amino acid showed an exothermic adsorption response. Glycine and lysine experienced a greater negative effect of increased temperature compared with glutamic acid, indicating a greater number of adsorbed molecules than glutamic acid, with the former undergoing intermolecular clustering within the adsorbed phase. Isosteric heat analyses suggest ionic interactions for lysine and hydrogen bonding for glutamic acid, both weakening with increased coverage. In contrast, initial hydrogen bonding led to ionic bonding for glycine with increasing coverage

Mixed system of ionic liquid and non-ionic surfactants in aqueous media: Surface and thermodynamic properties

International Nuclear Information System (INIS)

Bhatt, Darshak; Maheria, Kalpana; Parikh, Jigisha

2014-01-01

Highlights: • Interaction of ionic liquid and ethylene oxide based non-ionic surfactants in aqueous media. • Evaluation of various surface properties and thermodynamic parameters. • Micellar growth ensues from exothermic to endothermic with increase in temperature. • Micelle formation is enthalpy driven at low temperature and entropy driven at higher temperature. • The micellization power and adsorption proficiency decreased at high IL concentrations. - Abstract: The mixed system of ionic liquid (IL) tetraethyl ammonium tetrafluoroborate [TEA(BF 4 )] and numerous ethylene oxide based non-ionic surfactants in aqueous media were studied using surface tension, viscosity and dynamic light scattering (DLS) measurements. Various surface properties like critical micelle concentration (cmc), maximum surface excess concentration (Γ max ), minimum surface area per surfactant molecule (A min ), surface tension at the cmc (γ cmc ), adsorption efficiency (pC 20 ), and effectiveness of surface tension reduction (π cmc ) as well as thermodynamic parameters of micellization have been determined. DLS and viscosity measurements revealed that the micellar growth was attributed to the bridged solvophilicity of the POE chain in surfactants at elevated temperatures. In most of the cases, the progression ensues from exothermic to endothermic with increase in temperature of the mixed system. Thermodynamic parameter indicates that the micelle formation process is enthalpy driven at low temperature and entropy driven at higher temperature

Equilibrium and Thermodynamic Studies of Anionic Dyes Removal by an Anionic Clay-Layered Double Hydroxide

International Nuclear Information System (INIS)

Kantasamy, N.; Siti Mariam Sumari

2016-01-01

Adsorption isotherm describes the interaction of adsorbates with adsorbent in equilibrium. Equilibrium data was examined using Langmuir and Freundlich isotherm models. Thermodynamic studies were used to evaluate the thermodynamic parameters; heat of enthalpy change (ΔH degree), Gibbs free energy change (ΔG degree) and heat of entropy change (ΔSdegree) in order to gain information regarding the nature of adsorption (exothermic or endothermic). Four reactive dyes of anionic type, Acid Blue 29 (AB29), Reactive Black 5 (RB5), Reactive Orange 16 (RO16) and Reactive Red 120 (RR120) were used to obtain equilibrium isotherms at 25, 35, 45 and 55 degree Celsius. Based on Giles' classification, the isotherm produced were of L2-type, indicating strong dye affinity towards the adsorbent, and with weak competition with the solvent molecules for active adsorption sites. Equilibrium data fitted both Langmuir and Freundlich isotherm models with high correlation coefficient (R"2 > 0.91) indicating the possibility of both homogeneity and heterogeneous nature of adsorption. The negative values of ΔGdegree indicate the adsorption processes were spontaneous and feasible. The negative values of ΔHdegree lie between -20 to -75 kJ/ mol, suggesting these processes were exothermic and physical in nature. The negative values of ΔSdegree are indication of decreased disorder and randomness of spontaneous adsorption of reactive dyes on layered double hydroxide as adsorbent. (author)

Anoxic and Oxic Oxidation of Rocks Containing Fe(II)Mg-Silicates and Fe(II)-Monosulfides as Source of Fe(III)-Minerals and Hydrogen. Geobiotropy.

Science.gov (United States)

Bassez, Marie-Paule

2017-12-01

In this article, anoxic and oxic hydrolyses of rocks containing Fe (II) Mg-silicates and Fe (II)-monosulfides are analyzed at 25 °C and 250-350 °C. A table of the products is drawn. It is shown that magnetite and hydrogen can be produced during low-temperature (25 °C) anoxic hydrolysis/oxidation of ferrous silicates and during high-temperature (250 °C) anoxic hydrolysis/oxidation of ferrous monosulfides. The high-T (350 °C) anoxic hydrolysis of ferrous silicates leads mainly to ferric oxides/hydroxides such as the hydroxide ferric trihydroxide, the oxide hydroxide goethite/lepidocrocite and the oxide hematite, and to Fe(III)-phyllosilicates. Magnetite is not a primary product. While the low-T (25 °C) anoxic hydrolysis of ferrous monosulfides leads to pyrite. Thermodynamic functions are calculated for elementary reactions of hydrolysis and carbonation of olivine and pyroxene and E-pH diagrams are analyzed. It is shown that the hydrolysis of the iron endmember is endothermic and can proceed within the exothermic hydrolysis of the magnesium endmember and also within the exothermic reactions of carbonations. The distinction between three products of the iron hydrolysis, magnetite, goethite and hematite is determined with E-pH diagrams. The hydrolysis/oxidation of the sulfides mackinawite/troilite/pyrrhotite is highly endothermic but can proceed within the heat produced by the exothermic hydrolyses and carbonations of ferromagnesian silicates and also by other sources such as magma, hydrothermal sources, impacts. These theoretical results are confirmed by the products observed in several related laboratory experiments. The case of radiolyzed water is studied. It is shown that magnetite and ferric oxides/hydroxides such as ferric trihydroxide, goethite/lepidocrocite and hematite are formed in oxic hydrolysis of ferromagnesian silicates at 25 °C and 350 °C. Oxic oxidation of ferrous monosulfides at 25 °C leads mainly to pyrite and ferric oxides/hydroxides such as

Progress In Developing an Impermeable, High Temperature Ceramic Composite for Advanced Reactor Clad And Structural Applications

International Nuclear Information System (INIS)

Feinroth, Herbert; Hao, Bernard; Fehrenbacher, Larry; Patterson, Mark

2002-01-01

Most Advanced Reactors for Energy and Space Applications require higher temperature materials for fuel cladding and core internal structures. For temperatures above 500 deg. C, metal alloys do not retain sufficient strength or long term corrosion resistance for use in either water, liquid metal or gas cooled systems. In the case of water cooled systems, such metals react exo-thermically with water during core overheating accidents, thus requiring extensive and expensive emergency systems to protect against major releases. Past efforts to apply ceramic composites (oxide, carbide or nitride based) having passive safety characteristics, good strength properties at high temperatures, and reasonable resistance to crack growth, have not been successful, either because of irradiation induced effects, or lack of impermeability to fission gases. Under a Phase 1 SBIR (Small Business Innovative Research) project sponsored by DOE's Office of Nuclear Energy, the authors have developed a new material system that may solve these problems. A hybrid tubular structure (0.6 inches in outside diameter) consisting of an inner layer of monolithic silicon carbide (SiC) and outer layers of SiC-SiC composite, bonded to the inner layer, has been fabricated in small lengths. Room temperature permeability tests demonstrate zero gas leakage at pressures up to 120 psig internal pressure. Four point flexural bending tests on these hybrid tubular specimens demonstrate a 'graceful' failure mode: i.e. - the outer composite structure sustains a failure mode under stress that is similar to the yield vs. stress characteristics of metal structures. (authors)

Freezing pattern and frost killing temperature of apple (Malus domestica) wood under controlled conditions and in nature.

Science.gov (United States)

Pramsohler, Manuel; Hacker, Jürgen; Neuner, Gilbert

2012-07-01

The freezing pattern and frost killing temperatures of apple (Malus domestica Borkh.) xylem were determined by differential thermal analysis and infrared differential thermal analysis (IDTA). Results from detached or attached twigs in controlled freezing experiments and during natural field freezing of trees were compared. Non-lethal freezing of apoplastic water in apple xylem as monitored during natural winter frosts in the field occurred at -1.9 ± 0.4 °C and did not change seasonally. The pattern of whole tree freezing was variable and specific to the environmental conditions. On detached twigs high-temperature freezing exotherms (HTEs) occurred 2.8 K below the temperature observed under natural frosts in the field with a seasonal mean of -4.7 ± 0.5 °C. Microporous apple xylem showed freezing without a specific pattern within a few seconds in IDTA images during HTEs, which is in contrast to macroporous xylem where a 2D freezing pattern mirrors anatomical structures. The pith tissue always remained unfrozen. Increasing twig length increased ice nucleation temperature; for increased twig diameter the effect was not significant. In attached twigs frozen in field portable freezing chambers, HTEs were recorded at a similar mean temperature (-4.6 ± 1.0 °C) to those for detached twigs. Upon lethal intracellular freezing of apple xylem parenchyma cells (XPCs) low-temperature freezing exotherms (LTEs) can be recorded. Low-temperature freezing exotherms determined on detached twigs varied significantly between a winter minimum of -36.9 °C and a summer maximum -12.7 °C. Within the temperature range wherein LTEs were recorded by IDTA in summer (-12.7 ± 0.5 to -20.3 ± 1.1 °C) various tiny clearly separated discontinuous freezing events could be detected similar to that in other species with contrasting XPC anatomy. These freezing events appeared to be initially located in the primary and only later in the secondary xylem. During the LTE no

experimental investigation of the effect of microwave drying

African Journals Online (AJOL)

Alayande Ibraheem

sample was water washed to remove excess alkali metal present through hydrolysis, sun dried and ground to obtain a ..... activated carbon resulting in exothermic reaction which may .... Ubalua A O “Cassava Wastes: Treatments Options.

Mapping three-dimensional temperature in microfluidic chip.

KAUST Repository

Wu, Jinbo; Kwok, Tsz Yan; Li, Xiaolin; Cao, Wenbin; Wang, Yu; Huang, Junying; Hong, Yaying; Zhang, Dongen; Wen, Weijia

2013-01-01

and 2 ~ 6 °C temperature resolution depending the capture parameters. This method is successfully applied to monitor the local temperature variation throughout micro-droplet heat transfer process and further reveal exothermic nanoliter droplet reactions

Thermal Manifestations and Nanoindentation of Bone Cements for Orthopaedic Surgery

Czech Academy of Sciences Publication Activity Database

Hloch, Sergej; Monka, P.; Hvizdoš, P.; Jakubéczyová, D.; Kozak, D.; Čolič, K.; Kloc, J.; Magurová, D.

2013-01-01

Roč. 17, č. 1 (2013), s. 251-258 ISSN 0354-9836 Institutional support: RVO:68145535 Keywords : bone cement * exothermic behaviour * nanoindentation * porosity * osteonecrosis Subject RIV: FJ - Surgery incl. Transplants Impact factor: 0.962, year: 2013

EVALUATION OF BIOAEROSOL COMPONENTS, GENERATION FACTORS, AND AIRBORNE TRANSPORT ASSOCIATED WITH LIME TREATMENT OF CONTAMINATED SEDIMENT

Science.gov (United States)

Lime treatment has been used in contaminated sediment management activities for many purposes such as dewatering, improvement of physical properties, and reducing contaminant mobility. Exothermic volatilization of volatile organic compounds from lime-treated sediment is well kno...

Experimental investigations of MFCI in Russia

International Nuclear Information System (INIS)

Zagorulko, Yu.I.; Kozlov, F.A.; Masagutov, R.F.

1994-01-01

This report contains a review of the experimental investigations of MFCI which are carried out as applied to the safety problems of LMFBR, mainly in IPPE. Until the present time these investigations have been performed in out of pile conditions, using different substances for molten fuel simulation. A brief description of the experimental installations and results obtained in the course of experimental program realization is given. In particular the results are presented on the study of MFCI phenomenology with regards to the influence on the interaction energy release of such factors as: type of molten fuel-coolant contact, temperature conditions, ratio of interacted masses, scale factor. Simulation experiments have been effectuated using the following pairs of interaction media: low-melting metals (Lead, Tin, Bismuth, Aluminium)/water; molten Titan and Stainless steel/water; molten Titan and Stainless steel/sodium, eutectic alloy potassium-sodium; alumina/sodium; thermite mixture (Zr + Fe 2 O 3 )/water, sodium. The experiments were carried out mainly with the melts masses below 1 kg, except for some series of the experiments on molten Lead-water interaction, where the melt masses as big as 40 kg were used. Initial temperatures of low-melting metals have not exceeded 800 deg. C, while for the Stainless steel, Titan melts and alumina they were equal to 2200 deg. and 2500 deg. C respectively. The temperature of the melt, obtained by combustion of the thermite mixture Zr + Fe 2 O 3 , was about 3000 deg. C. The first part of the MFCI investigation program has been completed for the present time. A set of the data on the dynamical characteristics of interactions (time delays, amplitudes and shape of interaction pressure pulses, duration of interaction stage) and conversion coefficients of melt thermal energy into mechanical one was obtained. Analysis of these results has shown an essentially milder interaction energetics in the case of alkali metals coolants as compared

Adsorption of basic dye on high-surface-area activated carbon prepared from coconut husk: Equilibrium, kinetic and thermodynamic studies

Energy Technology Data Exchange (ETDEWEB)

Tan, I.A.W.; Ahmad, A.L. [School of Chemical Engineering, Universiti Sains Malaysia, Engineering Campus, 14300 Nibong Tebal, Penang (Malaysia); Hameed, B.H. [School of Chemical Engineering, Universiti Sains Malaysia, Engineering Campus, 14300 Nibong Tebal, Penang (Malaysia)], E-mail: chbassim@eng.usm.my

2008-06-15

Adsorption isotherm and kinetics of methylene blue on activated carbon prepared from coconut husk were determined from batch tests. The effects of contact time (1-30 h), initial dye concentration (50-500 mg/l) and solution temperature (30-50 {sup o}C) were investigated. Equilibrium data were fitted to Langmuir, Freundlich, Temkin and Dubinin-Radushkevich isotherm models. The equilibrium data were best represented by Langmuir isotherm model, showing maximum monolayer adsorption capacity of 434.78 mg/g. The kinetic data were fitted to pseudo-first-order, pseudo-second-order and intraparticle diffusion models, and was found to follow closely the pseudo-second-order kinetic model. Thermodynamic parameters such as standard enthalpy ({delta}H{sup o}), standard entropy ({delta}S{sup o}) and standard free energy ({delta}G{sup o}) were evaluated. The adsorption interaction was found to be exothermic in nature. Coconut husk-based activated carbon was shown to be a promising adsorbent for removal of methylene blue from aqueous solutions.

Thermal Characteristics of Conversion-Type FeOF Cathode in Li-ion Batteries

Directory of Open Access Journals (Sweden)

Liwei Zhao

2017-10-01

Full Text Available Rutile FeOF was used as a conversion-type cathode material for Li-ion batteries. In the present study, 0.6Li, 1.4Li, and 2.7Li per mole lithiation reactions were carried out by changing the electrochemical discharge reaction depth. The thermal characteristics of the FeOF cathode were investigated by thermogravimetric mass spectrometric (TG-MS and differential scanning calorimeter (DSC systems. No remarkable HF release was detected, even up to 700 °C, which indicated a low toxic risk for the FeOF cathode. Changes in the thermal properties of the FeOF cathode via different conversion reaction depths in the associated electrolyte were studied by changing the cathode/electrolyte ratio in the mixture. LiFeOF was found to exothermically react with the electrolyte at about 210 °C. Similar exothermic reactions were found with charged FeOF cathodes because of the irreversible Li ions. Among the products of the conversion reaction of FeOF, Li2O was found to exothermically react with the electrolyte at about 120 °C, which induced the main thermal risk of the FeOF cathode. It suggests that the oxygen-containing conversion-type cathodes have a higher thermal risk than the oxygen-free ones, but controlling the cathode/electrolyte ratio in cells successfully reduced the thermal risk. Finally, the thermal stability of the FeOF cathode was evaluated in comparison with FeF3 and LiFePO4 cathodes.

Thermodynamic study of (alkyl esters+α,ω-alkyl dihalides) III. HmEandVmE for 20 binary mixtures {xCu-1H2u-1CO2C4H9+(1-x)α,ω-ClCH2(CH2)v-2CH2Cl}, where u=1 to 4, α=1 and v=ω=2 to 6

International Nuclear Information System (INIS)

Ortega, J.; Marrero, E.; Toledo, F.J.

2006-01-01

In this article, the experimental data of excess molar enthalpies H m E and excess molar volumes V m E are presented for a set of 20 binary mixtures comprised of the first four butyl alkanoates (methanoate to butanoate) and five α,ω-dichloroalkanes (1,2-dichloroethane to 1,6-dichlorohexane), obtained at atmospheric pressure and at a temperature of 298.15K. The results indicate the existence of specific interactions between both kinds of compounds resulting in exothermic processes for most mixtures, except for those containing butyl methanoate which give rise to net endo/exothermic effects. The V m E are positive for mixtures of (butyl esters+1,2-dichloroethane or 1,3-dichloropropane) and negative for the remaining ones. The change in H m E with the dichloroethane chain length for a same ester is regular although the V m E presents an irregular variation. It can, therefore, be deuced from this that the mixing process involves both effects, exothermic/endothermic and expansion/contraction, simultaneously. The behaviour of the mixtures is interpreted on the basis of the results observed and attributed to different effects taking place among the molecules studied. To improve application of the UNIFAC model using the version of Dang and Tassios, average values were recalculated again for parameters of the ester/chloride interaction, distinguishing, during its application, the functional group of the acid part of the ester. In spite of this, the model does not adequately reproduce the systems' behaviour.

Thermodynamic investigation of the phase equilibrium boundary between TiO2 rutile and its α-PbO2-type high-pressure polymorph

Science.gov (United States)

Kojitani, Hiroshi; Yamazaki, Monami; Kojima, Meiko; Inaguma, Yoshiyuki; Mori, Daisuke; Akaogi, Masaki

2018-06-01

Heat capacity (C P) of rutile and α-PbO2 type TiO2 (TiO2-II) were measured by the differential scanning calorimetry and thermal relaxation method. Using the results, standard entropies at 1 atm and 298.15 K of rutile and TiO2-II were determined to be 50.04(4) and 46.54(2) J/mol K, respectively. Furthermore, thermal expansivity (α) determined by high-temperature X-ray diffraction measurement and mode Grüneisen parameters obtained by high-pressure Raman spectroscopy suggested the thermal Grüneisen parameter (γ th) for TiO2-II of 1.7(1). By applying the obtained low-temperature C P and γ th, the measured C P and α data of TiO2-II were extrapolated to higher temperature region using a lattice vibrational model calculation, as well as rutile. Internally consistent thermodynamic data sets of both rutile and TiO2-II assessed in this study were used to thermodynamically calculate the rutile‒TiO2-II phase equilibrium boundary. The most plausible boundary was obtained to be P (GPa) = 0.0074T (K) - 1.7. Our boundary suggests that the crystal growth of TiO2-II observed below 5.5 GPa and 900 K in previous studies advanced in its stability field. The phase boundary calculation also suggested small, exothermic phase transition enthalpy from rutile to TiO2-II at 1 atm and 298.15 K of - 0.5 to - 1.1 kJ/mol. This implies that the thermodynamic stability of rutile at 1 atm above room temperature is due to larger contribution of entropy term.

Influence of Pressure on Physical Property of Ammonia Borane and its Re-hydrogenation

Energy Technology Data Exchange (ETDEWEB)

Chen, Jiuhua [Florida Intl Univ., Miami, FL (United States)

2015-08-14

The project systematically studied the high pressure behavior of ammonia borane and its derivative lithium amidoborane. Phase transitions in these materials are investigated in the pressure range up to 20 GPa and temperature range from 80 K to 400K. A number of new phase transitions are discovered in this pressure and temperature range including a second order transformation at 5 GPa and a first order transformation at 12 GPa at room temperature, and four new transitions at high pressure and low temperatures. The Clapeyron slopes for both pressure-induce tetragonal (I4mm) phase to orthorhombic (Cmc21) phase and temperature-induce tetragonal (I4mm) phase to orthorhombic (Pmn21) phase are determined to be positive, indicating these phase transitions are exothermic. This result demonstrates that the high pressure orthorhombic phase of ammonia borane has lower enthalpy than that of tetragonal phase at ambient conditions. If we assume decomposition from the orthorhombic phase yields the same products as that from the tetragonal phase, the decomposition of the orthorhombic phase will be less exothermic. Therefore rehydrogenation from the decomposed product into the orthorhombic phase at high pressure may become easier. The project also studied the influences of nanoconfinement on the phase transitions. Comparative study using Raman spectroscopy indicates that the temperature induced I4mm to Pmn21 transition is suppressed from 217 K to 195 K when the sample is confined in SBA15 (7-9 nm pore size). When the pore size is reduced from 7-9 nm to 3-4 nm, this transition is totally suppressed in the temperature down to 80 K. A similar influence of the nanoconfiement on pressure induced phase transitions is also observed using Raman spectroscopy. The phase boundary between the I4mm phase and high pressure Cmc21 phase at ambient temperature shifts from 0.9 GPa to 0.5 GPa; and that between the Cmc21 phase and higher pressure P21 phase shifts from 10.2 GPa to 9.7 GPa.

Physico-chemical and thermochemical studies of the hydrolytic conversion of amorphous tricalcium phosphate into apatite

International Nuclear Information System (INIS)

Somrani, Saida; Banu, Mihai; Jemal, Mohamed; Rey, Christian

2005-01-01

The conversion of amorphous tricalcium phosphate with different hydration ratio into apatite in water at 25 deg. C has been studied by microcalorimetry and several physical-chemical methods. The hydrolytic transformation was dominated by two strong exothermic events. A fast, relatively weak, wetting process and a very slow but strong heat release assigned to a slow internal rehydration and the crystallization of the amorphous phase into an apatite. The exothermic phenomenon related to the rehydration exceeded the crystalline transformation enthalpy. Rehydration occurred before the conversion of the amorphous phase into apatite and determined the advancement of the hydrolytic reaction. The apatitic phases formed evolved slightly with time after their formation. The crystallinity increased whereas the amount of HPO 4 2- ion decreased. These data allow a better understanding of the behavior of biomaterials involving amorphous phases such as hydroxyapatite plasma-sprayed coatings

Mathematical Model For Autoclave Curing Of Unsaturated Polyester Based Composite Materials

Directory of Open Access Journals (Sweden)

Adnan A. Abdul Razak

2013-05-01

Full Text Available Heat transfer process involved in the autoclave curing of fiber-reinforced thermosetting composites is investigated numerically. A model for the prediction of the temperature and the extent of the reaction across the laminate thickness during curing process in the autoclave of unsaturated polyester based composite has been developed. The governing equation for one dimensional heat transfer, and accounting for the heat generation due to the exothermic cure reaction in the composites had been used.  It was found that the temperature at the central of the laminate increases up to the external imposed temperature, because of the thermal conductivity of the resin and fiber. The heat generated by the exothermic reaction of the resin is not adequately removed; the increase in the temperature at the center increases the resins rate reaction, which in turn generates more heat.

Study on the oscillation dissolved behavior of oxysophocarpine in water

International Nuclear Information System (INIS)

Li, Z.X.; Zhao, W.W.; Pu, X.H.

2012-01-01

Highlights: ► The dissolution enthalpies of oxysophocarpine in water was measured using a RD496-2000 Calvet microcalorimeter. ► The results show that the dissolution process possessed an endothermic and exothermic oscillation behavior. ► A series of thermodynamics functions and half-life period were obtained from thermodynamic and kinetic calculations. - Abstract: In this paper, the enthalpies of dissolution of oxysophocarpine in water were measured using a RD496-2000 Calvet microcalorimeter at 298.15 K under atmospheric pressure, showing that the dissolution process was an endothermic and exothermic oscillation behavior. A series of thermodynamics functions and the half-life were obtained by thermodynamic and kinetic methods. The results show that this work not only provide a simple method for the determination of the half-life for a drug but also offer a theoretical reference for the clinical application of resveratrol.

Fast Neutral reactions in cold interstellar clouds

International Nuclear Information System (INIS)

Graff, M.M.

1989-01-01

The dynamics of exothermic neutral reactions between radical species have been examined, with particular attention to reactivity at the very low energies characteristic of cold interstellar clouds. Long-range interactions (electrostatic and spin-orbit) were considered within in the adiabatic capture-infinite order sudden approximation (ACIOSA). Analytic expressions have been developed for cross sections and rate constants of exothermic reactions between atoms and dipolar radicals at low temperatures. A method for approximating the adiabatic potential surface for the reactive state will be presented. The reaction systems O+OH and O+CH are both predicted to be fast at low temperatures. The systems C+CH and C+OH are expected to be nonreactive at low temperatures, and upper limits of rate constants for these reactions have been estimated. General predictions are made for other reaction systems. Implications for interstellar chemistry will be discussed

The martensitic transformation of Ti–Ni shape memory thin films under proton irradiation

International Nuclear Information System (INIS)

Gao, Z.Y.; Wang, H.Z.; Zhu, Y.Y.; Meng, X.L.; Cai, W.

2015-01-01

The martensitic transformation behavior of a Ti–Ni alloy irradiated by proton with different doses has been investigated. It is found that the samples irradiated by 150 keV protons have a two-step phase transformation during heating and only one-step transformation during cooling. The exothermic peak at higher temperature disappears during the following thermal cycling. A model based on the stress-assisted martensitic transformation was established by the Transport of Ions in Matter (TRIM) calculations in order to explain the transformation behavior. - Highlights: • Martensitic transformation behavior of TiNi alloy under proton irradiation • Two-step transformation appears upon heating for a sample irradiated at 150 keV. • One-step transformation appears upon cooling for a sample irradiated at 150 keV. • In the following thermal cycling, the higher temperature exothermic peak vanishes

Intercalation studies of zinc hydroxide chloride: Ammonia and amino acids

Science.gov (United States)

Arízaga, Gregorio Guadalupe Carbajal

2012-01-01

Zinc hydroxide chloride (ZHC) is a layered hydroxide salt with formula Zn5(OH)8Cl2·2H2O. It was tested as intercalation matrix for the first time and results were compared with intercalation products of the well-known zinc hydroxide nitrate and a Zn/Al layered double hydroxide. Ammonia was intercalated into ZHC, while no significant intercalation occurred in ZHN. Aspartic acid intercalation was only achieved by co-precipitation at pH=10 with ZHC and pH=8 with zinc hydroxide nitrate. Higher pH resistance in ZHC favored total deprotonation of both carboxylic groups of the Asp molecule. ZHC conferred more thermal protection against Asp combustion presenting exothermic peaks even at 452 °C while the exothermic event in ZHN was 366 °C and in the LDH at 276 °C.

The excess enthalpies of liquid Ge-Pb-Te alloys

International Nuclear Information System (INIS)

Blachnik, R.; Binder, J.; Schlieper, A.

1997-01-01

The excess enthalpies of liquid alloys in the ternary system Ge-Pb-Te were determined at 1210 K in a heat flow calorimeter for five sections Ge y Pb 1-y -Te with y = 0.2, 0.4, 0.5, 0.6 and 0.8 and at 1153 K for Ge 0.5 Pb 0.5 -Te. The enthalpy surface in the ternary system is determined by a valley of exothermic minima, stretching from an exothermic minimum at the composition GeTe to one at the composition PbTe in the respective binaries. The excess enthalpies in the limiting metallic binary were adapted with the Redlich-Kister formalism. For the description of the thermodynamic functions in the ternary system the equation of Bonnier was taken using ternary coefficients. The calculated curves are in good agreement with the experimental data. (orig.)

Hybrid fiber gratings coated with a catalytic sensitive layer for hydrogen sensing in air.

Science.gov (United States)

Caucheteur, Christophe; Debliquy, Marc; Lahem, Driss; Megret, Patrice

2008-10-13

Using hydrogen as fuel presents a potential risk of explosion and requires low cost and efficient leak sensors. We present here a hybrid sensor configuration consisting of a long period fiber grating (LPFG) and a superimposed uniform fiber Bragg grating (FBG). Both gratings are covered with a sensitive layer made of WO(3) doped with Pt on which H(2) undergoes an exothermic reaction. The released heat increases the temperature around the gratings. In this configuration, the LPFG favors the exothermic reaction thanks to a light coupling to the sensitive layer while the FBG reflects the temperature change linked to the hydrogen concentration. Our sensor is very fast and suitable to detect low hydrogen concentrations in air whatever the relative humidity level and for temperatures down to -50 degrees C, which is without equivalent for other hydrogen optical sensors reported so far.

Dynamic High Pressure Study of Chemistry and Physics of Molecular Materials

Science.gov (United States)

Jezowski, Sebastian Ryszard

Both temperature and pressure control and influence the packing of molecules in crystalline phases. Our molecular simulations indicate that at ambient pressure, the cubic polymorph of tetracyanoethylene, TCNE, is the energetically stable form up to ˜ 160 K. The observed transition from the cubic to the monoclinic polymorph occurs however only at temperatures above ˜ 318 K due to the large transition barrier. The temperature-induced phase transition in TCNE studied with high-resolution IR spectroscopy is explained in terms of the increased vibrational entropy in the crystals of the monoclinic polymorph. Based upon the inverted design of the Merril-Bassett Diamond Anvil Cell, an improved, second generation dynamic Diamond Anvil Cell was developed. Based on the fluorescence of ruby crystals, we were able to demonstrate that the pressure variation range can be further increased at least up to 7 kbar and that the dynamic pressure compression of up to 1400 GPa/s can be achieved. A new class of mechanophoric system, bis-anthracene, BA, and its photoisomer, PI, is shown to respond reversibly to a mild, static pressure induced by a Diamond Anvil Cell as well as to shear deformation based on absorption spectroscopic measurements. The forward reaction occurs upon illumination with light while the back-reaction may be accelerated upon heating or mechanical stress, coupled to a rehybridization on four equivalent carbon atoms. It is an intriguing result as high pressure stabilizes the photodimerized species in related systems. Our molecular volume simulations ruled out significant differences in the volumes between bis-anthracene and its photoisomer. Kinetic absorption measurements at several different pressures reveal a negative volume of activation in the exothermic back-reaction at room temperature. Through a series of temperature-dependent kinetic measurements it is shown that the barrier of activation for the back-reaction is reduced by more than an order of magnitude at

Large-scale atomistic simulations of nanostructured materials based on divide-and-conquer density functional theory

Directory of Open Access Journals (Sweden)

Vashishta P.

2011-05-01

Full Text Available A linear-scaling algorithm based on a divide-and-conquer (DC scheme is designed to perform large-scale molecular-dynamics simulations, in which interatomic forces are computed quantum mechanically in the framework of the density functional theory (DFT. This scheme is applied to the thermite reaction at an Al/Fe2O3 interface. It is found that mass diffusion and reaction rate at the interface are enhanced by a concerted metal-oxygen flip mechanism. Preliminary simulations are carried out for an aluminum particle in water based on the conventional DFT, as a target system for large-scale DC-DFT simulations. A pair of Lewis acid and base sites on the aluminum surface preferentially catalyzes hydrogen production in a low activation-barrier mechanism found in the simulations

Computational modeling for hexcan failure under core distruptive accidental conditions

Energy Technology Data Exchange (ETDEWEB)

Sawada, T.; Ninokata, H.; Shimizu, A. [Tokyo Institute of Technology (Japan)

1995-09-01

This paper describes the development of computational modeling for hexcan wall failures under core disruptive accident conditions of fast breeder reactors. A series of out-of-pile experiments named SIMBATH has been analyzed by using the SIMMER-II code. The SIMBATH experiments were performed at KfK in Germany. The experiments used a thermite mixture to simulate fuel. The test geometry of SIMBATH ranged from single pin to 37-pin bundles. In this study, phenomena of hexcan wall failure found in a SIMBATH test were analyzed by SIMMER-II. Although the original model of SIMMER-II did not calculate any hexcan failure, several simple modifications made it possible to reproduce the hexcan wall melt-through observed in the experiment. In this paper the modifications and their significance are discussed for further modeling improvements.

Safety analysis of switching between reductive and oxidative conditions in a reaction coupling reverse flow reactor.

NARCIS (Netherlands)

van Sint Annaland, M.; Kuipers, J.A.M.; van Swaaij, Willibrordus Petrus Maria

2001-01-01

A new reverse flow reactor is developed where endothermic reactants (propane dehydrogenation) and exothermic reactants (fuel combustion) are fed sequentially to a monolithic catalyst, while periodically alternating the inlet and outlet positions. Upon switching from reductive to oxidative conditions

Solid State Thermochemical Decomposition of Neat 1,3,5,5-Tetranitrohexahydropyrimidine (DNNC) and Its DNNC-d6 Perdeuterio-Labeled Analogue (PREPRINT)

National Research Council Canada - National Science Library

Hendrickson, Scott A; Shackleford, Scott A

2005-01-01

...) at 142, 145, and 148 oC. Global rate constants and kinetic deuterium isotope effect (KDIE) data from the exothermic decomposition process suggest that homolytic C-H bond rupture, in one or both types of chemically non-equivalent methylene...

Thermal characterization of oil palm fiber and eucalyptus in torrefaction

International Nuclear Information System (INIS)

Chen, Wei-Hsin; Kuo, Po-Chih; Liu, Shih-Hsien; Wu, Wei

2014-01-01

Thermal behavior of biomass in torrefaction plays an important role in the operation of pretreatment. To understand the endothermic and/or exothermic characteristics of biomass in the course of torrefaction, an experimental system is conducted and two kinds of biomass (oil palm fiber and eucalyptus) are investigated. The results indicate that the thermal behavior is significantly influenced by the lignocellulosic composition in biomass and the torrefaction temperature. The thermal decomposition of hemicellulose is the dominant mechanism for oil palm fiber torrefied at 200 and 250 °C, whereas the thermal degradation of cellulose is crucial when the biomass is torrefied at 300 °C. Therefore, the heat of reaction of oil palm fiber increases with increasing torrefaction temperature. The torrefaction of eucalyptus is always endothermic, as a consequence of high cellulose contained in the biomass. It is less endothermic when the torrefaction temperature increases, presumably due to the char formation from cellulose thermal degradation and the exothermic lignin decomposition. As a whole, the values of the heat of reaction of the two samples are between −3.50 and 2.23 MJ/kg. The obtained results have provided a useful insight into the control of torrefaction operation and the design of torrefaction reactor. - Highlights: • Thermal behavior of oil palm fiber and eucalyptus in torrefaction is studied. • Thermal characteristic of biomass in torrefaction depends on lignocellulosic composition. • Heat of reaction of oil palm fiber increases with increasing torrefaction temperature. • Eucalyptus torrefaction is always endothermic because of high cellulose contained. • Torrefaction of eucalyptus is less endothermic when the torrefaction temperature increases

Design and control of integrated styrene aniline production plant

NARCIS (Netherlands)

Partenie, O.; Van der Last, V.; Sorin Bildea, C.; Altimari, P.

2009-01-01

This paper illustrates the operational difficulties arising from simultaneously performing exothermic and endothermic reactions, and demonstrates that a plant can be built and safely operated by integrating the design and plantwide control issues. The behaviour of reactor – separation – recycle

Removal of chromium ion from leather industrial wastes by activated ...

African Journals Online (AJOL)

293 – 323 K). The adsorption of Cr from industrial wastage was found to be exothermic. Thermodynamic parameters such as free energy (G°), enthalpy (H°) and entropy (S°) of adsorption was also calculated and interpreted from the slope and ...

Incorporation of fluorophosphate into zinc–aluminium–nitrate ...

Indian Academy of Sciences (India)

the final product, as well as their characterization by XRD,. IR spectroscopy, SEM, microanalysis and thermal analyses are presented. The localization of ..... third loss (16·5%), with a large exothermic signal at 510. ◦. C, may correspond to the ...

Technological aspects of the deactivation

International Nuclear Information System (INIS)

Ozhovan, M.

2004-01-01

Different decontamination techniques - manual cleaning; vibratory cleaning; water and steam jetting, machining, grinding and chipping; vacuum cleaning; chemical baths; circulation of cleaning solutions through plant systems; melting with slag separation; electropolishing; ultrasonic cleaning; exothermic (thermochemical) cleaning - and their application are presented

Acid-activated bentonite (Maghnite-H +) as a novel catalyst for the ...

Indian Academy of Sciences (India)

2018-03-23

Mar 23, 2018 ... The reaction was investigated in bulk, taking into account the effect of time, temperature ..... The thermogram presents a glass tran- sition, exothermic ... C; we assume that this is the ceiling temperature; this. Table 1. Effect of ...

Uranium sorption from aqueous solutions by activated biochar fibres investigated by FTIR spectroscopy and batch experiments

International Nuclear Information System (INIS)

Loukia Hadjittofi; Ioannis Pashalidis

2015-01-01

The efficiency of activated biochar fibres obtained from Opuntia ficus indica regarding the sorption of hexavalent uranium (U(VI)) from aqueous solutions has been investigated by batch experiments, as a function of various physicochemical parameters, and FTIR spectroscopy prior and after U(VI) sorption. The experimental results show that the activated biochar fibres possess extraordinary sorption capacity for U(VI) even in acidic solutions (q max = 210 g kg -1 ), which is attributed to the formation of inner-sphere complexes with the surface carboxylic moieties, available in high density on the lamellar structures of the bio-sorbent. The adsorption process is described by a two-step exothermic reaction. (author)

In situ transmission electron microscopy investigation of the interfacial reaction between Ni and Al during rapid heating in a nanocalorimeter

Energy Technology Data Exchange (ETDEWEB)

Grapes, Michael D., E-mail: mgrapes1@jhu.edu, E-mail: david.lavan@nist.gov, E-mail: weihs@jhu.edu [Department of Materials Science and Engineering, Johns Hopkins University, Baltimore, Maryland 21218 (United States); Material Measurement Laboratory, Materials Measurement Science Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899 (United States); LaGrange, Thomas; Reed, Bryan W.; Campbell, Geoffrey H. [Lawrence Livermore National Laboratory, Materials Science and Technology Division, Livermore, California 94550 (United States); Woll, Karsten [Department of Materials Science and Engineering, Johns Hopkins University, Baltimore, Maryland 21218 (United States); Institute of Applied Materials, Karlsruhe Institute of Technology, 76344 Eggenstein-Leopoldshafen (Germany); LaVan, David A., E-mail: mgrapes1@jhu.edu, E-mail: david.lavan@nist.gov, E-mail: weihs@jhu.edu [Material Measurement Laboratory, Materials Measurement Science Division, National Institute of Standards and Technology, Gaithersburg, Maryland 20899 (United States); Weihs, Timothy P., E-mail: mgrapes1@jhu.edu, E-mail: david.lavan@nist.gov, E-mail: weihs@jhu.edu [Department of Materials Science and Engineering, Johns Hopkins University, Baltimore, Maryland 21218 (United States)

2014-11-01

The Al/Ni formation reaction is highly exothermic and of both scientific and technological significance. In this report, we study the evolution of intermetallic phases in this reaction at a heating rate of 830 K/s. 100-nm-thick Al/Ni bilayers were deposited onto nanocalorimeter sensors that enable the measurement of temperature and heat flow during rapid heating. Time-resolved transmission electron diffraction patterns captured simultaneously with thermal measurements allow us to identify the intermetallic phases present and reconstruct the phase transformation sequence as a function of time and temperature. The results show a mostly unaltered phase transformation sequence compared to lower heating rates.

Neutron absorption spectroscopy for identification of light elements in actinides

Energy Technology Data Exchange (ETDEWEB)

Hau, I.D. [Lawrence Livermore National Laboratory, Advanced Detector Group, 7000 East Ave., L-270, Livermore, CA 94550 (United States) and Department of Nuclear Engineering, University of California Berkeley, Berkeley, CA 94720 (United States)]. E-mail: hau2@llnl.gov; Niedermayr, T.R. [Lawrence Livermore National Laboratory, Advanced Detector Group, 7000 East Ave., L-270, Livermore, CA 94550 (United States); Drury, O.B. [Lawrence Livermore National Laboratory, Advanced Detector Group, 7000 East Ave., L-270, Livermore, CA 94550 (United States); Burger, A. [Fisk University, 1000 17th Ave. North, Nashville, TN 37208 (United States); Bell, Z. [Oak Ridge National Laboratory, 1 Bethel Valley Road, Oak Ridge, TN 37831 (United States); Friedrich, S. [Lawrence Livermore National Laboratory, Advanced Detector Group, 7000 East Ave., L-270, Livermore, CA 94550 (United States)]. E-mail: friedrich1@llnl.gov

2006-04-15

We are developing cryogenic high-energy resolution fast-neutron spectrometers using superconducting transition-edge sensors (TES) for nuclear science and non-proliferation applications. Fast neutrons are absorbed in 94% enriched {sup 6}LiF single crystals with volumes of {approx}1 cm{sup 3} in an exothermic {sup 6}Li(n,{alpha}){sup 3}H capture reaction. The neutron energy is measured from the subsequent temperature rise with a Mo/Cu multilayer TES. Fast-neutron spectra from a {sup 252}Cf source show an energy resolution of 55 kev. Here, we discuss the instrument performance, with emphasis on the identification of light elements in actinide matrices.

Heating and cooling processes in disks*

Directory of Open Access Journals (Sweden)

Woitke Peter

2015-01-01

Full Text Available This chapter summarises current theoretical concepts and methods to determine the gas temperature structure in protoplanetary disks by balancing all relevant heating and cooling rates. The processes considered are non-LTE line heating/cooling based on the escape probability method, photo-ionisation heating and recombination cooling, free-free heating/cooling, dust thermal accommodation and high-energy heating processes such as X-ray and cosmic ray heating, dust photoelectric and PAH heating, a number of particular follow-up heating processes starting with the UV excitation of H2, and the release of binding energy in exothermal reactions. The resulting thermal structure of protoplanetary disks is described and discussed.

Differential-thermal analysis of irradiated lignite

International Nuclear Information System (INIS)

Chichek, F.; Eyubova, N.

2006-01-01

Full text: In this theme our purpose is to explain thermo-differential analysis of lignites irradiated. During experiment Caraman Ermenek (washed), Caraman Ermenek (crude), Nevshehir (crude), Slopi (crude), Trakya Harman (washed) lignite coals were used. Five of five kinds of coal samples with 3mm and 1gr of each sample were obtained. Then they were filled into the Tubes after having dried total 25 samples with 1 gr at 1000 degrees temperature for one hour. Air in the tubes was pumped out and closed. Coal samples in vacuum medium were irradiated by gamma rays of Co60 at 5.5 kGy, 19.2 kGy, 65.7 kGy, 169.6 kGy, 411.2 kGy doses to the normal conditions. Then differential thermal analysis was carried out both in original and the samples irradiated. Argon gas was used to make inert medium in the camera. T=200-8500 degrees temperature was selected. At the experiment done from 1000-1300 degrees temperatures too great endothermic reaction pick was begun to form by being observed thermal changings. At 3000-4200 degrees temperature exothermic reaction picks and at 7000 degrees parallel exothermic reaction picks were observed. Initial endothermic and exothermic reaction picks in five lignite samples were observed like a sharp curve. At the end coal irradiated samples were compared with original coal samples. At the result of experiment it was revealed that in comparison with original coal samples coal samples irradiated form exothermic and endothermic curves at very reaction pick and temperature intervals of these pick were large. Besides loss of weight was observed to begin at low temperatures in samples irradiated and especially momentary weight loss at some heats in the rang of known temperatures was observed in the coal Slopi contain in bitumen. Because of heat the weigh loss in the non irradiated samples forms parabolic curve and because of heat the weight loss in the samples irradiated forms stepped curves. It has shown that the coal irradiated can be easily departed by

Effect of rare-earth elements on nanophase evolution, crystallization ...

Indian Academy of Sciences (India)

scattered image of Al87Ni8La5 ingot, the phases are marked. Figure 2. XRD patterns of as-melt-spun Al–Ni–RE amorphous ribbons on the air-cooled side. temperature axis change with alloy composition. Two or three exothermic peaks.

Orifice microreactor for the production of an organic peroxide – non-reactive and reactive characterization

NARCIS (Netherlands)

Illg, T.; Hessel, V.; Löb, P.; Schouten, J.C.

2012-01-01

In this article, the transfer of a two-step, biphasic, and exothermic peroxide synthesis into a microreactor assisted process is discussed as well as the non-reactive and reactive characterization of the developed orifice microreactor. Residence time distribution measurements showed nearly ideal

Formation and characterization of solid-solution (V,W,Ti)CN composite powder

CSIR Research Space (South Africa)

Bolokang, Amogelang S

2017-04-01

Full Text Available We report on the synthesis of a mixture of vanadium (V), tungsten (W), titanium (Ti) and carbon (C) mixture using ball milling in argon atmosphere. Thermal analysis of the milled powder showed an exothermic reaction at approximately 700°C...

Disentangling dormancy and cold-hardiness in wine grape cultivars Cabernet Sauvignon and Chardonnay

Science.gov (United States)

Cold-hardiness of bud and cane tissue was monitored throughout para, endo and ecodormancy in field-grown vines using differential thermal analysis to generate lethal temperature exotherms (LTE). Deacclimation and re-acclimation rates were measured during ecodormancy to determine the depth of dorm...

The pH-sensitive structure of the C-terminal domain of voltage-gated proton channel and the thermodynamic characteristics of Zn{sup 2+} binding to this domain

Energy Technology Data Exchange (ETDEWEB)

Zhao, Qing; Li, Chuanyong; Li, Shu Jie, E-mail: shujieli@nankai.edu.cn

2015-01-02

Highlights: • The α-helical content of the C-terminus is decreased with a pH increase. • The thermostability of the C-terminus is decreased with a pH increase. • Zn{sup 2+} binds to His{sup 244} and His{sup 266} residues within the C-terminal domain. • The binding of Zn{sup 2+} to His{sup 244} residue is an endothermic heat reaction. • The binding of Zn{sup 2+} to His{sup 266} residue is an exothermic heat reaction. - Abstract: The voltage-gated proton channel Hv1 is strongly sensitive to Zn{sup 2+}. The H{sup +} conduction is decreased at a high concentration of Zn{sup 2+} and Hv1 channel closing is slowed by the internal application of Zn{sup 2+}. Although the recent studies demonstrated that Zn{sup 2+} interacts with the intracellular C-terminal domain, the binding sites and details of the interaction remain unknown. Here, we studied the pH-dependent structural stability of the intracellular C-terminal domain of human Hv1 and showed that Zn{sup 2+} binds to His{sup 244} and His{sup 266} residues. The thermodynamics signature of Zn{sup 2+} binding to the two sites was investigated by isothermal titration calorimetry. The binding of Zn{sup 2+} to His{sup 244} (mutant H266A) and His{sup 266} (mutant H244A) were an endothermic heat reaction and an exothermic heat reaction, respectively.

Using Amines and Alkanes as Thermal-Runaway Retardants for Lithium-Ion Battery

Science.gov (United States)

Shi, Yang

Thermal runaway imposes major challenges to large-scale lithium-ion batteries (LIBs). The working temperature of a LIB is usually around room temperature. However, upon mechanical abuse such as an impact or nail penetration, LIB cell components may fail and internal short circuits could be formed. As a result, a series of exothermic electrochemical reactions and decompositions would take place and the local temperature can rapidly increase. In this thesis, a few novel techniques are investigated to mitigate thermal runaway of LIBs. Mechanically triggered approach has been employed. Thermal-runaway retardant (TRR) is encapsulated in mechanically responsive packages made of materials inert to the battery environment, and upon external mechanical loadings the packages can be broken apart and release the TRR. This mechanism allows for the use of aggressive chemicals to suppress the short circuit discharge and reduce the subsequent exothermic phenomena, immediately after the battery is damaged even before temperature increase begins. The best TRR candidates are identified to be amines and alkanes. Among amines, secondary amines and tertiary amines perform better than primary amines. The reduction in electrolyte ionic conductivity and the displacement of electrolyte are the thermal-runaway-mitigation mechanisms of the secondary and the tertiary amines, respectively. Pentadecane is the best candidate among the alkanes under investigation, with the major working mechanism being electrolyte displacement. Impact tests on large pouch cells and high-energy battery chemistry were also performed; the results were quite encouraging.

Study on the oscillation dissolved behavior of oxysophocarpine in water

Energy Technology Data Exchange (ETDEWEB)

Li, Z.X., E-mail: mingtian8001@163.com [Department of Chemistry and Chemical Engineering, Baoji University of Arts and Science, Baoji, Shaanxi 721013 (China); Zhao, W.W.; Pu, X.H. [Department of Chemistry and Chemical Engineering, Baoji University of Arts and Science, Baoji, Shaanxi 721013 (China)

2012-06-10

Highlights: Black-Right-Pointing-Pointer The dissolution enthalpies of oxysophocarpine in water was measured using a RD496-2000 Calvet microcalorimeter. Black-Right-Pointing-Pointer The results show that the dissolution process possessed an endothermic and exothermic oscillation behavior. Black-Right-Pointing-Pointer A series of thermodynamics functions and half-life period were obtained from thermodynamic and kinetic calculations. - Abstract: In this paper, the enthalpies of dissolution of oxysophocarpine in water were measured using a RD496-2000 Calvet microcalorimeter at 298.15 K under atmospheric pressure, showing that the dissolution process was an endothermic and exothermic oscillation behavior. A series of thermodynamics functions and the half-life were obtained by thermodynamic and kinetic methods. The results show that this work not only provide a simple method for the determination of the half-life for a drug but also offer a theoretical reference for the clinical application of resveratrol.

Thermodynamic evidence for cluster ordering in Cu46Zr42Al7Y5 ribbons during glass transition

DEFF Research Database (Denmark)

Zheng, H.J.; Lv, Y.M.; Sun, Q.J.

2016-01-01

This work investigated the response of Cu46Zr42Al7Y5 glass ribbons to both dynamic and static heating using differential scanning calorimeter (DSC). The DSC curve manifests three exothermic responses to dynamic heating, among which the first and the third one are the signatures of the normal sub......-Tg (Tg, glass transition temperature) relaxation and the crystallization process, respectively. The second one is attributed to a partial overlap between the endothermic response to the glass transition and the exothermic response to the formation of ordered clusters. The cluster ordering, which begins...... at the final stage of glass transition, has been verified by the differences in the activation energy of the sub-Tg relaxation, the cluster ordering and primary crystallization for both the as-spun and annealed ribbons. The cluster ordering could be driven by the large difference between the Zr–Y mixing...

Thermochemistry of interaction between zirconium disulfate and sulfuric acid

International Nuclear Information System (INIS)

Dmitrieva, S.V.; Chekmarev, A.M.; Vorob'ev, A.F.

1988-01-01

Thermochemistry of Zr(SO 4 ) 2 x4H 2 O (1) interaction with water and sulfuric acid solutions of different concentrations is studied. It is established that the dependence of 1 solution enthalpy on acid concentration 1-bars of a complex polyextreme nature. It is noted that the increase in exothermic nature of dissolving during the increase of H 2 SO 4 concentration from 0.05 to 0.50 mol/l is explained by zirconium hydroxosulfate and fulfate complexes substitution for hydroxocomplexes. The endothermal nature of 1 interaction with concentrated (>3 mol/l) H 2 SO 4 solutions is conditioned by the formation of acidocomplexes. It is assumed that the abrupt growth of the exothermal nature of 1 interaction with sulfuric acid solutions with the concentration less than 0.05 mol/l with water is connected with colloid formation. 12 refs.; 2 figs

Thermodynamic study of (alkyl esters+{alpha},{omega}-alkyl dihalides) III. H{sub m}{sup E}andV{sub m}{sup E} for 20 binary mixtures {l_brace}xC{sub u-1}H{sub 2u-1}CO{sub 2}C{sub 4}H{sub 9}+(1-x){alpha},{omega}-ClCH{sub 2}(CH{sub 2}){sub v-2}CH{sub 2}Cl{r_brace}, where u=1 to 4, {alpha}=1 and v={omega}=2 to 6

Energy Technology Data Exchange (ETDEWEB)

Ortega, J. [Laboratorio de Termodinamica y Fisicoquimica de Fluidos, Parque Cientifico-Tecnologico, Campus Universitario Tafira, Universidad de Las Palmas de Gran Canaria, 35071-Las Palmas de Gran Canaria, Canary Islands (Spain)]. E-mail: jortega@dip.ulpgc.es; Marrero, E. [Laboratorio de Termodinamica y Fisicoquimica de Fluidos, Parque Cientifico-Tecnologico, Campus Universitario Tafira, Universidad de Las Palmas de Gran Canaria, 35071-Las Palmas de Gran Canaria, Canary Islands (Spain); Toledo, F.J. [Laboratorio de Termodinamica y Fisicoquimica de Fluidos, Parque Cientifico-Tecnologico, Campus Universitario Tafira, Universidad de Las Palmas de Gran Canaria, 35071-Las Palmas de Gran Canaria, Canary Islands (Spain)

2006-09-15

In this article, the experimental data of excess molar enthalpies H{sub m}{sup E} and excess molar volumes V{sub m}{sup E} are presented for a set of 20 binary mixtures comprised of the first four butyl alkanoates (methanoate to butanoate) and five {alpha},{omega}-dichloroalkanes (1,2-dichloroethane to 1,6-dichlorohexane), obtained at atmospheric pressure and at a temperature of 298.15K. The results indicate the existence of specific interactions between both kinds of compounds resulting in exothermic processes for most mixtures, except for those containing butyl methanoate which give rise to net endo/exothermic effects. The V{sub m}{sup E} are positive for mixtures of (butyl esters+1,2-dichloroethane or 1,3-dichloropropane) and negative for the remaining ones. The change in H{sub m}{sup E} with the dichloroethane chain length for a same ester is regular although the V{sub m}{sup E} presents an irregular variation. It can, therefore, be deuced from this that the mixing process involves both effects, exothermic/endothermic and expansion/contraction, simultaneously. The behaviour of the mixtures is interpreted on the basis of the results observed and attributed to different effects taking place among the molecules studied. To improve application of the UNIFAC model using the version of Dang and Tassios, average values were recalculated again for parameters of the ester/chloride interaction, distinguishing, during its application, the functional group of the acid part of the ester. In spite of this, the model does not adequately reproduce the systems' behaviour.

Glass transition and crystallization kinetics of a barium borosilicate glass by a non-isothermal method

International Nuclear Information System (INIS)

Lopes, Andreia A. S.; Soares, Roque S.; Lima, Maria M. A.; Monteiro, Regina C. C.

2014-01-01

The glass transition and crystallization kinetics of a glass with a molar composition 60BaO-30B 2 O 3 -10SiO 2 were investigated by differential scanning calorimetry (DSC) under non-isothermal conditions. DSC curves exhibited an endothermic peak associated with the glass transition and two partially overlapped exothermic peaks associated with the crystallization of the glass. The dependence of the glass transition temperature (T g ) and of the maximum crystallization temperature (T p ) on the heating rate was used to determine the activation energy associated with the glass transition (E g ), the activation energy for crystallization (E c ), and the Avrami exponent (n). X-ray diffraction (XRD) revealed that barium borate (β-BaB 2 O 4 ) was the first crystalline phase to be formed followed by the formation of barium silicate (Ba 5 Si 8 O 21 ). The variations of activation energy for crystallization and of Avrami exponent with the fraction of crystallization (χ) were also examined. When the crystallization fraction (χ) increased from 0.1 to 0.9, the value of local activation energy (E c (χ)) decreased from 554 to 458 kJ/mol for the first exothermic peak and from 1104 to 831 kJ/mol for the second exothermic peak. The value determined for the Avrami exponent was near 2 indicating a similar one-dimensional crystallization mechanism for both crystalline phases. This was confirmed by the morphological studies performed by scanning electron microscopy (SEM) on glass samples heat-treated at the first and at the second crystallization temperatures

Students’ conceptions and problem-solving ability on topic chemical thermodynamics

Energy Technology Data Exchange (ETDEWEB)

Diawati, Chansyanah, E-mail: chansyanahd@yahoo.com [Program Studi Pendidikan Kimia Jurusan PMIPA FKIP, Universitas Lampung, Jl. Prof. Dr. Soemantri Brodjonegoro No. 1 Gedung Meneng, Bandar Lampung35145 (Indonesia)

2016-02-08

The enthalpy concept and its change were introduced to describe the forms of internal energy transfer in chemical reactions. Likewise, the concepts of exothermic and endothermic reactions introduced as a consequence of heat transfer form. In the heat measurement process at constant pressure, work is often ignored. The exothermic or endothermic reactions, usually only based on the increase or decrease of the reaction temperature, without associated with the internal energy. Depictions of enthalpy and its change assumed closely related to students’ problem-solving ability. Therefore, the study to describe pre-service chemistry teacher student’s conceptions and problem-solving ability on topic chemical thermodynamics has been done. This research was a case study of chemical education course in Provinsi Lampung. The subjects of this study were 42 students who attend the chemical thermodynamics course. Questions about exothermic and endothermic reactions, enthalpy and its change, as well as internal energy and its change were given in the form of an essay exam questions. Answers related to conception qualitatively categorized, while problem solving answers were scored and assessed. The results showed that, in general, students were having problems in enthalpy and describe the changes in the form of heat and work. The highest value of problem solving ability obtained 26.67 from the maximum value of 100. The lowest value was 0, and the average value was 14.73. These results show that the problem-solving ability of pre-service chemistry teacher students was low. The results provide insight to researchers, and educators to develop learning or lab work on this concept.

Students’ conceptions and problem-solving ability on topic chemical thermodynamics

International Nuclear Information System (INIS)

Diawati, Chansyanah

2016-01-01

The enthalpy concept and its change were introduced to describe the forms of internal energy transfer in chemical reactions. Likewise, the concepts of exothermic and endothermic reactions introduced as a consequence of heat transfer form. In the heat measurement process at constant pressure, work is often ignored. The exothermic or endothermic reactions, usually only based on the increase or decrease of the reaction temperature, without associated with the internal energy. Depictions of enthalpy and its change assumed closely related to students’ problem-solving ability. Therefore, the study to describe pre-service chemistry teacher student’s conceptions and problem-solving ability on topic chemical thermodynamics has been done. This research was a case study of chemical education course in Provinsi Lampung. The subjects of this study were 42 students who attend the chemical thermodynamics course. Questions about exothermic and endothermic reactions, enthalpy and its change, as well as internal energy and its change were given in the form of an essay exam questions. Answers related to conception qualitatively categorized, while problem solving answers were scored and assessed. The results showed that, in general, students were having problems in enthalpy and describe the changes in the form of heat and work. The highest value of problem solving ability obtained 26.67 from the maximum value of 100. The lowest value was 0, and the average value was 14.73. These results show that the problem-solving ability of pre-service chemistry teacher students was low. The results provide insight to researchers, and educators to develop learning or lab work on this concept

Effect of high-order multicomponent on formation and properties of Zr-based bulk glassy alloys

Energy Technology Data Exchange (ETDEWEB)

Inoue, A., E-mail: ainouebmg@yahoo.co.jp [International Institute of Green Materials, Josai International University, Togane 283-8555 (Japan); School of Materials Science and Engineering, Tianjin University, Tianjin 300072 (China); Department of Physics, King Abdulaziz University, Jeddah 22254 (Saudi Arabia); Wang, Z.; Louzguine-Luzgin, D.V. [WPI Advanced Institute for Materials Research, Tohoku University, Sendai 980-8577 (Japan); Han, Y. [School of Materials Science and Engineering, Tianjin University, Tianjin 300072 (China); Kong, F.L. [International Institute of Green Materials, Josai International University, Togane 283-8555 (Japan); Shalaan, E.; Al-Marzouki, F. [Department of Physics, King Abdulaziz University, Jeddah 22254 (Saudi Arabia)

2015-07-25

Highlights: • A multicomponent Zr{sub 55}Al{sub 10}Fe{sub 6}Co{sub 6}Ni{sub 6}Cu{sub 6}Pd{sub 6}Ag{sub 5} bulk glassy alloy was formed. • The high-order multiplication suppression of the decrease in mechanical strength. • The BGAs show good corrosion resistance and slow growth rate of primary precipitates. - Abstract: We examined the formation, thermal stability, mechanical properties and corrosion behavior of a multicomponent Zr{sub 55}Al{sub 10}Fe{sub 6}Co{sub 6}Ni{sub 6}Cu{sub 6}Pd{sub 6}Ag{sub 5} bulk glassy alloy, with the aim of clarifying the effect of high-order multiplication of the number of components on their properties. The bulk glassy alloy rods of 2 and 6 mm in diameter were formed by suction casting even at the low total content of typical glass-forming 3-d late transition metals like Co, Ni and Cu. The Vickers hardness is different in the center region and in the outer surface region. The difference seems to reflect the relaxation level of glassy structure. The Young’s modulus and the compressive fracture strength are nearly the same for the base Zr{sub 55}Al{sub 10}Ni{sub 5}Cu{sub 30} alloy in spite of the existence of immiscible atomic pairs. Moreover, the multicomponent alloy exhibits better corrosion resistance than that for the base alloy. The glassy phase changes to a supercooled liquid state at 720 K and then starts to crystallize at 754 K with a single exothermic peak, in contrast to the appearance of a wide supercooled liquid region for the base alloy. The primary crystalline phase precipitates with very short incubation time and very low growth rate, which are different from those for the base alloy. The extremely low growth rate of the crystallites is presumably due to the reduction of diffusivity of late transition metal elements resulting from multiplication. Thus, the high-order multiplication has the features of (1) the maintenance of high glass-forming ability even at the lower Co, Ni and Cu content and in the absence of

Solid-solid phase change thermal storage application to space-suit battery pack

Science.gov (United States)

Son, Chang H.; Morehouse, Jeffrey H.

1989-01-01

High cell temperatures are seen as the primary safety problem in the Li-BCX space battery. The exothermic heat from the chemical reactions could raise the temperature of the lithium electrode above the melting temperature. Also, high temperature causes the cell efficiency to decrease. Solid-solid phase-change materials were used as a thermal storage medium to lower this battery cell temperature by utilizing their phase-change (latent heat storage) characteristics. Solid-solid phase-change materials focused on in this study are neopentyl glycol and pentaglycerine. Because of their favorable phase-change characteristics, these materials appear appropriate for space-suit battery pack use. The results of testing various materials are reported as thermophysical property values, and the space-suit battery operating temperature is discussed in terms of these property results.

Principal processes in the radiolysis of gases with fission recoils and gamma rays. Annual progress report, October 16, 1979-September 15, 1980

International Nuclear Information System (INIS)

Meisels, G.G.

1980-10-01

High resolution mass spectrometry and threshold photoelectron-coincident photoion mass spectrometry of propane-2- 13 C showed that skeletal isomerization in propane ions precedes the fragmentation of that ion to ethylene ion and methane. Methylnitrite ion was exceptional in its fragmentaion near threshold; the products NO + and CH 3 O + are not competitive. Electron range and energy loss for 50 to 500 eV electrons were measured for the rare gases and nitrogen. Isomerization of nitromethane ion to methylnitrite ion appears to be controlled by electronic state correlation. While highly exothermic even at threshold for parent ion formation of nitromethane, dissociation and presumably isomerization to methylnitrite ion occur only from the upper, 2A'' state of nitromethane ion, which correlates approximately with the 2A'' state of methylnitrite ion

Out-of-pile experiments on the high-temperature behavior of Zircaloy-4 clad fuel rods

International Nuclear Information System (INIS)

Hagen, S.

1984-01-01

Out-of-pile experiments have been performed to investigate the escalation in temperature of Zircaloy-clad fuel rods during heatup in steam due to the exothermal Zircaloy steam reaction. In these tests single Zircaloy/uranium dioxide (UO 2 ) fuel rod simulators surrounded with a Zircaloy shroud--simulating the Zircaloy of neighboring rods--were heated inside a fiber ceramic insulation. The initial heating rates were varied from 0.3 to 2.5 K/s. In every test an escalation of the temperature rise rate was observed. The maximum measured surface temperature was about 2200 0 C. The temperature decreased after the maximum had been reached without decreasing the input electric power. The temperature decreases were due to inherent processes including the runoff of molten Zircaloy. The escalation process was influenced by the temperature behavior of the shroud, which was itself affected by the insulation and steam cooling. Damage to the fuel rods increased with increasing heatup rate. Fro slow heatup rates nearly no interaction between the oxidized cladding and UO 2 was observed, while for fast heatup rates the entire annular pellet was dissolved by molten Zircaloy

40 CFR 63.133 - Process wastewater provisions-wastewater tanks.

Science.gov (United States)

2010-07-01

... Chemical Manufacturing Industry for Process Vents, Storage Vessels, Transfer Operations, and Wastewater... exothermic reaction or the contents of the tank is sparged, the owner or operator shall comply with the... barometric pressure, or (B) An engineering evaluation that the Administrator determines is an accurate method...

Subsite binding energies of an exo-polygalacturonase using isothermal titration calorimetry

Science.gov (United States)

Thermodynamic parameters for binding of a series of galacturonic acid oligomers to an exo-polygalacturonase, RPG16 from Rhizopus oryzae, were determined by isothermal titration calorimetry. Binding of oligomers varying in chain length from two to five galacturonic acid residues is an exothermic proc...

Synthesis of ferrite grade γ-Fe2O3

Indian Academy of Sciences (India)

Unknown

carboxylates in air yield α-Fe2O3, but the controlled atmosphere of moisture requires for the oxalates to stabi- ... structure form, α-Fe2O3, is made to react with the cubic divalent metal .... water of crystallization show multistep exothermic peaks.

Pyro-synthesis of a high rate nano-Li3V2(PO4)3/C cathode with mixed morphology for advanced Li-ion batteries.

Science.gov (United States)

Kang, Jungwon; Mathew, Vinod; Gim, Jihyeon; Kim, Sungjin; Song, Jinju; Im, Won Bin; Han, Junhee; Lee, Jeong Yong; Kim, Jaekook

2014-02-10

A monoclinic Li3V2(PO4)3/C (LVP/C) cathode for lithium battery applications was synthesized by a polyol-assisted pyro-synthesis. The polyol in the present synthesis acts not only as a solvent, reducing agent and a carbon source but also as a low-cost fuel that facilitates a combustion process combined with the release of ultrahigh exothermic energy useful for nucleation process. Subsequent annealing of the amorphous particles at 800°C for 5 h is sufficient to produce highly crystalline LVP/C nanoparticles. A combined analysis of X-ray diffraction (XRD) and neutron powder diffraction (NPD) patterns was used to determine the unit cell parameters of the prepared LVP/C. Electron microscopic studies revealed rod-type particles of length ranging from nanometer to micrometers dispersed among spherical particles with average particle-sizes in the range of 20-30 nm. When tested for Li-insertion properties in the potential windows of 3-4.3 and 3-4.8 V, the LVP/C cathode demonstrated initial discharge capacities of 131 and 196 mAh/g (~100% theoretical capacities) at 0.15 and 0.1 C current densities respectively with impressive capacity retentions for 50 cycles. Interestingly, the LVP/C cathode delivered average specific capacities of 125 and 90 mAh/g at current densities of 9.6 C and 15 C respectively within the lower potential window.

Hierarchically porous micro-rod lithium-rich cathode material Li1.2Ni0.13Mn0.54Co0.13O2 for high performance lithium-ion batteries

International Nuclear Information System (INIS)

Zhang, Linjing; Borong, Wu.; Ning, Li.; Feng, Wu.

2014-01-01

Graphical abstract: - Highlights: • The hierarchically porous micro-rod Li 1.2 Ni 0.13 Mn 0.54 Co 0.13 O 2 material is prepared by a facile hydrothermal method. • This material exhibits good cycling performance. • It delivers discharge capacities of 280.7, 254.8, 232.3, 225.6, 201.7 and 172.7 mAh g −1 at 0.1 C, 0.2 C, 0.5 C, 1 C, 2 C and 5 C rates, respectively. • Excellent rate capability and cycleability are obtained attributed to the hierarchically porous micro-rod structure. - Abstract: Lithium-rich cathode material Li 1.2 Ni 0.13 Mn 0.54 Co 0.13 O 2 with hierarchically porous micro-rod structures has been synthesized using a facile hydrothermal method. The morphology and XRD patterns explain the formation mechanism of the sample. Micro-rod oxalates precursor with rough surface is formed during the hydrothermal reaction, and then the product with hierarchically porous structures constructed of nanoparticles is synthesized during the sintering process at high temperatures. The electrochemical performance results show that the as-prepared sample exhibits high capacities, good cycleability and outstanding rate capability. It delivers discharge capacities of 280.7, 254.8, 232.3, 225.6, 201.7 and 172.7 mAh g −1 at 0.1 C, 0.2 C, 0.5 C, 1 C, 2 C and 5 C rates, respectively. The cycle voltammograms indicate the good reversibility of the as-prepared Li 1.2 Ni 0.13 Mn 0.54 Co 0.13 O 2 material. The high onset temperature of the exothermal peak in the differential scanning calorimetry curve implies its good thermal stability. The good performance of the as-prepared material is endowed by its hierarchically porous structures

Hyperquenched hyaloclastites from Axial Seamount

Science.gov (United States)

Zezin, D.; Helo, C.; Richard, D.; Clague, D. A.; Dingwell, D. B.; Stix, J.

2009-12-01

We determined apparent cooling rates for basaltic hyaloclastites from Axial caldera, Juan de Fuca Ridge. Samples originate from different stratigraphic layers within the unconsolidated volcaniclastic sequences, on flanks of the volcanic edifice. Water depth is ~1400 m below sea level. The hyaloclastite glass fragments comprise two principal morphologies: (1) angular fragments, and (2) thin glassy melt films interpreted as bubble walls, called deep-sea limu o Pele. A natural cooling rate was estimated for each sample of ~50 carefully selected glass shards. The heat capacity was first measured with a differential scanning calorimeter in two heating scans with heating rates of 20 K/min, and a matching cooling rate between those scans. The fictive temperatures Tf were then determined from both heating cycles, and the natural cooling rate derived by the non-Arrhenian relationship between Tf and cooling rate. All samples display hyperquenched states, manifested in a strong exothermic energy release during the initial heating cycle before reaching the glass transition. Cooling rates range from 10 6.73 K/s to 10 3.94 K/s for the limu, and 10 4.92 K/s to 10 2.34 K/s for the angular fragments. Almost all samples of limu shards show elevated cooling rates compared to their angular counterparts of comparable grain mass. In addition, the exothermic part of the enthalpy curves reveal two superimposed relaxation domains, the main broad exothermal peak, ranging from ~350 K to the onset of the glass transition, and a small subordinate peak/shoulder occurring between 550 K and 700 K. The magnitude of the latter varies from clearly identifiable to nearly absent, and tends to be more pronounced in curves obtained from angular fragments. The main exothermal peak is related to the frozen-in structure of the glass and consequently to its thermal history when passing through the glass transition. The subordinate peak may represent strain rate-induced and tensile stress accumulation

Investigation of alpha experiment by severe accident analysis code SAMPSON

International Nuclear Information System (INIS)

Baglietto, Emilio; Ninokata, Hisashi; Naitoh, Masanori

2006-01-01

The severe accident analysis code SAMPSON is adopted in this work to evaluate its capability of reproducing the complex gap cooling phenomenon. The ALPHA experiment is adopted for validation, where molten aluminum oxide (Al 2 O 3 ) produced by a thermite reaction is poured into a water filled hemispherical vessel at the ambient pressure of approximately 1.3 MPa. The spreading and cooling of the debris that has relocated into the pressure vessel lower plenum are simulated, including the analysis of the RPV failure. The model included in the core to mimic the water penetration inside the gap is evaluated and improvements are proposed. The importance of the introduction of some mechanistic approach to describe the gap formation and evolution is underlined, where the results show its necessity in order to correctly reproduce the experimental trends. (author)

A low-temperature partial-oxidation-methanol micro reformer with high fuel conversion rate and hydrogen production yield

International Nuclear Information System (INIS)

Wang, Hsueh-Sheng; Huang, Kuo-Yang; Huang, Yuh-Jeen; Su, Yu-Chuan; Tseng, Fan-Gang

2015-01-01

Highlights: • A low-operating temperature of the POM-mode micro methanol reformer is obtained. • The effect of channel design on the performance is studied. • The effect of solid content and binder’ ratio on the performance is studied. • The centrifugal process is benefit for the modification of performance. • 98% of methanol conversion rate of the micro reformer can be obtained at 180 °C. - Abstract: A partial oxidation methanol micro reformer (POM-μReformer) with finger-shaped channels for low operating temperature and high conversing efficiency is proposed in this study. The micro reformer employs POM reaction for low temperature operation (less than 200 °C), exothermic reaction, and quick start-up, as well as air feeding capability; and the finger type reaction chambers for increasing catalyst loading as well as reaction area for performance enhancement. In this study, centrifugal technique was introduced to assist on the catalyst loading with high amount and uniform distribution. The solid content (S), binder’s ratio (B), and channel design (the ratio between channel’s length and width, R) were investigated in detail to optimize the design parameters. Scanning electron microscopy (SEM), gas chromatography (GC), and inductively coupled plasma-mass spectrometer (ICP-MS) were employed to analyze the performance of the POM-μReformer. The result depicted that the catalyst content and reactive area could be much improved at the optimized condition, and the conversion rate and hydrogen selectivity approached 97.9% and 97.4%, respectively, at a very low operating temperature of 180 °C with scarce or no binder in catalyst. The POM-μReformer can supply hydrogen to fuel cells by generating 2.23 J/min for 80% H 2 utilization and 60% fuel cell efficiency at 2 ml/min of supplied reactant gas, including methanol, oxygen and argon at a mixing ratio of 12.2%, 6.1% and 81.7%, respectively

Thermal ignition in a reactive variable viscosity Poiseuille flow ...

African Journals Online (AJOL)

In this paper, we investigate the thermal ignition in a strongly exothermic reaction of a variable viscosity combustible material flowing through a channel with isothermal walls under Arrhenius kinetics, neglecting the consumption of the material. Analytical solutions are constructed for the governing nonlinear boundary-value ...

Crystallization and melting behavior of multi-walled carbon nanotube-reinforced nylon-6 composites

NARCIS (Netherlands)

Phang, In Yee; Ma, Jianhua; Shen, Lu; Liu, Tianxi; Zhang, Wei-De

2006-01-01

The crystallization and melting behavior of neat nylon-6 (PA6) and multi-walled carbon nanotubes (MWNTs)/PA6 composites prepared by simple melt-compounding was comparatively studied. Differential scanning calorimetry (DSC) results show two crystallization exotherms (TCC, 1 and TCC, 2) for PA6/MWNTs

Analytical methods for lignin characterization - Differential scanning calorimetry

NARCIS (Netherlands)

Koullas, D.P.; Koukios, E.G.; Avgerinos, E.; Abaecherli, A.; Gosselink, R.; Vasile, C.; Lehnen, R.; Saake, B.; Suren, J.

2006-01-01

Results of a round robin on lignin thermal analyses are reported. Six laboratories have conducted thermal analyses of four lignin types to determine their cp values and softening points, and to study the thermal behaviour, materials endo- and exotherms included. The lignin types examined were wood

Changes in the Nutrient Composition of Brewery Spent Grain ...

African Journals Online (AJOL)

BSN

animal feed production. Feed costs are ... industry. Agro-industrial by-products are in abundance in Nigeria (Iyayi, 2004). One of such ... a significant part of costs for the breweries. Today .... exothermic reactions mediated by microbial enzymes. This increase in temperature was ... digestibility, carcass traits and economic.

Fabrication of high-uranium-loaded U{sub 3}O{sub 8}-Al developmental fuel plates

Energy Technology Data Exchange (ETDEWEB)

Copeland, G L; Martin, M M [Oak Ridge National Laboratory, TN (United States)

1983-08-01

cores up to 1.52 mm 60 mils) thick. We successfully formed a radius of curvature of 84 mm 3.3 in.) in 75 wt % plates with core thicknesses up to 0.89 mm 35 mils). This is a sharper radius than is required for most research reactor elements. Void contents of the high-uranium-loaded plates agree well with earlier data and should serve to accommodate fission products. Thermal conductivity measurements indicate that operating temperatures for the cores will be within acceptable limits. Measurements of the energy releases from the thermite reaction show that the higher levels Of U{sub 3}0{sub 8} do not add a significant chemical reaction hazard to the other considerations of safe reactor operation. Thus, assuming satisfactory performance in irradiation tests to the required burnup, we anticipate being able to increase the uranium loading in U{sub 3}0{sub 8}-Al dispersions to the 3.1 Mg U/m{sup 3} level. (author)

Enhanced electronic and magnetic properties by functionalization of monolayer GaS via substitutional doping and adsorption

Science.gov (United States)

Rahman, Altaf Ur; Rahman, Gul; Kratzer, Peter

2018-05-01

The structural, electronic, and magnetic properties of two-dimensional (2D) GaS are investigated using density functional theory (DFT). After confirming that the pristine 2D GaS is a non-magnetic, indirect band gap semiconductor, we consider N and F as substitutional dopants or adsorbed atoms. Except for N substituting for Ga (NGa), all considered cases are found to possess a magnetic moment. Fluorine, both in its atomic and molecular form, undergoes a highly exothermic reaction with GaS. Its site preference (FS or FGa) as substitutional dopant depends on Ga-rich or S-rich conditions. Both for FGa and F adsorption at the Ga site, a strong F–Ga bond is formed, resulting in broken bonds within the GaS monolayer. As a result, FGa induces p-type conductivity in GaS, whereas FS induces a dispersive, partly occupied impurity band about 0.5 e below the conduction band edge of GaS. Substitutional doping with N at both the S and the Ga site is exothermic when using N atoms, whereas only the more favourable site under the prevailing conditions can be accessed by the less reactive N2 molecules. While NGa induces a deep level occupied by one electron at 0.5 eV above the valence band, non-magnetic NS impurities in sufficiently high concentrations modify the band structure such that a direct transition between N-induced states becomes possible. This effect can be exploited to render monolayer GaS a direct-band gap semiconductor for optoelectronic applications. Moreover, functionalization by N or F adsorption on GaS leads to in-gap states with characteristic transition energies that can be used to tune light absorption and emission. These results suggest that GaS is a good candidate for design and construction of 2D optoelectronic and spintronics devices.

Thermodynamics and binding mechanism of polyphenon-60 with human lysozyme elucidated by calorimetric and spectroscopic techniques

International Nuclear Information System (INIS)

Yasmeen, Shama; Riyazuddeen

2017-01-01

Highlights: • Thermodynamics of the binding of Lys with polypenone-60 were studied. • The binding was found to be exothermic. • Polyphenon-60 quenches the fluorescence of Lys through static quenching. • Polyphenon-60 binds to Lys through hydrogen binding. • Conformational changes of Lys were studied using circular dichorism. - Abstract: Protein-drug interaction offer information of the structural features that determine the therapeutic effectiveness of drug and have become an attractive research field in life science, chemistry, and clinical medicine. Interaction of pharmacologically important antioxidant drug polyphenon-60 with human lysozyme (Lys) at physiological pH 7.4 has been studied by using calorimetric and various spectroscopic techniques. UV–visible spectroscopy results indicate the complex formation between Lys and polyphenon-60. The binding constant, quenching mechanism and the number of binding sites were determined by the fluorescence quenching spectra of Lys in presence of polyphenon-60. Fluorescence data indicate that the polyphenon-60 interact with Lys through static quenching mechanism with binding affinity of 2.9 × 10 4 M −1 . The average binding distance between drug and Lys was found to be 2.89 nm on the basis of the theory of Förster's energy transfer. Isothermal titration calorimetry (ITC) data reveals the thermodynamic investigations which suggest that the interaction of Lys and polyphenon-60 through exothermic process and enthalpy driven and also explore that the polyphenon-60 binds in both sites of Lys with high and low affinity. Hydrogen bonding (high affinity) and hydrophobic interactions (low affinity) are the major forces in stabilizing the drug protein complex. Far-UV CD and FTIR results deciphere the conformational alterations in the secondary structure of Lys.

Dehydration and crystallization kinetics of zirconia-yttria gels

International Nuclear Information System (INIS)

Ramanathan, S.; Muraleedharan, R.V.; Roy, S.K.; Nayar, P.K.K.

1995-01-01

Zirconia and zirconia-yttria gels containing 4 and 8 mol% yttria were obtained by coprecipitation and drying at 373 K. The dehydration and crystallization behavior of the dried gels was studied by DSC, TG, and XRD. The gels undergo elimination of water over a wide temperature range of 373--673 K. The peak temperature of the endotherm corresponding to dehydration and the kinetic constants for the process were not influenced by the yttria content of the gel. The enthalpy of dehydration observed was in good agreement with the heat of vaporization data. The dehydration was followed by a sharp exothermic crystallization process. The peak temperature of the exotherm and the activation energy of the process increased with an increase in yttria content, while the enthalpy of crystallization showed a decrease. The ''glow effect'' reduced with increasing yttria content. Pure zirconia crystallizes in the tetragonal form while the zirconia containing 4 and 8 mol% yttria appears to crystallize in the cubic form

Fiber-Reinforced Epoxy Composites and Methods of Making Same Without the Use of Oven or Autoclave

Science.gov (United States)

Barnell, Thomas J. (Inventor); Rauscher, Michael D. (Inventor); Stienecker, Rick D. (Inventor); Nickerson, David M. (Inventor); Tong, Tat H. (Inventor)

2016-01-01

Method embodiments for producing a fiber-reinforced epoxy composite comprise providing a mold defining a shape for a composite, applying a fiber reinforcement over the mold, covering the mold and fiber reinforcement thereon in a vacuum enclosure, performing a vacuum on the vacuum enclosure to produce a pressure gradient, insulating at least a portion of the vacuum enclosure with thermal insulation, infusing the fiber reinforcement with a reactive mixture of uncured epoxy resin and curing agent under vacuum conditions, wherein the reactive mixture of uncured epoxy resin and curing agent generates exothermic heat, and producing the fiber-reinforced epoxy composite having a glass transition temperature of at least about 100.degree. C. by curing the fiber reinforcement infused with the reactive mixture of uncured epoxy resin and curing agent by utilizing the exothermically generated heat, wherein the curing is conducted inside the thermally insulated vacuum enclosure without utilization of an external heat source or an external radiation source.

Origin of nondetectable x-ray diffraction peaks in nanocomposite CuTiZr alloys

DEFF Research Database (Denmark)

Jiang, Jianzhong; Kato, H.; Ohsuna, T.

2003-01-01

Microscopic structures of Cu60Ti10+xZr30-x (x=0 and 10) alloys have been investigated by transmission electron microscopy, x-ray diffraction (XRD) and differential scanning calorimeter (DSC). In the Cu60Ti10Zr30 samples annealed at 708 K for times ranging from 0 to 130 min, where the enthalpy...... of the first exothermic peak decreases by 80%, the corresponding XRD patterns still look similar to that for the as-prepared sample. However, the simulated XRD patterns for the pure Cu51Zr14 phase, which is the crystalline phase formed during the first exothermic reaction, with small grain sizes and defects...... clearly show a broadened amorphous-like feature. This might be the reason that no diffraction peaks from the nanocrystalline component were detected in the XRD patterns recorded for the as-cast or as-spun Cu60Ti10+xZr30-x (x=0 and 10) alloys and for the alloys annealed at lower temperatures, in which...

Biothermal sensing of a torsional artificial muscle.

Science.gov (United States)

Lee, Sung-Ho; Kim, Tae Hyeob; Lima, Márcio D; Baughman, Ray H; Kim, Seon Jeong

2016-02-14

Biomolecule responsive materials have been studied intensively for use in biomedical applications as smart systems because of their unique property of responding to specific biomolecules under mild conditions. However, these materials have some challenging drawbacks that limit further practical application, including their speed of response and mechanical properties, because most are based on hydrogels. Here, we present a fast, mechanically robust biscrolled twist-spun carbon nanotube yarn as a torsional artificial muscle through entrapping an enzyme linked to a thermally sensitive hydrogel, poly(N-isopropylacrylamide), utilizing the exothermic catalytic reaction of the enzyme. The induced rotation reached an equilibrated angle in less than 2 min under mild temperature conditions (25-37 °C) while maintaining the mechanical properties originating from the carbon nanotubes. This biothermal sensing of a torsional artificial muscle offers a versatile platform for the recognition of various types of biomolecules by replacing the enzyme, because an exothermic reaction is a general property accompanying a biochemical transformation.

Microstructure evolution in the rapidly quenched Fe{sub 78}Si{sub 9}B{sub 13} ribbons

Energy Technology Data Exchange (ETDEWEB)

Wang, W.-M., E-mail: weiminw@sdu.edu.c [Key Lab of Liquid Structure and Heredity of Materials, Shandong University, Jinan 250061 (China); Key Laboratory of Metastable Materials Science and Technology, Yanshan University, Qinhuangdao 066004 (China); Jin, S.F. [Key Lab of Liquid Structure and Heredity of Materials, Shandong University, Jinan 250061 (China); Institute of Physics, Chinese Academy of Sciences, Beijing 100080 (China); Zhang, J.T.; Huang, T.; Wang, L.; Bian, X.F. [Key Lab of Liquid Structure and Heredity of Materials, Shandong University, Jinan 250061 (China)

2009-11-01

We report microstructure evolution in as-spun Fe{sub 78}Si{sub 9}B{sub 13} ribbons under various wheel speeds (s), which was investigated by X-ray diffraction (XRD), differential scanning calorimetry (DSC), and transmission electron microscopy (TEM). With decreasing s, the volume fraction of the residual amorphous phase (V{sub a}) in the as-spun ribbons decreases gradually, and the total exothermic heat of the crystallization in the DSC curves also decreases, but the ratio of the exothermic heat of the second crystallization to the first one is on the contrary. alpha-Fe is found in the ribbon with s of 32.9 m/s, while alpha-Fe, eutectic alpha-Fe+Fe{sub 2}B, and Fe{sub 3}Si phases are found in ribbons with s of 25.6 and 18.3 m/s. The phase precipitating behavior in cooling processes is well consistent with the annealing process in the literatures.

Analysis Of The Reactivity Of Radpro Solution With Cotton Rags

International Nuclear Information System (INIS)

Marusich, R.M.

2009-01-01

Rags containing RadPro(reg s ign) solution will be generated during the decontamination of the Plutonium Finishing Plant (PFP). Under normal conditions, the rags will be neutralized with sodium carbonate prior to placing in the drums. The concern with RadPro solutions and cotton rags is that some of the RadPro solutions contain nitric acid. Under the right conditions, nitric acid and cotton rags exothermically react. The concern is, will RadPro solutions react with cotton rags exothermically? The potential for a runaway reaction for any of the RadPro solutions used was studied in Section 5.2 of PNNL-15410, Thermal Stability Studies of Candidate Decontamination Agents for Hanford's Plutonium Finishing Plant Plutonium-Contaminated Gloveboxes. This report shows the thermal behavior of cotton rags having been saturated in one of the various neutralized and non-neutralized RadPro solutions. The thermal analysis was performed using thermogravimetric Analysis (TGA), Differential Thermal Analysis (DTA) and Accelerating Rate Calorimetry (ARC).

Molecular structure of virgin and Tg cycled (Ag2Se)x (AsSe)1-x bulk glasses

Science.gov (United States)

Wachtman, Jacob; Chen, Ping; Boochand, P.

2009-03-01

AsSe, the base glass (x = 0) in the titled ternary, is an interesting example of a chalcogenide that is partially de-mixed into As4Se4 molecules segregated from a connected AsSe network, with the latter determining glass network properties. Raman scattering reveals sharp modes of the Realgar molecules that are superimposed on broad modes coming from of the backbone. Upon Tg cycling virgin samples (as quenched melts), the concentration of de-mixed As4Se4 molecules decreases, suggesting that thermally induced polymerization occurs; molecules break up to form part of the connective tissue. Modulated DSC experiments reveal a broad exotherm near 140 ^oC in virgin samples, which becomes nearly extinct in Tg cycled samples. The exotherm may represent Realgar molecules nano-crystallizing as the temperature approaches Tg. Compositional trends in thermal parameters such as Tg(x), δCp(x), and the δHnr(x) as a function of Ag2Se content `x' of the glasses will be reported.

Thermal degradation of ligno-cellulosic fuels. DSC and TGA studies

Energy Technology Data Exchange (ETDEWEB)

Leroy, V.; Cancellieri, D.; Leoni, E. [SPE-CNRS UMR 6134, University of Corsica, Campus Grossetti, BP 52, 20250 Corti (France)

2006-12-01

The scope of this work was to show the utility of thermal analysis and calorimetric experiments to study the thermal oxidative degradation of Mediterranean scrubs. We investigated the thermal degradation of four species; DSC and TGA were used under air sweeping to record oxidative reactions in dynamic conditions. Heat released and mass loss are important data to be measured for wildland fires modelling purpose and fire hazard studies on ligno-cellulosic fuels. Around 638 and 778K, two dominating and overlapped exothermic peaks were recorded in DSC and individualized using a experimental and numerical separation. This stage allowed obtaining the enthalpy variation of each exothermic phenomenon. As an application, we propose to classify the fuels according to the heat released and the rate constant of each reaction. TGA experiments showed under air two successive mass loss around 638 and 778K. Both techniques are useful in order to measure ignitability, combustibility and sustainability of forest fuels. (author)

Pyrophoric potential of plutonium-containing salt residues

International Nuclear Information System (INIS)

Haschke, John M.; Fauske, Hans K.; Phillips, Alan G.

2000-01-01

Ignition temperatures of plutonium and the pyrophoric potential of plutonium-containing pyrochemical salt residues are determined from differential thermal analysis (DTA) data and by modeling of thermal behavior. Exotherms observed at 90-200 deg. C for about 30% of the residues are attributed to reaction of plutonium with water from decomposition of hydrated salts. Exotherms observed near 300 deg. C are consistent with ignition of metal particles embedded in the salt. Onset of self-sustained reaction at temperatures as low as 90 deg. C is not precluded by these results and heat-balance models are developed and applied in predicting the static ignition point of massive metal and in evaluating salt pyrophoricity. Results show that ambient temperatures in excess of 200 deg. C are required for ignition of salt residues and that the most reactive salts cannot ignite at low temperatures because diffusion of oxidant to embedded metal is limited by low salt porosity

Mechanistic aspects of polymer chemistry for radiation curing

International Nuclear Information System (INIS)

Dickson, Lawrence W.

1988-01-01

The chemistry of polymer production has been reviewed for the purpose of identifying suitable uses for high-energy electron accelerators in the plastics industry. High-energy radiation produces free radicals, electrons and ions in irradiated materials. These species initiate polymerization and cross-linking reactions in a manner analogous to that of chemical agents. The chemical mechanisms of radiation-induced polymerization, co-polymerization and cross-linking are compared with those of chemical and thermal initiation. Radiation polymerization can be a very fast process, but the polymerization reactions are quite exothermic, and temperature increases of up to 400 degrees Celcius may result if insufficient cooling is provided. Several approaches to reducing the temperature increase during radiation curing are presented. Chemical kinetic simulations of the radiation-induced cationic polymerization of styrene have shown that the effect of water inhibition on the rate of polymerization may be eliminated at the high dose rates available from high power accelerators. 25 refs

Down Select Report of Chemical Hydrogen Storage Materials, Catalysts, and Spent Fuel Regeneration Processes

Energy Technology Data Exchange (ETDEWEB)

Ott, Kevin; Linehan, Sue; Lipiecki, Frank; Aardahl, Christopher L.

2008-08-24

The DOE Hydrogen Storage Program is focused on identifying and developing viable hydrogen storage systems for onboard vehicular applications. The program funds exploratory research directed at identifying new materials and concepts for storage of hydrogen having high gravimetric and volumetric capacities that have the potential to meet long term technical targets for onboard storage. Approaches currently being examined are reversible metal hydride storage materials, reversible hydrogen sorption systems, and chemical hydrogen storage systems. The latter approach concerns materials that release hydrogen in endothermic or exothermic chemical bond-breaking processes. To regenerate the spent fuels arising from hydrogen release from such materials, chemical processes must be employed. These chemical regeneration processes are envisioned to occur offboard the vehicle.

Thermal stability of Dion-Jacobson mixed-metal-niobate double-layered perovskites

International Nuclear Information System (INIS)

Hermann, Andrew T.; Wiley, John B.

2009-01-01

The thermal stability and decomposition pathways of six Dion-Jacobson-related double-layered perovskites, ALaNb 2 O 7 (A = H, Li, Na, Ag) and (ACl)LaNb 2 O 7 (A = Fe, Cu), are investigated. These compounds are made by low temperature ( 2 O 7 . All the compounds are low temperature phases with some of them exhibiting decomposition exotherms consistent with metastability. Decomposition temperatures and reactions pathways vary with the identity of A with most decompositions resulting in the formation of a niobate (containing A) and LaNbO 4 . Results from differential scanning calorimetry and high temperature X-ray powder diffraction studies are presented and structural parameters pertinent to compound stability discussed

Mapping three-dimensional temperature in microfluidic chip.

KAUST Repository

Wu, Jinbo

2013-11-25

Three-dimensional (3D) temperature mapping method with high spatial resolution and acquisition rate is of vital importance in evaluating thermal processes in micro-environment. We have synthesized a new temperature-sensitive functional material (Rhodamine B functionalized Polydimethylsiloxane). By performing optical sectioning of this material, we established an advanced method for visualizing the micro-scale 3D thermal distribution inside microfluidic chip with down to 10 ms temporal resolution and 2 ~ 6 °C temperature resolution depending the capture parameters. This method is successfully applied to monitor the local temperature variation throughout micro-droplet heat transfer process and further reveal exothermic nanoliter droplet reactions to be unique and milder than bench-top experiment.

REDUCTION OF NO FORMATION BY THERMAL EFFECT OF A TURBULNENT DIFFUSION FLAME H2/AIR MODELED BY THE CONCEPT OF LAMINAR FLAMELET

Directory of Open Access Journals (Sweden)

HADEF AMAR

2016-03-01

Full Text Available Highly exothermic reactions are responsible for the formation of harmful polluting chemical species to humans and the biosphere. In this context, nitrogen oxides (NOx are pollutants that are the subject of special attention on the part of regulators. In this work we studied the impact of a co-flow swirl on the internal structure of a turbulent diffusion flame H2-N2/Air and its role in reducing the formation of NO, which is modeled by the concept of laminar flamelet, while the flow field is modeled by the standard model k-ε, with a correction term for round jets.The results show good agreement with data from the experimental data.

40 CFR 63.161 - Definitions.

Science.gov (United States)

2010-07-01

... process; and/or transformed by chemical reaction into materials that are not organic hazardous air... good engineering judgement and standards, such as ANSI B31-3. In food/medical service means that a... meet written specifications, (2) An exothermic reaction which is a safety hazard, (3) The intended...

Chilled water optimization at Beek INEOS PVC Plant : ammonia cycle

NARCIS (Netherlands)

Karami Alaghinloo, B.

2012-01-01

In BEEK INEOS PVC plant, polymerization takes place in a suspension process in twenty reactors in five lines. As the reaction is exothermic, a 17MW chilled water unit (CWU) removing heat from reactors which are producing different grades in batch processes. The objective of the project was to

Glass forming ability of amorphous drugs investigated by continuous cooling- and isothermal transformation

DEFF Research Database (Denmark)

Blaabjerg, Lasse Ingerslev; Lindenberg, Eleanor; Löbmann, Korbinian

2016-01-01

/min). Thus, the glass forming ability can be predicted by the use of TTT diagrams. In contrast to TTT diagrams, CCT diagrams may not be suitable for small organic molecules due to poor separation of exothermic events, which makes it difficult to determine the zone of recrystallization. In conclusion...

A New Road to Reaction, Part 3. Teaching the Heat Effect of Reaction.

Science.gov (United States)

de Vos, Wobbe; Verdonk, Adri H.

1986-01-01

Addresses the need to present beginning chemistry students with a variety of experiences dealing with chemical reactions to develop the individual student's concept of these processes. Presents information and experiments dealing with the heat effect of chemical reactions. Includes a discussion on exothermic and endothermic processes in laboratory…

Effects of rest time after Li plating on safety behavior—ARC tests with commercial high-energy 18650 Li-ion cells

International Nuclear Information System (INIS)

Waldmann, Thomas; Wohlfahrt-Mehrens, Margret

2017-01-01

During charging at low temperatures, metallic Lithium can be deposited on the surface of graphite anodes of Li-ion cells. This Li plating does not only lead to fast capacity fade, it can also impair the safety behavior. The present study observes the effect of rest periods between Li plating and subsequent accelerated rate calorimetry (ARC) tests. As an example, commercial 3.25 Ah 18650-type cells with graphite anodes and NCA cathodes are cycled at 0 °C to provoke Li plating. It is found that the rest period at 25 °C between Li plating and the ARC tests has a significant influence on the onset temperature of exothermic reactions (T SH ), the onset temperature of thermal runaway (T TR ), the maximum temperature, the self-heating rate, and on damage patterns of 18650 cells. The results are discussed in terms of chemical intercalation of Li plating into adjacent graphite particles during the rest period. The exponential increase of capacity recovery and T SH as a function of time suggests a reaction of 1st order for the relaxation process.

Activation barriers for series of exothermic homologous reactions. V. Boron group diatomic species reactions

Science.gov (United States)

Blue, Alan S.; Belyung, David P.; Fontijn, Arthur

1997-09-01

Semiempirical configuration interaction (SECI) theory is used to predict activation barriers E, as defined by k(T)=ATn exp(-E/RT). Previously SECI has been applied to homologous series of oxidation reactions of s1, s2, and s2p1 metal atoms. Here it is extended to oxidation reactions of diatomic molecules containing one s2p1 atom. E values are calculated for the reactions of BH, BF, BCl, AlF, AlCl, AlBr, GaF, GaI, InCl, InBr, InI, TlF, TlCl, TlBr, and TlI with O2, CO2, SO2, or N2O. These values correlate with the sums of the ionization potentials and Σ-Π promotion energies of the former minus the electron affinities of the latter. In the earlier work n was chosen somewhat arbitrarily, which affected the absolute values of E. Here it is shown that examination of available experimental and theoretical results allows determination of the best values of n. Using this approach yields n=1.9 for the present series. For the seven reactions which have been studied experimentally, the average deviation of the SECI activation barrier prediction from experiment is 4.0 kJ mol-1. Energy barriers are calculated for another 52 reactions.

Theoretical studies of mechanisms of cycloaddition reaction between difluoromethylene carbene and acetone

Science.gov (United States)

Lu, Xiu Hui; Yu, Hai Bin; Wu, Wei Rong; Xu, Yue Hua

Mechanisms of the cycloaddition reaction between singlet difluoromethylene carbene and acetone have been investigated with the second-order Møller-Plesset (MP2)/6-31G* method, including geometry optimization and vibrational analysis. Energies for the involved stationary points on the potential energy surface (PES) are corrected by zero-point energy (ZPE) and CCSD(T)/6-31G* single-point calculations. From the PES obtained with the CCSD(T)//MP2/6-31G* method for the cycloaddition reaction between singlet difluoromethylene carbene and acetone, it can be predicted that path B of reactions 2 and 3 should be two competitive leading channels of the cycloaddition reaction between difluoromethylene carbene and acetone. The former consists of two steps: (i) the two reactants first form a four-membered ring intermediate, INT2, which is a barrier-free exothermic reaction of 97.8 kJ/mol; (ii) the intermediate INT2 isomerizes to a four-membered product P2b via a transition state TS2b with an energy barrier of 24.9 kJ/mol, which results from the methyl group transfer. The latter proceeds in three steps: (i) the two reactants first form an intermediate, INT1c, through a barrier-free exothermic reaction of 199.4 kJ/mol; (ii) the intermediate INT1c further reacts with acetone to form a polycyclic intermediate, INT3, which is also a barrier-free exothermic reaction of 27.4 kJ/mol; and (iii) INT3 isomerizes to a polycyclic product P3 via a transition state TS3 with an energy barrier of 25.8 kJ/mol.

Thermogravimetric study of the reaction of uranium oxides with fluorine

International Nuclear Information System (INIS)

Komura, Motohiro; Sato, Nobuaki; Kirishima, Akira; Tochiyama, Osamu

2008-01-01

Thermogravimetric study of the reaction of uranium oxides with fluorine was conducted by TG-DTA method using anti-corrosion type differential thermobalance. When UO 2 was heated from R.T. to 500 deg. C in 5% F 2 /He atmosphere, the weight increase appeared at ca. 250 deg. C with an exothermic peak. Then the weight decreased slightly with a small exothermic peak followed by the complete volatilization with a large exothermic peak at ca. 350 deg. C. At a flow rate of 15, 30, 60 ml min -1 , there seemed to be no significant change for the fluorination of UO 2 . With the different heating rates of 1, 2, 5 and 10 deg. C min -1 , the fluorination peak shifted to higher temperature with increasing heating rates. For the comparison with thermogravimetric results, phase analysis by XRD method was conducted for the products obtained at different temperatures. At 260 deg. C, the product was UO 2 with a small amount of the intermediate compound, UO 2 F. The amount of this compound increased with increasing temperature up to 320 deg. C. Then another phase of UO 2 F 2 appeared at 340 deg. C but it was immediately fluorinated to the volatile fluoride. When U 3 O 8 was used as a starting material, it was found that the steep weight decrease peak appeared at ca. 350 deg. C and the uranium volatilized completely. This result suggests that fluorination of U 3 O 8 occurs at this temperature forming UF 6 . Uranium trioxide showed the similar fluorination behavior to that of U 3 O 8

Reports on 1977 result of Sunshine Project. R and D on high calorie gas manufacturing technology (molten salt/lime slurry bath gasification method); 1977 nendo kokarori gas seizo gijutsu no kenkyu kaihatsu seika hokokusho. Yoyuen sekkai slurry yo gas ka hoshiki

Energy Technology Data Exchange (ETDEWEB)

NONE

1978-03-31

The following results were obtained by fundamental studies on molten salt/lime slurry bath gasification method. A comparison between a gasification process in a literature and the subject process shows the characteristics as follows. It is necessary to withdraw a high temperature molten salt slurry from under pressurization to atmospheric pressure and to separate only the ash content from other components; however, a large burden of this operation is a problem. In addition, CaO reacts with a part of the ash, making complete recovery of CaO difficult. From these two reasons, the subject gasification process has disadvantage, compared with the fluidized-bed process, against coal that contains much ash content. The gasification process, however, has the following advantage. It can reduce oxygen usage. It is unaffected by the grain size and caking of coal. The reaction rate of CaO in carbonation is several times greater in molten salt than in a fluidized bed. The heat of reaction of CaO for carbonation is an exothermic reaction and can supply several tens of percentages of the heat of reaction in coal gasification. The desulfurization effect of CaO is great. Molten salt has a catalytic effect, making particularly the reaction rate of methanization several times greater. (NEDO)

Production of Excess CO2 relative to methane in peatlands: a new H2 sink

Science.gov (United States)

Wilson, R.; Woodcroft, B. J.; Varner, R. K.; Tyson, G. W.; Tfaily, M. M.; Sebestyen, S.; Saleska, S. R.; Rogers, K.; Rich, V. I.; McFarlane, K. J.; Kostka, J. E.; Kolka, R. K.; Keller, J.; Iversen, C. M.; Hodgkins, S. B.; Hanson, P. J.; Guilderson, T. P.; Griffiths, N.; de La Cruz, F.; Crill, P. M.; Chanton, J.; Bridgham, S. D.; Barlaz, M.

2015-12-01

Methane is generated as the end product of anaerobic organic matter degradation following a series of reaction pathways including fermentation and syntrophy. Along with acetate and CO2, syntrophic reactions generate H2 and are only thermodynamically feasible when coupled to an exothermic reaction that consumes H2. The usual model of organic matter degradation in peatlands has assumed that methanogenesis is that exothermic H2-consuming reaction. If correct, this paradigm should ultimately result in equimolar production of CO2 and methane from the degradation of the model organic compound cellulose: i.e. C6H12O6 à 3CO2 + 3CH4. However, dissolved gas measurement and modeling results from field and incubation experiments spanning peatlands across the northern hemisphere have failed to demonstrate equimolar production of CO2 and methane. Instead, in a flagrant violation of thermodynamics, these studies show a large bias favoring CO2 production over methane generation. In this talk, we will use an array of complementary analytical techniques including FT-IR, cellulose and lignin measurements, 13C-NMR, fluorescence spectroscopy, and ultra-high resolution mass spectrometry to describe organic matter degradation within a peat column and identify the important degradation mechanisms. Hydrogenation was the most common transformation observed in the ultra-high resolution mass spectrometry data. From these results we propose a new mechanism for consuming H2 generated during CO2 production, without concomitant methane formation, consistent with observed high CO2/CH4 ratios. While homoacetogenesis is a known sink for H2 in these systems, this process also consumes CO2 and therefore does not explain the excess CO2 measured in field and incubation samples. Not only does the newly proposed mechanism consume H2 without generating methane, but it also yields enough energy to balance the coupled syntrophic reactions, thereby restoring thermodynamic order. Schematic of organic matter

The role of deep acceptor centers in the oxidation of acceptor-doped wide-band-gap perovskites ABO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Putilov, L.P., E-mail: lev.putilov@gmail.com; Tsidilkovski, V.I.

2017-03-15

The impact of deep acceptor centers on defect thermodynamics and oxidation of wide-band-gap acceptor-doped perovskites without mixed-valence cations is studied. These deep centers are formed by the acceptor-bound small hole polarons whose stabilization energy can be high enough (significantly higher than the hole-acceptor Coulomb interaction energy). It is shown that the oxidation enthalpy ΔH{sub ox} of oxide is determined by the energy ε{sub A} of acceptor-bound states along with the formation energy E{sub V} of oxygen vacancies. The oxidation reaction is demonstrated to be either endothermic or exothermic, and the regions of ε{sub A} and E{sub V} values corresponding to the positive or negative ΔH{sub ox} are determined. The contribution of acceptor-bound holes to the defect thermodynamics strongly depends on the acceptor states depth ε{sub A}: it becomes negligible at ε{sub A} less than a certain value (at which the acceptor levels are still deep). With increasing ε{sub A}, the concentration of acceptor-bound small hole polarons can reach the values comparable to the dopant content. The results are illustrated with the acceptor-doped BaZrO{sub 3} as an example. It is shown that the experimental data on the bulk hole conductivity of barium zirconate can be described both in the band transport model and in the model of hopping small polarons localized on oxygen ions away from the acceptor centers. Depending on the ε{sub A} magnitude, the oxidation reaction can be either endothermic or exothermic for both mobility mechanisms.

Solution Calorimetry Experiments for Physical Chemistry.

Science.gov (United States)

Raizen, Deborah A.; And Others

1988-01-01

Presents two experiments: the first one measures the heat of an exothermic reaction by the reduction of permanganate by the ferris ion; the second one measures the heat of an endothermic process, the mixing of ethanol and cyclohexane. Lists tables to aid in the use of the solution calorimeter. (MVL)

Reaction mechanism of O-acylhydroxamate with cysteine proteases

Indian Academy of Sciences (India)

WINTEC

more stable than the reactant and hence the reaction enthalpy is found to be exothermic. ... healing, fertilization, cell differentiation and growth, ... to lower the side effects of drug administration. Since ... tozoa and plants. ... give turnover products or could produce a stable ad- ...... be due to the hydrolysis with water molecule.

Chemical Kinetics, Heat Transfer, and Sensor Dynamics Revisited in a Simple Experiment

Science.gov (United States)

Sad, Maria E.; Sad, Mario R.; Castro, Alberto A.; Garetto, Teresita F.

2008-01-01

A simple experiment about thermal effects in chemical reactors is described, which can be used to illustrate chemical reactor models, the determination and validation of their parameters, and some simple principles of heat transfer and sensor dynamics. It is based in the exothermic reaction between aqueous solutions of sodium thiosulfate and…

Use of infrared thermography for the evaluation of heat losses during coal storage

NARCIS (Netherlands)

Fierro, V.; Miranda, J.L.; Romero, C.; Andrés, J.M.; Pierrot, A.; Gómez-Landesa, E.; Arriaga, A.; Schmal, D.

1999-01-01

The exothermic processes during coal storage reduce the calorific value of the coal which in turn results in financial losses. An accurate and easy calculation of the losses may be an efficient tool to evaluate the effectiveness of the measures taken to reduce the spontaneous heating of coal and to

Dependence of hotspot initiation on void distribution in high explosive crystals simulated with molecular dynamics

Science.gov (United States)

Herring, Stuart Davis

Microscopic defects may dramatically affect the susceptibility of high explosives to shock initiation. Such defects redirect the shock's energy and become hotspots (concentrations of stress and heat) that can initiate chemical reactions. Sufficiently large or numerous defects may produce a self-sustaining deflagration or even detonation from a shock notably too weak to detonate defect-free samples. The effects of circular or spherical voids on the shock sensitivity of a model (two- or three-dimensional) high explosive crystal are considered. We simulate a piston impact using molecular dynamics with a Reactive Empirical Bond Order (REBO) model potential for a sub-micron, sub-ns exothermic reaction in a diatomic molecular solid. In both dimensionalities, the probability of initiating chemical reactions rises more suddenly with increasing piston velocity for larger voids that collapse more deterministically. A void of even 10 nm radius (˜39 interatomic spacings) reduces the minimum initiating velocity by a factor of 4 (8 in 3D). The transition at larger velocities to detonation is studied in micron-long samples with a single void (and its periodic images). Reactions during the shock traversal increase rapidly with velocity, then become a reliable detonation. In 2D, a void of radius 2.5 nm reduces the critical velocity by 10% from the perfect crystal; a Pop plot of the detonation delays at higher velocities shows a characteristic pressure dependence. 3D samples are more likely to react but less to detonate. In square lattices of voids, reducing the (common) void radius or increasing the porosity without changing the other parameter causes the hotspots to consume the material faster and detonation to occur sooner and at lower velocities. Early behavior is seen to follow a very simple ignition and growth model; the pressure exponents are more realistic than with single voids. The hotspots collectively develop a broad pressure wave (a sonic, diffuse deflagration front

Flame Synthesis of Composite Oxides for Catalytic Applications

DEFF Research Database (Denmark)

Jensen, Joakim Reimer

2002-01-01

gas (CO/CO2/H2) and an excellent thermal stability. Addition of alumina as a structural promoter is necessary in order to obtain a high activity for methanol formation. The binary systems, i.e., CuO/ZnO, ZnO/Al2O3 and CuO/Al2O3 are investigated as a prelude to the preparation of the ternary catalyst...... the flame temperature, the high temperature residence time and the precursor concentration. The Cu/ZnO/Al2O3 methanol catalyst is used as a model system for the preparation of catalytic materials. The flame synthesized catalyst exhibits a high and reproducible activity for methanol formation from synthesis...... crystallites is oxidized. A number of complications may arise using the N2O-titration. It may be difficult to obtain full oxidation of the copper surface without having some oxidation of the bulk. Secondly, some sintering of the nano-sized copper crystallites may occur due to the exothermic nature...

A combined high-temperature experimental and theoretical kinetic study of the reaction of dimethyl carbonate with OH radicals

KAUST Repository

Khaled, Fathi; Giri, Binod; Szőri, Milá n; Mai, Tam V.-T.; Huynh, Lam K.; Farooq, Aamir

2017-01-01

The reaction kinetics of dimethyl carbonate (DMC) and OH radicals were investigated behind reflected shock waves over the temperature range of 872-1295 K and at pressures near 1.5 atm. Reaction progress was monitored by detecting OH radicals at 306.69 nm using a UV laser absorption technique. The rate coefficients for the reaction of DMC with OH radicals were extracted using a detailed kinetic model developed by Glaude et al. (Proc. Combust. Inst. 2005, 30(1), 1111-1118). The experimental rate coefficients can be expressed in Arrhenius form as: kexpt'l = 5.15 × 10(13) exp(-2710.2/T) cm(3) mol(-1) s(-1). To explore the detailed chemistry of the DMC + OH reaction system, theoretical kinetic analyses were performed using high-level ab initio and master equation/Rice-Ramsperger-Kassel-Marcus (ME/RRKM) calculations. Geometry optimization and frequency calculations were carried out at the second-order Møller-Plesset (MP2) perturbation level of theory using Dunning's augmented correlation consistent-polarized valence double-ζ basis set (aug-cc-pVDZ). The energy was extrapolated to the complete basis set using single point calculations performed at the CCSD(T)/cc-pVXZ (where X = D, T) level of theory. For comparison purposes, additional ab initio calculations were also carried out using composite methods such as CBS-QB3, CBS-APNO, G3 and G4. Our calculations revealed that the H-abstraction reaction of DMC by OH radicals proceeds via an addition elimination mechanism in an overall exothermic process, eventually forming dimethyl carbonate radicals and H2O. Theoretical rate coefficients were found to be in excellent agreement with those determined experimentally. Rate coefficients for the DMC + OH reaction were combined with literature rate coefficients of four straight chain methyl ester + OH reactions to extract site-specific rates of H-abstraction from methyl esters by OH radicals.

Environmentally-safe process control and state diagnostic in chemical plants by neuronal network. Subproject 2. Final report; Umweltgerechte Prozessfuehrung und Zustandserkennung in Chemieanlagen mit neuronalen Netzen. Teilvorhaben 2: Konzipierung und Erprobung des Zustandserkennungsverfahrens. Schlussbericht

Energy Technology Data Exchange (ETDEWEB)

Hessel, G.; Heidrich, J.; Hilpert, R.; Roth, M. [Degussa AG (Germany); Kryk, H.; Schmitt, W.; Seiler, T.; Weiss, F.P.

2002-12-01

In the frame of the sub-project, an on-line monitoring system for strongly exothermic reactions was developed to support the operational personnel in the optimal and environmentally compatible process control of complex or safety-difficult reactions in semibatch-mode in stirred tank reactors (batch reactor). The Monitoring System (MoSys) based on dimensionless mass and heat balances with adaptive functions has first to be trained using process data from normal and undesired courses of batches carried out in a miniplant under conditions of the industrial process. The adaptation of balance models to the target plant is done by two-layer perceptron networks. To ensure a complete scale-up, MoSys should be adapted and validated using process data of at least one normal batch course in the chemical plant. MoSys was designed for both a homogeneous exothermic esterification reaction and a heterogeneous exothermic hydrogenation process. Experimental tests were carried out in a pilot plant (esterification) and in an industrial plant (hydrogenation). For industrial testing, MoSys was integrated into a Batch-Information-Management System (BIMS) which was also developed and implemented in the Process Control System (PCS) of a multi-purpose reactor installation in the fine chemical factory at Radebeul (Degussa Inc.). As a result, the MoSys outputs can simultaneously be visualised with important process signals on the terminals of PCS. For example, the progress of hydrogenation, the predictive end of reaction and the concentration profiles of the educt, intermediate and product are displayed on the terminals of operator stations. Furthermore, when undesired operating states occur, the operational personnel is early alarmed and recommendation are given for countermeasures that are allowed to be only done by the operator. The efficiency of BIMS/MoSys could be proven during two industrial hydrogenation campaigns. (orig.)

Self-heating of dried industrial wastewater sludge: lab-scale investigation of supporting conditions.

Science.gov (United States)

Della Zassa, M; Biasin, A; Zerlottin, M; Refosco, D; Canu, P

2013-06-01

We studied the reactivity of dried sludge produced by treatment of wastewater, mainly from tanneries. The solids transformations have been first characterized with thermal analysis (TGA and DSC) proving that exothermic transformation takes place at fairly low temperature, before the total organic combustion that occurs in air above 400°C. The onset of low temperature reactions depends on the heating rate and it can be below 100°C at very small heating rate. Then, we reproducibly determined the conditions to trigger dried sludge self-heating at the laboratory scale, on samples in the 0.2-0.3 kg size. Thermal insulation, some aeration and addition of water are key factors. Mastering the self-heating at this scale allows more detailed investigations as well as manipulation of conditions, to understand its nature, course and remediation. Here we report proves and discussions on the role of air, water, particle size, porosity and biological activity, as well as proving that also dried sludge from similar sources lead to self-heating. Tests demonstrate that air and water are simultaneously required for significant self-heating to occur. They act in diverging directions, both triggering the onset of the reactions and damping the temperature rise, by supporting heat loss. The higher the O2 concentration, the higher the solids heating rate. More added water prolongs the exothermic phase. Further additions of water can reactivate the material. Water emphasizes the exothermic processes, but it is not sufficient to start it in an air-free atmosphere. The initial solid moisture concentration (between 8% and 15%) affects the onset of self-heating as intuitive. The sludge particles size strongly determines the strength and extent of the heat release, indicating that surface reactions are taking place. In pelletized particles, limitations to water and air permeability mitigates the reaction course. Copyright © 2013 Elsevier Ltd. All rights reserved.

Studies on natural circulation cooling enhancement in a spent fuel in fast breeder reactors

Energy Technology Data Exchange (ETDEWEB)

Maekawa, Isamu; Akamatsu, Mikio; Toda, Shinichi; Sato, Manabu [Kawasaki Heavy Industries Ltd., Kobe (Japan); Mayumi, Masami

2001-01-01

Fast breeder reactor (FBR) has some advantages such as effective application of plutonium, excellent capacity to fire minor-actinides (longer half-life nuclides such as Np, Am, Cm, and so on) contained in radioactive wastes in the reactor to convert their shorter half-life nuclides. However, fuels containing the minor-actinides have a characteristic with higher exotherm and radioactive intensity than those of conventional ones, it is essential at their actual stages to prepare some rational fuel handling systems on their transportation, storage and so forth. In addition, there are few examples on natural circulation heat transfer test of a liquid metal using long sized container. Then, in order to establish an evaluating method on decay-heat removing property of a spent fuel assembly in sodium canister and pot, some natural circulation tests on a long sized container including a quasi pin-bundle structure for a working fluid of lead-bismuth (Pb-Bi) mixture with easier handling than that of sodium was carried out. A specimen could be mounted at optional angles from horizontal to vertical positions so as to evaluate effects of inclined angles. In addition, in order to estimate temperature and flow rate distribution in a long sized container and understand thermal flowing phenomenon in specimen system, numerical analysis using multi-dimensional analysis code was carried out. As a result, it was found that in vertical arrangement system, natural circulation phenomenon is limited at upper portion of the exothermal portion, and its maximum temperature was tested at central portion of top pin-bundle of the exothermal portion. And, it was also found that at horizontal arrangement maximum temperature was 40 centigrade less than that of vertical arrangement, and so forth. (G.K.)

Thermal stability and mechanism of decomposition of emulsion explosives in the presence of pyrite

International Nuclear Information System (INIS)

Xu, Zhi-Xiang; Wang, Qian; Fu, Xiao-Qi

2015-01-01

Highlights: • An exothermic reaction occurs at about 200 °C between pyrite and ammonium nitrate (emulsion explosives). • The essence of reaction between emulsion explosives and pyrite is reaction between ammonium nitrate and pyrite. • The excellent thermal stability of emulsion explosives does not mean it was also showed when pyrite was added. • A new overall reaction has been proposed as: • 14FeS_2(s) + 91NH_4NO_3(s) → 52NO(g) + 26SO_2(g) + 6Fe_2O_3(s) + 78NH_3(g) + 26N_2O(g) + 2FeSO_4(s) + 65H_2O(g). - Abstract: The reaction of emulsion explosives (ammonium nitrate) with pyrite was studied using techniques of TG-DTG-DTA. TG–DSC–MS was also used to analyze samples thermal decomposition process. When a mixture of pyrite and emulsion explosives was heated at a constant heating rate of 10 K/min from room temperature to 350 °C, exothermic reactions occurred at about 200 °C. The essence of reaction between emulsion explosives and pyrite is the reaction between ammonium nitrate and pyrite. Emulsion explosives have excellent thermal stability but it does not mean it showed the same excellent thermal stability when pyrite was added. Package emulsion explosives were more suitable to use in pyrite shale than bulk emulsion explosives. The exothermic reaction was considered to take place between ammonium nitrate and pyrite where NO, NO_2, NH_3, SO_2 and N_2O gases were produced. Based on the analysis of the gaseous, a new overall reaction was proposed, which was thermodynamically favorable. The results have significant implication in the understanding of stability of emulsion explosives in reactive mining grounds containing pyrite minerals.

Thermal stability and mechanism of decomposition of emulsion explosives in the presence of pyrite

Energy Technology Data Exchange (ETDEWEB)

Xu, Zhi-Xiang; Wang, Qian [School of Energy and Power Engineering, Jiangsu University, Zhenjiang 212013 (China); Fu, Xiao-Qi, E-mail: xzx19820708@163.com [School of Chemistry and Chemical Engineering, Jiangsu University Zhenjiang 212013 (China)

2015-12-30

Highlights: • An exothermic reaction occurs at about 200 °C between pyrite and ammonium nitrate (emulsion explosives). • The essence of reaction between emulsion explosives and pyrite is reaction between ammonium nitrate and pyrite. • The excellent thermal stability of emulsion explosives does not mean it was also showed when pyrite was added. • A new overall reaction has been proposed as: • 14FeS{sub 2}(s) + 91NH{sub 4}NO{sub 3}(s) → 52NO(g) + 26SO{sub 2}(g) + 6Fe{sub 2}O{sub 3}(s) + 78NH{sub 3}(g) + 26N{sub 2}O(g) + 2FeSO{sub 4}(s) + 65H{sub 2}O(g). - Abstract: The reaction of emulsion explosives (ammonium nitrate) with pyrite was studied using techniques of TG-DTG-DTA. TG–DSC–MS was also used to analyze samples thermal decomposition process. When a mixture of pyrite and emulsion explosives was heated at a constant heating rate of 10 K/min from room temperature to 350 °C, exothermic reactions occurred at about 200 °C. The essence of reaction between emulsion explosives and pyrite is the reaction between ammonium nitrate and pyrite. Emulsion explosives have excellent thermal stability but it does not mean it showed the same excellent thermal stability when pyrite was added. Package emulsion explosives were more suitable to use in pyrite shale than bulk emulsion explosives. The exothermic reaction was considered to take place between ammonium nitrate and pyrite where NO, NO{sub 2}, NH{sub 3}, SO{sub 2} and N{sub 2}O gases were produced. Based on the analysis of the gaseous, a new overall reaction was proposed, which was thermodynamically favorable. The results have significant implication in the understanding of stability of emulsion explosives in reactive mining grounds containing pyrite minerals.

Studies on adsorption behaviour of Cr(VI) onto synthetic hydrous ...

African Journals Online (AJOL)

Results indicate the following order to fit the isotherms equations: Redlich- ... The results are compared, and indicated that the best fit is obtained with the Lagergren or pseudo first-order and the power-function models. ... the exothermic nature of the adsorption process and the other is the ion-ion type ... HOW TO USE AJOL.

Preparation of highly ordered cubic NaA zeolite from halloysite mineral for adsorption of ammonium ions

International Nuclear Information System (INIS)

Zhao Yafei; Zhang Bing; Zhang Xiang; Wang Jinhua; Liu Jindun; Chen Rongfeng

2010-01-01

Well-ordered cubic NaA zeolite was first synthesized using natural halloysite mineral with nanotubular structure as source material by hydro-thermal method. SEM and HRTEM images indicate that the synthesized NaA zeolite is cubic-shaped crystal with planar surface, well-defined edges and symmetrical and uniform pore channels. The adsorption behavior of ammonium ions (NH 4 + ) from aqueous solution onto NaA zeolite was investigated as a function of parameters such as equilibrium time, pH, initial NH 4 + concentration, temperature and competitive cations. The Langmuir and Freundlich adsorption models were applied to describe the equilibrium isotherms. A maximum adsorption capacity of 44.3 mg g -1 of NH 4 + was achieved. The regeneration and reusable ability of this adsorbent was evaluated, and the results indicated that the recovered adsorbent could be used again for NH 4 + removal with nearly constant adsorption capacity. Thermodynamic parameters such as change in free energy (ΔG 0 ), enthalpy (ΔH 0 ) and entropy (ΔS 0 ) were also determined, which indicated that the adsorption was a spontaneous and exothermic process at ambient conditions. Compared with other adsorbents, the as-synthesized NaA zeolite displays a faster adsorption rate and higher adsorption capacity, which implies potential application for removing NH 4 + pollutants from wastewaters.

Structure investigations on zirconium phosphate preparates by means of DTA, ETA, and TG

International Nuclear Information System (INIS)

Herbell, J.D.; Specht, S.; Born, H.J.

1976-01-01

The simultanous DTA, ETA and TG inorganic ion exchanger based on zirconium phosphate enables the clear interpretation of the effects occuring. In particular it can be seen that the fast transition in amorphous preparates at high temperature of a badly defined form of pyrophosphate into the cubic crystalline substances, however a measurable energy release by means of DTA is not observed due to the slight mobility of the atoms in the crystal lattice. This effect on the other hand may be seen using ETA. In addition, an exothermal reaction occuring in some preparates, especially in cation charged ones, was traced back to the forming of part-crystalline structures which could be especially fast and sensitively characterized using DTA. (orig.) [de

Extracting oils

Energy Technology Data Exchange (ETDEWEB)

Patart, G

1926-03-15

In the hydrogenation or extraction of by-products from organic substances at high temperatures and pressures, the gases or liquids, or both, used are those which are already heated and compressed during industrial operations such as exothermic synthesizing reactions such as the production of methanol from hydrogen and carbon monoxide in a catalytic process. Gases from this reaction may be passed upwardly through a digester packed with pine wood while liquid from the same catalytic process is passed downwardly through the material. The issuing liquid contains methanol, pine oil, acetone, isopropyl alcohol, and acetic acid. The gases contain additional hydrogen, carbon monoxide, methane, ethylene, and its homologs which are condensed upon the catalyser to liquid hydrocarbons. Petroleum oils and coal may be treated similarly.

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)

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)

Analysis of structural and thermal stability in the positive electrode for sulfide-based all-solid-state lithium batteries

Science.gov (United States)

Tsukasaki, Hirofumi; Otoyama, Misae; Mori, Yota; Mori, Shigeo; Morimoto, Hideyuki; Hayashi, Akitoshi; Tatsumisago, Masahiro

2017-11-01

Sulfide-based all-solid-state batteries using a non-flammable inorganic solid electrolyte are promising candidates as a next-generation power source owing to their safety and excellent charge-discharge cycle characteristics. In this study, we thus focus on the positive electrode and investigated structural stabilities of the interface between the positive electrode active material LiNi1/3Mn1/3Co1/3O2 (NMC) and the 75Li2S·25P2S5 (LPS) glass electrolyte after charge-discharge cycles via transmission electron microscopy (TEM). To evaluate the thermal stability of the fabricated all-solid-state cell, in-situ TEM observations for the positive electrode during heating are conducted. As a result, structural and morphological changes are detected in the LPS glasses. Thus, exothermal reaction present in the NMC-LPS composite positive electrode after the initial charging is attributable to the crystallization of LPS glasses. On the basis of a comparison with crystallization behavior in single LPS glasses, the origin of exothermal reaction in the NMC-LPS composites is discussed.

Synthesis, crystal structure and catalytic effect on thermal decomposition of RDX and AP: An energetic coordination polymer [Pb{sub 2}(C{sub 5}H{sub 3}N{sub 5}O{sub 5}){sub 2}(NMP)·NMP]{sub n}

Energy Technology Data Exchange (ETDEWEB)

Liu, Jin-jian [School of Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Yancheng Teachers College, Yancheng 224002 (China); Liu, Zu-Liang, E-mail: liuzl@mail.njust.edu.cn [School of Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Cheng, Jian [School of Chemical Engineering, Nanjing University of Science and Technology, Nanjing 210094 (China); Yancheng Teachers College, Yancheng 224002 (China); Fang, Dong, E-mail: fangdong106@163.com [Yancheng Teachers College, Yancheng 224002 (China)

2013-04-15

An energetic lead(II) coordination polymer based on the ligand ANPyO has been synthesized and its crystal structure has been got. The polymer was characterized by FT-IR spectroscopy, elemental analysis, DSC and TG-DTG technologies. Thermal analysis shows that there are one endothermic process and two exothermic decomposition stages in the temperature range of 50–600 °C with final residues 57.09%. The non-isothermal kinetic has also been studied on the main exothermic decomposition using the Kissinger's and Ozawa–Doyle's methods, the apparent activation energy is calculated as 195.2 KJ/mol. Furthermore, DSC measurements show that the polymer has significant catalytic effect on the thermal decomposition of ammonium perchlorate. - Graphical abstract: An energetic lead(II) coordination polymer of ANPyO has been synthesized, structurally characterized and properties tested. Highlights: ► We have synthesized and characterized an energetic lead(II) coordination polymer. ► We have measured its molecular structure and thermal decomposition. ► It has significant catalytic effect on thermal decomposition of AP.

The Leachate Release and Microstructure of the Sewage Sludge under the Anaerobic Fermentation

Directory of Open Access Journals (Sweden)

Yiqie Dong

2015-01-01

Full Text Available Pollutant release, pore structure, and thermal effect of sewage sludge during anaerobic fermentation were investigated. Results showed that the pH value firstly declined and then increased during anaerobic fermentation. The BOD5 and organics of sewage sludge declined, and the BOD5 of samples which was originally neutral declined as much as 53.6%. The micropore of samples was relatively developed. The biggest adsorption amount was 69.2 cm3/g. The average pore size was enlarged about 16.0–19.8% under anaerobic fermentation. There existed endothermic valley during heating procedure of 0–200∘C because of the dehydration, and the mass loss was 60.9–72.5%. The endothermic valley of the sample fluctuated at the 14th day in the anaerobic fermentation. During the heating procedure of 200–600∘C, there existed exothermal peaks because of the oxidation and burning of the organics. The curve of sample which was originally neutral had comparatively large endothermic valley and exothermal peak.

Design Tool for Estimating Chemical Hydrogen Storage System Characteristics for Light-Duty Fuel Cell Vehicles

Energy Technology Data Exchange (ETDEWEB)

Thornton, Matthew J [National Renewable Energy Laboratory (NREL), Golden, CO (United States); Sprik, Samuel [National Renewable Energy Laboratory (NREL), Golden, CO (United States); Brooks, Kriston P. [Pacific Northwest National Laboratory; Tamburello, David A. [Savannah River National Laboratory

2018-04-07

The U.S. Department of Energy (DOE) developed a vehicle Framework model to simulate fuel cell-based light-duty vehicle operation for various hydrogen storage systems. This transient model simulates the performance of the storage system, fuel cell, and vehicle for comparison to Technical Targets established by DOE for four drive cycles/profiles. Chemical hydrogen storage models have been developed for the Framework for both exothermic and endothermic materials. Despite the utility of such models, they require that material researchers input system design specifications that cannot be estimated easily. To address this challenge, a design tool has been developed that allows researchers to directly enter kinetic and thermodynamic chemical hydrogen storage material properties into a simple sizing module that then estimates system parameters required to run the storage system model. Additionally, the design tool can be used as a standalone executable file to estimate the storage system mass and volume outside of the Framework model. These models will be explained and exercised with the representative hydrogen storage materials exothermic ammonia borane (NH3BH3) and endothermic alane (AlH3).

Synthesis of new thermoelectrics using modulated elemental reactants

Energy Technology Data Exchange (ETDEWEB)

Hornbostel, M D; Sellinschegg, H; Johnson, D C

1997-07-01

A series of new, metastable ternary crystalline compounds with the skutterudite crystal structure have been synthesized using modulated elemental reactants. The initial reactants are made up of multiple repeats of a {approximately}25 {angstrom} thick unit containing elemental layers of the desired ternary metal, iron and antimony. Low temperature annealing (150 C) results in interdiffusion of the elemental layers to form amorphous reaction intermediates. Annealing these intermediates at temperatures between 200 C and 250 C results in exothermic crystallization of the desired skutterudite crystal structure. Most of the new compounds prepared are only kinetically stable, decomposing exothermically to form thermodynamically more stable mixtures of binary compounds and elements. Low angle x-ray diffraction studies show that the resulting films are exceedingly smooth. These films have an ideal geometry for measuring properties of importance for thermoelectric devices--the Seebeck coefficient and the electrical conductivity. Thermal conductivity can be measured using a modification of the 3{omega} technique of Cahill. Samples can be produced rapidly, allowing for systematic screening and subsequent optimization as a function of composition and doping levels.

Effects of Al/P composition ratio on the crystallization of MgO-CaO-Al203-SiO2-P2O5 bioglass-ceramic system

Energy Technology Data Exchange (ETDEWEB)

Wu, Shihching; Hon, Minhsiung [National Cheng-Kung Univ., Taiwan (Taiwan, Province of China)

1993-06-01

Effects of Al/P composition ratio on the crystallization of apatite and anorthite were investigated by differential thermal analysis ( DTA ) using series of glasses with the nominal composition of 3.0wt% MgO, 35.0wt% CaO, 41.4wt% SiO2 and 20.6wt%(Al2O3+P205). With the decrease of Al/P ratio, the activation energy for apatite crystallization is decreased and the apatite exotherm is shifted to the lower temperature. On the other hand, anorthite crystallized from the specimen surface, the activation energy for anorthite is increased with the decrease of Al/P ratio, however the exotherm is not shifted significantly. Roughly estimated values of Avrami parameters, n, which is related to the directionality of crystal growth, for apatite and anorthite have been 2 and 1 respectively. This had shown that apatite implies bulk crystallization and anorthite signifies surface crystallization. Also the SEM observations of the crystals revealed that there was one dimensional crystal growth for anorthite and spherulitic growth for apatite. 17 refs., 6 figs., 2 tabs.

Thermodynamics on Soluble Carbon Nanotubes: How Do DNA Molecules Replace Surfactants on Carbon Nanotubes?

Science.gov (United States)

Kato, Yuichi; Inoue, Ayaka; Niidome, Yasuro; Nakashima, Naotoshi

2012-01-01

Here we represent thermodynamics on soluble carbon nanotubes that enables deep understanding the interactions between single-walled carbon nanotubes (SWNTs) and molecules. We selected sodium cholate and single-stranded cytosine oligo-DNAs (dCn (n = 4, 5, 6, 7, 8, 10, 15, and 20)), both of which are typical SWNT solubilizers, and successfully determined thermodynamic properties (ΔG, ΔH and ΔS values) for the exchange reactions of sodium cholate on four different chiralities of SWNTs ((n,m) = (6,5), (7,5), (10,2), and (8,6)) for the DNAs. Typical results contain i) the dC5 exhibited an exothermic exchange, whereas the dC6, 8, 10, 15, and 20 materials exhibited endothermic exchanges, and ii) the energetics of the dC4 and dC7 exchanges depended on the associated chiral indices and could be endothermic or exothermic. The presented method is general and is applicable to any molecule that interacts with nanotubes. The study opens a way for science of carbon nanotube thermodynamics. PMID:23066502

Mechanically activated SHS reaction in the Fe-Al system: in-situ time resolved diffraction using synchrotron radiation

International Nuclear Information System (INIS)

Gaffet, E.; Charlot, F.; Klein, D.; Bernard, F.; Niepce, J.C.

1998-01-01

The mechanical activation self propagating high temperature synthesis (M.A.S.H.S.) processing is a new way to produce nanocrystalline iron aluminide intermetallic compounds. This process is maily the combination of two steps; in the one hand, a mechanical activation where the Fe - Al powder mixture was milled during a short time at given energy and frequency of shocks and in the other hand, a self propagating high temperature synthesis (S.H.S.) reaction, for which the exothermicity of the Fe + Al reaction is used. This fast propagated MASHS reaction has been in-situ investigated using the time resolved X-ray diffraction (TRXRD) using a X-ray synchrotron beam and an infrared thermography camera, allowing the coupling of the materials structure and the temperature field. The effects of the initial mean compositions, of the milling conditions as well as of the compaction parameters on the MASHS reaction are reported. (orig.)

Insight into biosorption equilibrium, kinetics and thermodynamics of crystal violet onto Ananas comosus (pineapple) leaf powder

Science.gov (United States)

Chakraborty, Sagnik; Chowdhury, Shamik; Saha, Papita Das

2012-06-01

Biosorption performance of pineapple leaf powder (PLP) for removal of crystal violet (CV) from its aqueous solutions was investigated. To this end, the influence of operational parameters such as pH, biosorbent dose, initial dye concentration and temperature were studied employing a batch experimental setup. The biosorption process followed the Langmuir isotherm model with high correlation coefficients ( R 2 > 0.99) at different temperatures. The maximum monolayer biosorption capacity was found to be 78.22 mg g-1 at 293 K. The kinetic data conformed to the pseudo-second-order kinetic model. The activation energy of the system was calculated as 58.96 kJ mol- 1 , indicating chemisorption nature of the ongoing biosorption process. A thermodynamic study showed spontaneous and exothermic nature of the biosorption process. Owing to its low cost and high dye uptake capacity, PLP has potential for application as biosorbent for removal of CV from aqueous solutions.

Ultra-sonic observation in niobium hydride precipitation

International Nuclear Information System (INIS)

Florencio, O.; Pinatti, Dyonisio G.

1982-01-01

The hidrogen embrittlement of exothermic ocluders, had been considered as due to applied stress induced hydride precipitates leading to brittle fracture. The results of simultaneous measurements of macroscopic deformation and elastic change due to hydride precipitation, using the ultrasonic pulse-echo technique are showed. THen it was tested the possibility of kinectis precipitation parameters evoluation. (Author) [pt

Abstracts, Third Space Processing Symposium, Skylab results

Science.gov (United States)

1974-01-01

Skylab experiments results are reported in abstracts of papers presented at the Third Space Processing Symposium. Specific areas of interest include: exothermic brazing, metals melting, crystals, reinforced composites, glasses, eutectics; physics of the low-g processes; electrophoresis, heat flow, and convection demonstrations flown on Apollo missions; and apparatus for containerless processing, heating, cooling, and containing materials.

Coordination of CO to the alkaline earth metallocene [(Me₅C₅)₂Ca

OpenAIRE

Selg, Peter; Brintzinger, Hans-Herbert; Andersen, Richard A.; Horváth, István T.

1995-01-01

The exothermic formation of a Ca–CO complex [Eq.(a), ΔHo = −25 kJ mol−1] confirms that CO can bind to a metal center without π back donation from filled d orbitals. In its spectroscopic properties, the calcocene–carbonyl complex resembles "nonclassical" noble metal carbonyl complexes. Cp* = η5-C5Me5.

Insertion of singlet chlorocarbenes across C–H bonds in alkanes ...

Indian Academy of Sciences (India)

WINTEC

stry3 and in gas phase combustion.4,5 Regarding the stability the large σ – pπ separation6–8 and inductive/ mesomeric effects make the halocarbenes more stable .... to the enthalpy due to internal energy. All the reaction enthalpies show the exothermicity of the insertion reactions indicating that all the tran-. Table 2. Heat of ...

Encapsulation of nuclear wastes

International Nuclear Information System (INIS)

Arnold, J.L.; Boyle, R.W.

1978-01-01

Toxic waste materials are encapsulated by the method wherein the waste material in liquid or finely divided solid form is uniformly dispersed in a vinyl ester resin or an unsaturated polyester and the resin cured under conditions that the exotherm does not rise above the temperature at which the integrity of the encapsulating material is destroyed

Effect of the solvent type and polymerization conditions on the curing kinetics, thermal and viscoelastic performance of poly(amide-imide resins

Directory of Open Access Journals (Sweden)

Z. Rasheva

2015-03-01

Full Text Available Isothermal and non-isothermal curing kinetics of both N-methyl-2-pyrrolidone (NMP and N-methylimidazole (MI based poly(amide-imide (PAI resins were investigated by DSC analysis using tightly closed high-pressure crucibles. Several exothermal peaks on the non-isothermal DSC-traces were observed and attributed to the reactions of different functional groups of PAI-resin. Furthermore the final conversion (polymerization degree of PAI was determined under isothermal conditions, simulating three programs with the post-curing temperatures set as 215, 240 and 270°C. For the MI-PAI based resin, the conversion values were found to be much higher compared to those for the NMP-PAI system. Compared to NMP-based PAI-resin, a shift of the main exothermal peaks to the lower temperatures was observed in the non-isothermal kinetic investigations when MI was used as a solvent. This was accompanied with a reduction of activation energy (Ea values, as up to a factor of 3 determined by the Flynn-Wall-Ozawa approach for all the main formation reactions. It indicates a catalytic effect of MI on the PAI polymerization. In addition, conversion values were determined according to the Di Benedetto equation for both systems cured using open molds in the oven. Regardless the different post-curing temperatures, the conversion values were similar for all the samples. Thermal and viscoelastic properties as well as crosslink density (nc were also investigated for these systems. It was found that the MI-based samples demonstrate lower nc values compared to the NMP-based ones at an almost two times higher storage modulus (E' at room temperature.

Waved graphene: Unique structure for the adsorption of small molecules

International Nuclear Information System (INIS)

Pan, Hui

2017-01-01

We propose waved graphenes for the strong adsorption of molecules and investigate their potential applications. We find that the physical adsorption of molecules on waved graphene is greatly enhanced by compression. At optimal compression, the physical adsorption energies of H_2, N_2, NO, and CO are increased by 6–9 times, and that for O_2 is more than 2 times. We show that the energy for their chemical adsorption on waved graphene decreases dramatically with the increment of compression. The energy of dissociation of H_2 on flat graphene is 1.63 eV and reduced to 0.06 eV (96% reduction) on waved graphene at a compression of 50%, respectively. The energy for chemical adsorption of O_2 on waved graphenes is extremely reduced from 0.98 eV to −0.57 eV as with compression increasing from 0 to 50%, indicating the transition of endothermic chemical adsorption to exothermic. We further show that the electronic properties of waved graphenes are modified, leading to the change of electrical characters. We see that the waved graphenes may find applications in gas storage, sensor and catalyst because of enhanced physical and chemical adsorption and the induced change of electronic properties. - Highlights: • Adsorption of small molecules on waved graphene is greatly enhanced. • Strong physical adsorption in the trough of waved graphene can be achieved by tuning the curvature. • Chemical adsorption is on the crest of waved graphene. • Exothermic dissociation of H2 and O2 can be realized on waved graphene under high compression. • Wave graphene can be candidates as catalysts and gas storage/sensor.

Waved graphene: Unique structure for the adsorption of small molecules

Energy Technology Data Exchange (ETDEWEB)

Pan, Hui, E-mail: huipan@umac.mo

2017-03-01

We propose waved graphenes for the strong adsorption of molecules and investigate their potential applications. We find that the physical adsorption of molecules on waved graphene is greatly enhanced by compression. At optimal compression, the physical adsorption energies of H{sub 2}, N{sub 2}, NO, and CO are increased by 6–9 times, and that for O{sub 2} is more than 2 times. We show that the energy for their chemical adsorption on waved graphene decreases dramatically with the increment of compression. The energy of dissociation of H{sub 2} on flat graphene is 1.63 eV and reduced to 0.06 eV (96% reduction) on waved graphene at a compression of 50%, respectively. The energy for chemical adsorption of O{sub 2} on waved graphenes is extremely reduced from 0.98 eV to −0.57 eV as with compression increasing from 0 to 50%, indicating the transition of endothermic chemical adsorption to exothermic. We further show that the electronic properties of waved graphenes are modified, leading to the change of electrical characters. We see that the waved graphenes may find applications in gas storage, sensor and catalyst because of enhanced physical and chemical adsorption and the induced change of electronic properties. - Highlights: • Adsorption of small molecules on waved graphene is greatly enhanced. • Strong physical adsorption in the trough of waved graphene can be achieved by tuning the curvature. • Chemical adsorption is on the crest of waved graphene. • Exothermic dissociation of H2 and O2 can be realized on waved graphene under high compression. • Wave graphene can be candidates as catalysts and gas storage/sensor.

Influence exothermical mixtures contents Na or B on elongation and hardness AlSi12 alloy

Directory of Open Access Journals (Sweden)

T. Lipiński

2008-04-01

Full Text Available The experiments were conducted on alloy AlSi12, following a factor design 23 for 3 independent variables. Mixtures composed of NaNO3, Na2B4O7, and Mg were used for alloy treatment. The amount of a reducing agent (Mg necessary to carry out the process was calculated on the basis of chemical reactions. The mass fraction (weight in weight concentration of individual variables is presented in Table 1. Results of study present by graphical forms. Figures 2-8 present until elongation (A5 and Brinell hardness (HB for each variable, at extreme (lower or higher levels of the other two.

A two-fluid two-phase model for thermal-hydraulic analysis of a U-tube steam generator

International Nuclear Information System (INIS)

Hung, Huanjen; Chieng, Chingchang; Pei, Baushei; Wang, Songfeng

1993-01-01

The Advanced Thermal-Hydraulic Analysis Code for Nuclear Steam Generators (ATHANS) was developed on the basis of the THERMIT-UTSG computer code for U-tube steam generators. The main features of the ATHANS model are as follows: (a) the equations are solved in cylindrical coordinates, (b) the number and the arrangement of the control volumes inside the steam generator can be chosen by the user, (c) the virtual mass effect is incorporated, and (d) the conjugate gradient squared method is employed to accelerate and improve the numerical convergence. The performance of the model is successfully validated by comparison with the test data from a Westinghouse model F steam generator at the Maanshan nuclear power plant. Better agreement with the test data can be obtained by a finer grid system using a cylindrical coordinate system and the virtual mass effect. With these advanced features, ATHANS provides the basic framework for further studies on the problems of steam generators, such as analyses of secondary-side corrosion and tube ruptures

On the prediction of the reactor vessel integrity under severe accident loadings (RPVSA)

Energy Technology Data Exchange (ETDEWEB)

Krieg, R. E-mail: maeule@irs.fzk.de; Devos, J.; Caroli, C.; Solomos, G.; Ennis, P.J.; Kalkhof, D

2001-11-01

In order to allow more reliable predictions on the lower head response under core melt-down conditions, the temperature distribution has been analysed including the natural convection in the corium pool. Furthermore, the mechanical models and the failure criteria have been improved based on the RUPTHER and FASTHER experiments where typical temperature gradients are simulated. Lower head local melting as well as corium crust development has been addressed in the CORVIS experiments studying the contact between an alumina/iron thermite and a thick steel plate. The upper head loading by corium impact due to a postulated in-vessel steam explosion has been investigated by the BERDA experiments. Similarity rules were considered such that the results can be directly converted to reactor conditions. Based on these investigations admissible steam explosion energy releases are determined which the upper head can carry. If these limits are not exceeded the reactor containment cannot be endangered by broken head fragments. To provide the necessary basic data, mechanical material tests have been performed.

Creating unstable velocity-space distributions with barium injections

International Nuclear Information System (INIS)

Pongratz, M.B.

1983-01-01

Large Debye lengths relative to detector dimensions and the absence of confining walls makes space an attractive laboratory for studying fundamental theories of plasma instabilities. However, natural space plasmas are rarely found displaced from equilibrium enough to permit isolation and diagnosis of the controlling parameters and driving conditions. Furthermore, any plasma or field response to the departure from equilibrium can be masked by noise in the natural system. Active experiments provide a technique for addressing the chicken or egg dilemma. Early thermite barium releases were generally conducted at low altitudes from sounding rockets to trace electric fields passively or to study configuration-space instabilities. One can also study velocity-space instabilities with barium releases. Neutral barium vapor releases wherein a typical speed greatly exceeds the thermal speed can be used to produce barium ion velocity-space distributions that should be subject to a number of microinstabilities. We examine the ion velocity-space distributions resulting from barium injections from orbiting spacecraft and shaped-charges

Understanding and modulating the high-energy properties of noble-gas hydrides from their long-bonding: an NBO/NRT investigation on HNgCO+/CS+/OSi+ and HNgCN/NC (Ng = He, Ar, Kr, Xe, Rn) molecules.

Science.gov (United States)

Zhang, Guiqiu; Song, Junjie; Fu, Lei; Tang, Kongshuang; Su, Yue; Chen, Dezhan

2018-04-18

The noble-gas hydrides, HNgX (X is an electronegative atom or fragment), represent potential high-energy materials because their two-body decomposition process, HNgX → Ng + HX, is strongly exoergic. Our previous studies have shown that each member of the HNgX (X = halogen atom or CN/NC fragment) molecules is composed of three leading resonance structures: two ω-bonding structures (H-Ng+ :X- and H:- Ng+-X) and one long-bonding structure (H∧X). The last one paints a novel [small sigma, Greek, circumflex]-type long-bonding picture. The present study focuses on the relationship between this novel bonding motif and the unusual energetic properties. We chose HNgCO+/CS+/OSi+/CN/NC, with the formula HNgAB (Ng = He, Ar, Kr, Xe, Rn; AB = CO+/CS+/OSi+/CN/NC) as the research system. We first investigated the bonding of HNgCO+ and its analogous HNgCS+/OSi+ species using NBO/NRT methods, and quantitatively compared the bonding with that in HNgCN/NC molecules. NBO/NRT results showed that each of the HNgCO+/CS+/OSi+ molecules could be better represented as a resonance hybrid of ω-bonding and long-bonding structures, but the long-bonding is much weaker than that in HNgCN/NC molecules. Furthermore, we introduced the long-bonding concept into the rationalization of the high-energy properties, and found a good correlation between the highly exothermic two-body dissociation channel and the long-bond order, bH-A. We also found that the long-bond order is highly tunable for these noble-gas hydrides due to its dependence on the nature of the electronegative AB fragments or the central noble-gas atoms, Ng. On the basis of these results, we could optimize the energetic properties by changing the long-bonding motif of our studied molecules. Overall, this study shows that the long-bonding model provides an easy way to rationalize and modulate the unusual energy properties of noble-gas hydrides, and that it is helpful to predict some noble-gas hydrides as potential energetic materials.

Report on the handling of safety information concerning flammable gases and ferrocyanide at the Hanford waste tanks

International Nuclear Information System (INIS)

1990-07-01

This report discusses concerns safety issues, and management at Hanford Tank Farm. Concerns center on the issue of flammable gas generation which could ignite, and on possible exothermic reactions of ferrocyanide compounds which were added to single shell tanks in the 1950's. It is believed that information concerning these issues has been mis-handled and the problems poorly managed

Report on the handling of safety information concerning flammable gases and ferrocyanide at the Hanford waste tanks

Energy Technology Data Exchange (ETDEWEB)

1990-07-01

This report discusses concerns safety issues, and management at Hanford Tank Farm. Concerns center on the issue of flammable gas generation which could ignite, and on possible exothermic reactions of ferrocyanide compounds which were added to single shell tanks in the 1950's. It is believed that information concerning these issues has been mis-handled and the problems poorly managed. (CBS)

Supported polytertiary amines: highly efficient and selective SO2 adsorbents.

Science.gov (United States)

Tailor, Ritesh; Abboud, Mohamed; Sayari, Abdelhamid

2014-01-01

Tertiary amine containing poly(propyleneimine) second (G2) and third (G3) generation dendrimers as well as polyethyleneimine (PEI) were developed for the selective removal of SO2. N-Alkylation of primary and secondary amines into tertiary amines was confirmed by FTIR and NMR analysis. Such modified polyamines were impregnated on two nanoporous supports, namely, SBA-15PL silica with platelet morphology and ethanol-extracted pore-expanded MCM-41 (PME) composite. In the presence of 0.1% SO2/N2 at 23 °C, the uptake of modified PEI, G2, and G3 supported on SBA-15PL was 2.07, 2.35, and 1.71 mmol/g, respectively; corresponding to SO2/N ratios of 0.22, 0.4, and 0.3. Under the same conditions, the SO2 adsorption capacity of PME-supported modified PEI and G3 was significantly higher, reaching 4.68 and 4.34 mmol/g, corresponding to SO2/N ratios of 0.41 and 0.82, respectively. The working SO2 adsorption capacity decreased with increasing temperature, reflecting the exothermic nature of the process. The adsorption capacity of these materials was enhanced dramatically in the presence of humidity in the gas mixture. FTIR data before SO2 adsorption and after adsorption and regeneration did not indicate any change in the materials. Nonetheless, the SO2 working capacity decreased in consecutive adsorption/regeneration cycles due to evaporation of impregnated polyamines, rather than actual deactivation. FTIR and (13)C and (15)N CP-MAS NMR of fresh and SO2 adsorbed modified G3 on PME confirmed the formation of a complexation adduct.

GAMMA RADIATION INITIATED POLYMERIZATION OF FLUOROMONOMERS. II. COPOLYMER OF CHLOROTRIFLUOROETHYLENE AND ETHYLENE

Energy Technology Data Exchange (ETDEWEB)

Manno, P. J.

1963-06-15

The radioinduced copolymerization of chlorotrifluoro ethylene and ethylene was studied. The polymerization rate increased with time and radiation intensity, and the Gvalues after 50% polymerization varied from 13,000 at 10/sup 5/ rep/hr to 25,000 at 6 x 10/sup 3/ rep/hr. The polymerization rate is proportional to the 0.7 or 0.8th power of the radiation intensity. The polymerization reaction is highly exothermic, and the optimum conditions for the best polymer properties occurred in a stirred autoclave cooled to 0 deg C containing a monomer-- water mixture and irradiated at 10/sup 4/ rep/hr. Catalytic polymerization was also studied, and the economics of or the preparation of the copolymer by catalytic and radiation processes is discussed briefly. (D.L.C.)

60-MW/sub t/ methanation plant design for HTGR process heat

International Nuclear Information System (INIS)

Davis, C.R.; Arcilla, N.T.; Hui, M.M.; Hutchins, B.A.

1982-07-01

This report describes a 60 MW(t) Methanation Plant for generating steam for industrial applications. The plant consists of four 15 MW(t) methanation trains. Each train is connected to a pipeline and receives synthesis gas (syngas) from a High Temperature Gas-Cooled Reactor Reforming (HTGR-R) plant. Conversion of the syngas to methane and water releases exothermic heat which is used to generate steam. Syngas is received at the Methanation Plant at a temperature of 80 0 F and 900 psia. One adiabatic catalytic reactor and one isothermal catalytic reactor, in each methanation train, converts the syngas to 92.2% (dry bases) methane. Methane and condensate are returned at temperatures of 100 to 125 0 F and at pressures of 860 to 870 psia to the HTGR-R plant for the reproduction of syngas

Temperature oscillations in methanol partial oxidation reactor for the production of hydrogen

Energy Technology Data Exchange (ETDEWEB)

Kim, Jinsu; Byeon, Jeonguk; Seo, Il Gyu; Lee, Hyun Chan; Kim, Dong Hyun; Lee, Jietae [Kyungpook National University, Daegu (Korea, Republic of)

2013-04-15

Methanol partial oxidation (POX) is a well-known reforming reaction for the production of hydrogen from methanol. Since POX is relatively fast and highly exothermic, this reforming method will be efficient for the fast start-up and load-following operation. However, POX generates hot spots around catalyst and even oscillations in the reactor temperature. These should be relieved for longer operations of the reactor without catalyst degradations. For this, temperature oscillations in a POX reactor are investigated experimentally. Various patterns of temperature oscillations according to feed flow rates of reactants and reactor temperatures are obtained. The bifurcation phenomena from regular oscillations to chaotic oscillations are found as the methanol flow rate increases. These experimental results can be used for theoretical analyses of oscillations and for designing safe reforming reactors.

Temperature oscillations in methanol partial oxidation reactor for the production of hydrogen

International Nuclear Information System (INIS)

Kim, Jinsu; Byeon, Jeonguk; Seo, Il Gyu; Lee, Hyun Chan; Kim, Dong Hyun; Lee, Jietae

2013-01-01

Methanol partial oxidation (POX) is a well-known reforming reaction for the production of hydrogen from methanol. Since POX is relatively fast and highly exothermic, this reforming method will be efficient for the fast start-up and load-following operation. However, POX generates hot spots around catalyst and even oscillations in the reactor temperature. These should be relieved for longer operations of the reactor without catalyst degradations. For this, temperature oscillations in a POX reactor are investigated experimentally. Various patterns of temperature oscillations according to feed flow rates of reactants and reactor temperatures are obtained. The bifurcation phenomena from regular oscillations to chaotic oscillations are found as the methanol flow rate increases. These experimental results can be used for theoretical analyses of oscillations and for designing safe reforming reactors

The polymer–polymorphoid nature of glass aging process

Directory of Open Access Journals (Sweden)

Victor S. Minaev

2015-12-01

Full Text Available Based on the concept of polymeric–polymorphous structure of glass and glass-forming liquid experimental data have been analyzed revealing the nature of glass aging. We show that the glass forming substance is a copolymer consisting of structural nano-fragments (polymorphoids in different polymorphous modifications (PM of the material having no translational symmetry (long-range order. The study revealed that the process and degree of glass aging influences the properties of glasses, including a change in enthalpy, manifested in the exothermic and endothermic effects observed in thermograms of differential scanning calorimetry of heated and cooled glasses. We have shown that the physicochemical essence of aging is the transformation of polymorphoids from high-temperature PM (HTPM to low-temperature PM (LTPM which results, under certain conditions, in LTPM crystallization.

Combustion Joining of Regolith Tiles for In-Situ Fabrication of Launch/Landing Pads on the Moon and Mars

Science.gov (United States)

Ferguson, Robert E.; Shafirovich, Evgeny; Mantovani, James G.

2017-01-01

To mitigate dust problems during launch/landing operations in lunar and Mars missions, it is desired to build solid pads on the surface. Recently, strong tiles have been fabricated from lunar regolith simulants using high-temperature sintering. The present work investigates combustion joining of these tiles through the use of exothermic intermetallic reactions. Specifically, nickel/aluminum (1:1 mole ratio) mixture was placed in a gap between the tiles sintered from JSC-1A lunar regolith simulant. Upon ignition by a laser, a self-sustained propagation of the combustion front over the mixture occurred. Joining was improved with increasing the tile thickness from 6.3 mm to 12.7 mm. The temperatures sufficient for melting the glass phase of JSC-1A were recorded for 12.7-mm tiles, which explains the observed better joining.

Molecular simulation for novel carbon buckyball materials

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Hasan R. Obayes

2015-12-01

Full Text Available The discovery of buckyballs was unexpected because the researchers were delivering carbon plasmas to reproduce and describe unidentified interstellar matter. Density functional theory was done to study and design the structure of [8]circulene and three new buckyballs with molecular dimensions of less than a nanometer. Cyclic polymerization reactions can be utilized to prepare new buckyballs, and this process also produces molecules of hydrogen. All reactions are spontaneous and exothermic as per the estimations to the values of entropy, Gibbs energy, and enthalpy changes. The results demonstrate that the most symmetric buckyball is the most stable, and the molecular dimensions are less than a nanometer. The new buckyballs are characterized by the high efficiency of their energy gaps, making it potentially useful for solar cell applications.

Simulation of styrene polymerization reactors: kinetic and thermodynamic modeling

Directory of Open Access Journals (Sweden)

A. S. Almeida

2008-06-01

Full Text Available A mathematical model for the free radical polymerization of styrene is developed to predict the steady-state and dynamic behavior of a continuous process. Special emphasis is given for the kinetic and thermodynamic models, where the most sensitive parameters were estimated using data from an industrial plant. The thermodynamic model is based on a cubic equation of state and a mixing rule applied to the low-pressure vapor-liquid equilibrium of polymeric solutions, suitable for modeling the auto-refrigerated polymerization reactors, which use the vaporization rate to remove the reaction heat from the exothermic reactions. The simulation results show the high predictive capability of the proposed model when compared with plant data for conversion, average molecular weights, polydispersity, melt flow index, and thermal properties for different polymer grades.

Modification of NaK (Na and K) dissolution device at the L.E.C.I

International Nuclear Information System (INIS)

Mansard, Bernard; Ducas, Serge; Riviere, Michel

1969-12-01

As three NaK dissolution devices had been operated since 1965 and as irradiation assemblies with a greater capacity (2 to 3 times) are now to be used, the modification of these dissolution devices is addressed. This requires a better control of the dissolution reaction (the NaK + alcohol reaction is highly exothermic and results in an effervescence which requires a greater volume). The objectives are therefore to delay the dissolution, to trigger it, to stop it, to control it at will, and to release heat. The new device is then described with its vessel, its cap, its ball valve, and its two tight sleeves. The operation principle is described, as well as the NaK draining process, and the NaK dissolution. Safety, time saving and raw matter saving issues are finally outlined

Chemothermal Therapy for Localized Heating and Ablation of Tumor

Directory of Open Access Journals (Sweden)

Zhong-Shan Deng

2013-01-01

Full Text Available Chemothermal therapy is a new hyperthermia treatment on tumor using heat released from exothermic chemical reaction between the injected reactants and the diseased tissues. With the highly minimally invasive feature and localized heating performance, this method is expected to overcome the ubiquitous shortcomings encountered by many existing hyperthermia approaches in ablating irregular tumor. This review provides a relatively comprehensive review on the latest advancements and state of the art in chemothermal therapy. The basic principles and features of two typical chemothermal ablation strategies (acid-base neutralization-reaction-enabled thermal ablation and alkali-metal-enabled thermal/chemical ablation are illustrated. The prospects and possible challenges facing chemothermal ablation are analyzed. The chemothermal therapy is expected to open many clinical possibilities for precise tumor treatment in a minimally invasive way.

Preparation method and thermal properties of samarium and europium-doped alumino-phosphate glasses

Energy Technology Data Exchange (ETDEWEB)

Sava, B.A., E-mail: savabogdanalexandru@yahoo.com [National Institute of Research and Development for Optoelectronics, Department for Optospintronics, 409 Atomistilor Street, P.O. Box MG – 5, RO-77125 Magurele (Romania); Elisa, M., E-mail: astatin18@yahoo.com [National Institute of Research and Development for Optoelectronics, Department for Optospintronics, 409 Atomistilor Street, P.O. Box MG – 5, RO-77125 Magurele (Romania); Boroica, L., E-mail: boroica_lucica@yahoo.com [National Institute for Lasers, Plasma and Radiation Physics, 77125 Magurele (Romania); Monteiro, R.C.C., E-mail: rcm@fct.unl.pt [Center of Materials Research/Institute for Nanostructures, Nanomodelling and Nanofabrication, (CENIMAT/I3N), Department of Materials Sciences, Faculty of Sciences and Technology, Universidade Nova de Lisboa, 2829-516 Caparica (Portugal)

2013-12-01

Highlights: • Improved preparation method of rare-earth-doped phosphate glasses was done. • Working and annealing temperatures were lower than for undoped phosphate glass. • Doped glass viscosity is also lower and has quasi-linear variation with temperature. • Exothermic peak appears at about 555 °C and 685 °C, due to devitrification in glass. -- Abstract: The present work investigates alumino-phosphate glasses from Li{sub 2}O–BaO–Al{sub 2}O{sub 3}–La{sub 2}O{sub 3}–P{sub 2}O{sub 5} system containing Sm{sup 3+} and Eu{sup 3+} ions, prepared by two different ways: a wet raw materials mixing route followed by evaporation and melt-quenching, and by remelting of shards. The linear thermal expansion coefficient measured by dilatometry is identical for both rare-earth-doped phosphate glasses. Comparatively to undoped phosphate glass the linear thermal expansion coefficient increases with 2 × 10{sup −7} K{sup −1} when dopants are added. The characteristic temperatures very slowly decrease but can be considered constant with atomic weight, atomic number and f electrons number of the doping ions in the case of T{sub g} (vitreous transition temperature) and T{sub sr} (high annealing temperature) but slowly increase in the case of T{sub ir} (low annealing temperature–strain point) and very slowly increase, being practically constant in the case of T{sub D} (dilatometric softening temperature). Comparatively to undoped phosphate glass the characteristic temperatures of Sm and Eu-doped glasses present lower values. The higher values of electrical conductance for both doped glasses, comparatively to usual soda-lime-silicate glass, indicate a slightly reduced stability against water. The viscosity measurements, showed a quasi-linear variation with temperature the mean square deviation (R{sup 2}) being ranged between 0.872% and 0.996%. The viscosity of doped glasses comparatively to the undoped one is lower at the same temperature. Thermogravimetric

Systems and methods for solar energy storage, transportation, and conversion utilizing photochemically active organometallic isomeric compounds and solid-state catalysts

Science.gov (United States)

Vollhardt, K. Peter C.; Segalman, Rachel A; Majumdar, Arunava; Meier, Steven

2015-02-10

A system for converting solar energy to chemical energy, and, subsequently, to thermal energy includes a light-harvesting station, a storage station, and a thermal energy release station. The system may include additional stations for converting the released thermal energy to other energy forms, e.g., to electrical energy and mechanical work. At the light-harvesting station, a photochemically active first organometallic compound, e.g., a fulvalenyl diruthenium complex, is exposed to light and is photochemically converted to a second, higher-energy organometallic compound, which is then transported to a storage station. At the storage station, the high-energy organometallic compound is stored for a desired time and/or is transported to a desired location for thermal energy release. At the thermal energy release station, the high-energy organometallic compound is catalytically converted back to the photochemically active organometallic compound by an exothermic process, while the released thermal energy is captured for subsequent use.

Atomic adsorption on pristine graphene along the Periodic Table of Elements - From PBE to non-local functionals

Science.gov (United States)

Pašti, Igor A.; Jovanović, Aleksandar; Dobrota, Ana S.; Mentus, Slavko V.; Johansson, Börje; Skorodumova, Natalia V.

2018-04-01

The understanding of atomic adsorption on graphene is of high importance for many advanced technologies. Here we present a complete database of the atomic adsorption energies for the elements of the Periodic Table up to the atomic number 86 (excluding lanthanides) on pristine graphene. The energies have been calculated using the projector augmented wave (PAW) method with PBE, long-range dispersion interaction corrected PBE (PBE+D2, PBE+D3) as well as non-local vdW-DF2 approach. The inclusion of dispersion interactions leads to an exothermic adsorption for all the investigated elements. Dispersion interactions are found to be of particular importance for the adsorption of low atomic weight earth alkaline metals, coinage and s-metals (11th and 12th groups), high atomic weight p-elements and noble gases. We discuss the observed adsorption trends along the groups and rows of the Periodic Table as well some computational aspects of modelling atomic adsorption on graphene.

Thermoplasmonic Ignition of Metal Nanoparticles.

Science.gov (United States)

Mutlu, Mehmet; Kang, Ju-Hyung; Raza, Søren; Schoen, David; Zheng, Xiaolin; Kik, Pieter G; Brongersma, Mark L

2018-03-14

Explosives, propellants, and pyrotechnics are energetic materials that can store and quickly release tremendous amounts of chemical energy. Aluminum (Al) is a particularly important fuel in many applications because of its high energy density, which can be released in a highly exothermic oxidation process. The diffusive oxidation mechanism (DOM) and melt-dispersion mechanism (MDM) explain the ways powders of Al nanoparticles (NPs) can burn, but little is known about the possible use of plasmonic resonances in NPs to manipulate photoignition. This is complicated by the inhomogeneous nature of powders and very fast heating and burning rates. Here, we generate Al NPs with well-defined sizes, shapes, and spacings by electron beam lithography and demonstrate that their plasmonic resonances can be exploited to heat and ignite them with a laser. By combining simulations with thermal-emission, electron-, and optical-microscopy studies, we reveal how an improved control over NP ignition can be attained.

Influence of aging on the heat and gas emissions from commercial lithium ion cells in case of thermal failure

Directory of Open Access Journals (Sweden)

Michael Lammer

2018-03-01

Full Text Available A method for thermal ramp experiments on cylindrical 18650 Li-ion cells has been established. The method was applied on pristine cells as well as on devices aged by cyclisation or by storage at elevated temperature respectively. The tested cells comprise three types of LiNi0.8Co0.15Al0.05O2 cells for either high power or high energy applications. The heat flux to and from the cell was investigated. Degradation and exothermic breakdown released large amounts of heat and gas. The total gas and heat emission from cycled cells was significantly larger than emission from cells aged by storage. After aging, the low energy cell ICR18650HE4 did not transgress into thermal runaway. Gas composition changed mainly in the early stage of the experiment. The composition of the initial gas release changed from predominantly CO2 towards hydrocarbons. The thermal runaway emitted for all tests a comparable mixture of H2, CO and CO2.

Effect of the design variables on the energy performance and size parameters of a heat transformer based on the system acetone/H[sub 2]/2-propanol

Energy Technology Data Exchange (ETDEWEB)

Gandia, L M; Montes, M [Ente Vasco de la Energia, Bilbao (Spain). Div. de Investigacion y Recursos

1992-12-01

A high-temperature chemical heat pump based on the system acetone/H[sub 2]/2-propanol for waste heat recovery was studied. Two reversible catalytic chemical reactions are involved in this system. The waste heat (at 333-353K) is recovered by means of the endothermic liquid-phase dehydrogenation of 2-propanol, and is upgraded at high temperature (453-473K) by the reverse reaction, the exothermic gaseous-phase hydrogenation of acetone. In this process, a fraction of the recovered waste heat is removed at low temperature (303K), to carry out the separation by vapour rectification between acetone and 2-propanol. A mathematical model was developed, that permits the study of the effect of the heat pump operating conditions on the coefficient of performance (COP), exergetic efficiency and size parameters. This model allows the optimal range for the system control variables to be estimated. Under these conditions, the energy and size parameters have been calculated on a basis of 0.32 MW upgraded heat. (author)

Biosorption of Cr(VI from AqueousSolution Using New Adsorbent: Equilibrium and Thermodynamic Study

Directory of Open Access Journals (Sweden)

Israa G. Zainal

2010-01-01

Full Text Available Biosorption is one such emerging technology which utilized naturally occurring waste materials to sequester heavy metals from polluted water. In the present study cinnamon was utilized for Cr(VI removal from aqueous solutions.It was found that a time of two hours was sufficient for sorption to attain equilibrium. The optimum pH was 2 for Cr(VI removal. Temprature has little influence on the biosorption process. The Cr(VI removal decreased with increase in temperature. The biosorption data was well fitted to Dubinin - Radushkevich (D-R, Freundlich and Tempkin adsorption isotherm models, although the correlation coefficient of Langmuir model was high but the calculated adsorption capacity did not agree with the experimental. The thermodynamic study reveals that the biosorption process is spontaneous and the spontaneity decreased with temperature increase and the process is exothermic accompanied by highly ordered adsorbate at the solid liquid interface. ΔH° values were negative and lie in the range of physical adsorption.

Effect of Sodium Carboxymethyl Celluloses on Water-catalyzed Self-degradation of 200-degree C-heated Alkali-Activated Cement

Energy Technology Data Exchange (ETDEWEB)

Sugama T.; Pyatina, T.

2012-05-01

We investigated the usefulness of sodium carboxymethyl celluloses (CMC) in promoting self-degradation of 200°C-heated sodium silicate-activated slag/Class C fly ash cementitious material after contact with water. CMC emitted two major volatile compounds, CO2 and acetic acid, creating a porous structure in cement. CMC also reacted with NaOH from sodium silicate to form three water-insensitive solid reaction products, disodium glycolate salt, sodium glucosidic salt, and sodium bicarbonate. Other water-sensitive solid reaction products, such as sodium polysilicate and sodium carbonate, were derived from hydrolysates of sodium silicate. Dissolution of these products upon contact with water generated heat that promoted cement’s self-degradation. Thus, CMC of high molecular weight rendered two important features to the water-catalyzed self-degradation of heated cement: One was the high heat energy generated in exothermic reactions in cement; the other was the introduction of extensive porosity into cement.

Preparation of highly ordered cubic NaA zeolite from halloysite mineral for adsorption of ammonium ions.

Science.gov (United States)

Zhao, Yafei; Zhang, Bing; Zhang, Xiang; Wang, Jinhua; Liu, Jindun; Chen, Rongfeng

2010-06-15

Well-ordered cubic NaA zeolite was first synthesized using natural halloysite mineral with nanotubular structure as source material by hydro-thermal method. SEM and HRTEM images indicate that the synthesized NaA zeolite is cubic-shaped crystal with planar surface, well-defined edges and symmetrical and uniform pore channels. The adsorption behavior of ammonium ions (NH(4)(+)) from aqueous solution onto NaA zeolite was investigated as a function of parameters such as equilibrium time, pH, initial NH(4)(+) concentration, temperature and competitive cations. The Langmuir and Freundlich adsorption models were applied to describe the equilibrium isotherms. A maximum adsorption capacity of 44.3 mg g(-1) of NH(4)(+) was achieved. The regeneration and reusable ability of this adsorbent was evaluated, and the results indicated that the recovered adsorbent could be used again for NH(4)(+) removal with nearly constant adsorption capacity. Thermodynamic parameters such as change in free energy (DeltaG(0)), enthalpy (DeltaH(0)) and entropy (DeltaS(0)) were also determined, which indicated that the adsorption was a spontaneous and exothermic process at ambient conditions. Compared with other adsorbents, the as-synthesized NaA zeolite displays a faster adsorption rate and higher adsorption capacity, which implies potential application for removing NH(4)(+) pollutants from wastewaters. Copyright 2010 Elsevier B.V. All rights reserved.

Preparation of highly ordered cubic NaA zeolite from halloysite mineral for adsorption of ammonium ions

Energy Technology Data Exchange (ETDEWEB)

Zhao Yafei [School of Chemical Engineering, Zhengzhou University, Zhengzhou 450001 (China); Zhang Bing, E-mail: zhangb@zzu.edu.cn [School of Chemical Engineering, Zhengzhou University, Zhengzhou 450001 (China); Henan Academy of Sciences, Zhengzhou 450002 (China); Zhang Xiang; Wang Jinhua; Liu Jindun [School of Chemical Engineering, Zhengzhou University, Zhengzhou 450001 (China); Chen Rongfeng [Henan Academy of Sciences, Zhengzhou 450002 (China)

2010-06-15

Well-ordered cubic NaA zeolite was first synthesized using natural halloysite mineral with nanotubular structure as source material by hydro-thermal method. SEM and HRTEM images indicate that the synthesized NaA zeolite is cubic-shaped crystal with planar surface, well-defined edges and symmetrical and uniform pore channels. The adsorption behavior of ammonium ions (NH{sub 4}{sup +}) from aqueous solution onto NaA zeolite was investigated as a function of parameters such as equilibrium time, pH, initial NH{sub 4}{sup +} concentration, temperature and competitive cations. The Langmuir and Freundlich adsorption models were applied to describe the equilibrium isotherms. A maximum adsorption capacity of 44.3 mg g{sup -1} of NH{sub 4}{sup +} was achieved. The regeneration and reusable ability of this adsorbent was evaluated, and the results indicated that the recovered adsorbent could be used again for NH{sub 4}{sup +} removal with nearly constant adsorption capacity. Thermodynamic parameters such as change in free energy ({Delta}G{sup 0}), enthalpy ({Delta}H{sup 0}) and entropy ({Delta}S{sup 0}) were also determined, which indicated that the adsorption was a spontaneous and exothermic process at ambient conditions. Compared with other adsorbents, the as-synthesized NaA zeolite displays a faster adsorption rate and higher adsorption capacity, which implies potential application for removing NH{sub 4}{sup +} pollutants from wastewaters.

Copolymers of Vinyl-Containing Benzoxazine with Vinyl Monomers as Precursors for High Performance Thermosets

Directory of Open Access Journals (Sweden)

Tsutomu Takeichi

2015-04-01

Full Text Available A benzoxazine containing a vinyl group (P-4va was prepared by the reaction of phenol, 4-vinylaniline, and paraformaldehyde. A differential scanning calorimetry (DSC study revealed that ring-opening polymerization of the benzoxazine and chain polymerization of the vinyl group occurred in the same temperature range. When 2,2'-azobisisobutyronitrile was added as a radical initiator to P-4va, however, only the vinyl groups were polymerized at lower temperature, giving oligo(P-4va that contains pendent benzoxazine units. Radical copolymerization of P-4va with various vinyl monomers such as styrene, methyl methacrylate (MMA, and n-butyl acrylate (BuA was examined. The chemical structure of the copolymers was confirmed by FT-IR and 1H-NMR to be one of polyolefins bearing benzoxazine units as the pendant groups. The weight-average molecular weights of the copolymers determined by size exclusion chromatography were to be in the range of 1900–51,500 depending on the comonomers. DSC of the copolymers showed that the maxima of the exothermic peaks corresponding to the ring-opening polymerization of the pendent benzoxazine units were observed in the temperature range of 229–250 °C. Thermal cure up to 240 °C of the copolymer films afforded homogenous transparent films with improved thermal properties. Tough cured film was obtained by the copolymerization with MMA, while a tough and flexible film was obtained by the copolymerization with BuA.

Which hydrogen atom of toluene protonates PAH molecules in (+)-mode APPI MS analysis?

Science.gov (United States)

Ahmed, Arif; Ghosh, Manik Kumer; Choi, Myung Chul; Choi, Cheol Ho; Kim, Sunghwan

2013-03-01

A previous study (Ahmed, A. et al., Anal. Chem. 84, 1146-1151( 2012) reported that toluene used as a solvent was the proton source for polyaromatic hydrocarbon compounds (PAHs) that were subjected to (+)-mode atmospheric-pressure photoionization. In the current study, the exact position of the hydrogen atom in the toluene molecule (either a methyl hydrogen or an aromatic ring hydrogen) involved in the formation of protonated PAH ions was investigated. Experimental analyses of benzene and anisole demonstrated that although the aromatic hydrogen atom of toluene did not contribute to the formation of protonated anthracene, it did contribute to the formation of protonated acridine. Thermochemical data and quantum mechanical calculations showed that the protonation of anthracene by an aromatic ring hydrogen atom of toluene is endothermic, while protonation by a methyl hydrogen atom is exothermic. However, protonation of acridine by either an aromatic ring hydrogen or a methyl hydrogen atom of toluene is exothermic. The different behavior of acridine and anthracene was attributed to differences in gas-phase basicity. It was concluded that both types of hydrogen in toluene can be used for protonation of PAH compounds, but a methyl hydrogen atom is preferred, especially for non-basic compounds.

Thermal stability and mechanism of decomposition of emulsion explosives in the presence of pyrite.

Science.gov (United States)

Xu, Zhi-Xiang; Wang, Qian; Fu, Xiao-Qi

2015-12-30

The reaction of emulsion explosives (ammonium nitrate) with pyrite was studied using techniques of TG-DTG-DTA. TG-DSC-MS was also used to analyze samples thermal decomposition process. When a mixture of pyrite and emulsion explosives was heated at a constant heating rate of 10K/min from room temperature to 350°C, exothermic reactions occurred at about 200°C. The essence of reaction between emulsion explosives and pyrite is the reaction between ammonium nitrate and pyrite. Emulsion explosives have excellent thermal stability but it does not mean it showed the same excellent thermal stability when pyrite was added. Package emulsion explosives were more suitable to use in pyrite shale than bulk emulsion explosives. The exothermic reaction was considered to take place between ammonium nitrate and pyrite where NO, NO2, NH3, SO2 and N2O gases were produced. Based on the analysis of the gaseous, a new overall reaction was proposed, which was thermodynamically favorable. The results have significant implication in the understanding of stability of emulsion explosives in reactive mining grounds containing pyrite minerals. Copyright © 2015 Elsevier B.V. All rights reserved.

Ferroelectricity of strained SrTiO3 in lithium tetraborate glass-nanocomposite and glass-ceramic

Science.gov (United States)

Abdel-Khalek, E. K.; Mohamed, E. A.; Kashif, I.

2018-02-01

Glass-nanocomposite (GNCs) sample of the composition [90Li2B4O7-10SrTiO3] (mol %) was prepared by conventional melt quenching technique. The glassy phase and the amorphous nature of the GNCs sample were identified by Differential thermal analysis (DTA) and X-ray diffraction (XRD) studies, respectively. DTA of the GNCs exhibits sharp and broad exothermic peaks which represent the crystallization of Li2B4O7 and SrTiO3, respectively. The tetragonal Li2B4O7 and tetragonal SrTiO3 crystalline phases in glass-ceramic (GC) were identified by XRD and scanning electron microscopic (SEM). The strain tetragonal SrTiO3 phase in GNCs and GC has been confirmed by SEM. The values of crystallization activation energies (Ec1 and Ec2) for the first and second exothermic peaks are equal to 174 and 1452 kJ/mol, respectively. The Ti3+ ions in tetragonal distorted octahedral sites in GNCs were identified by optical transmission spectrum. GNCs and GC samples exhibit broad dielectric anomalies at 303 and 319 K because of strained SrTiO3 ferroelectric, respectively.

Enthalpies of proton adsorption onto Bacillus licheniformis at 25, 37, 50, and 75 °C

Science.gov (United States)

Gorman-Lewis, Drew

2011-03-01

Understanding bacterial surface reactivity requires many different lines of investigation. Toward this end, we used isothermal titration calorimetry to measure heats of proton adsorption onto a Gram positive thermophile Bacillus licheniformis at 25, 37, 50, and 75 °C. Proton adsorption under all conditions exhibited exothermic heat production. Below pH 4.5, exothermic heats decreased as temperature increased above 37 °C; above pH 4.5, there was no significant difference in heats evolved at the temperatures investigated. Total proton uptake did not vary significantly with temperature. Site-specific enthalpies and entropies were calculated by applying a 4-site, non-electrostatic surface complexation model to the calorimetric data. Interpretation of site-specific enthalpies and entropies of proton adsorption for site L1, L2, and L4 are consistent with previous interpretations of phosphoryl, carboxyl, and hydroxyl/amine site-identities, respectively, and with previous calorimetric measurements of proton adsorption onto mesophilic species. Enthalpies and entropies for surface site L3 are not consistent with the commonly inferred phosphoryl site-identity and are more consistent with sulfhydryl functional groups. These results reveal intricacies of surface reactivity that are not detectable by other methods.

Development of in-situ ZrC reinforced iron based composites for wear resistance applications

International Nuclear Information System (INIS)

Bandyopadhyay, T.K.; Das, K.

2002-01-01

A common objective behind the processing of iron-based composites is to improve the wear resistance of steels by incorporating some reinforcing phases, e.g., carbides and oxides. In the present investigation, iron-based zirconium carbide reinforced composite is produced by the aluminothermic reduction of zircon sand (ZrSiO 4 ) and blue dust (Fe 2 O 3 ) in the presence of carbon. Aluminothermic reduction of blue dust and zircon sand, being highly exothermic in nature, essentially leads to a self-propagating high-temperature synthesis (SHS) of the Fe-ZrC composite. The as-cast composite is characterized by scanning electron microscopy (SEM) and X-ray diffraction (XRD). The mechanical properties of the composite and the effect of heat treatment on the microstructure are evaluated. The composite possess sufficient hardness and promising abrasive wear resistance property. The abrasive wear resistance property of the Fe-ZrC composite is compared with that of a M2 grade tool material and it is found to be better than the tool material. The composite also possess good high temperature stability. (author)

The probability of containment failure by direct containment heating in surry

International Nuclear Information System (INIS)

Pilch, M.M.; Allen, M.D.; Bergeron, K.D.; Tadios, E.L.; Stamps, D.W.; Spencer, B.W.; Quick, K.S.; Knudson, D.L.

1995-05-01

In a light-water reactor core melt accident, if the reactor pressure vessel (RPV) fails while the reactor coolant system (RCS) at high pressure, the expulsion of molten core debris may pressurize the reactor containment building (RCB) beyond its failure pressure. A failure in the bottom head of the RPV, followed by melt expulsion and blowdown of the RCS, will entrain molten core debris in the high-velocity steam blowdown gas. This chain of events is called a high-pressure melt ejection (HPME). Four mechanisms may cause a rapid increase in pressure and temperature in the reactor containment: (1) blowdown of the RCS, (2) efficient debris-to-gas heat transfer, (3) exothermic metal-steam and metal-oxygen reactions, and (4) hydrogen combustion. These processes, which lead to increased loads on the containment building, are collectively referred to as direct containment heating (DCH). It is necessary to understand factors that enhance or mitigate DCH because the pressure load imposed on the RCB may lead to early failure of the containment

Preliminary analysis of the inclusion of security passive systems to reduce the impact of accidents in nuclear power plants; Analisis preliminar de la inclusion de sistemas pasivos de seguridad para reducir el impacto de accidentes en centrales nucleares

Energy Technology Data Exchange (ETDEWEB)

Sanchez J, J.; Morales S, J. B. [UNAM, Facultad de Ingenieria, Circuito Interior, Ciudad Universitaria, 04510 Mexico D. F. (Mexico); Espinosa P, G., E-mail: jersonsanchez@gmail.com [Universidad Autonoma Metropolitana, Unidad Iztapalapa, Av. San Rafael Atlixco 186, Col. Vicentina, 09340 Mexico D. F. (MX)

2011-11-15

In this work is presented a conceptual analysis of possible benefits and limitations that potentially represents the introduction of security passive systems to reduce the events impact of very low probability and high risk to the systems of radioactive material confinement of a light water reactor. These events are related with the possibility that a hydrogen explosion is presented as consequence of the accumulation of the same hydrogen in the contention of the reactor, in a scenario of severe accident. This accumulated hydrogen can be liberated in the reactor building or primary contention, where the conditions of their atmosphere make but prone the combustion. The catalytic recombination represents a viable option for the hydrogen concentrations decrease and because this recombination is highly exothermic, is important to analyze and to know if the recombined vapor to high temperature can be used in combination with vapor injectors that in turn, they are passive systems. In the following sections an explanation is presented about the use of the mentioned systems, as well as some results on the behavior of the vapor injectors. (Author)

Preliminary analysis of the inclusion of security passive systems to reduce the impact of accidents in nuclear power plants

International Nuclear Information System (INIS)

Sanchez J, J.; Morales S, J. B.; Espinosa P, G.

2011-11-01

In this work is presented a conceptual analysis of possible benefits and limitations that potentially represents the introduction of security passive systems to reduce the events impact of very low probability and high risk to the systems of radioactive material confinement of a light water reactor. These events are related with the possibility that a hydrogen explosion is presented as consequence of the accumulation of the same hydrogen in the contention of the reactor, in a scenario of severe accident. This accumulated hydrogen can be liberated in the reactor building or primary contention, where the conditions of their atmosphere make but prone the combustion. The catalytic recombination represents a viable option for the hydrogen concentrations decrease and because this recombination is highly exothermic, is important to analyze and to know if the recombined vapor to high temperature can be used in combination with vapor injectors that in turn, they are passive systems. In the following sections an explanation is presented about the use of the mentioned systems, as well as some results on the behavior of the vapor injectors. (Author)

Influence of uranium hydride oxidation on uranium metal behaviour

International Nuclear Information System (INIS)

Patel, N.; Hambley, D.; Clarke, S.A.; Simpson, K.

2013-01-01

This work addresses concerns that the rapid, exothermic oxidation of active uranium hydride in air could stimulate an exothermic reaction (burning) involving any adjacent uranium metal, so as to increase the potential hazard arising from a hydride reaction. The effect of the thermal reaction of active uranium hydride, especially in contact with uranium metal, does not increase in proportion with hydride mass, particularly when considering large quantities of hydride. Whether uranium metal continues to burn in the long term is a function of the uranium metal and its surroundings. The source of the initial heat input to the uranium, if sufficient to cause ignition, is not important. Sustained burning of uranium requires the rate of heat generation to be sufficient to offset the total rate of heat loss so as to maintain an elevated temperature. For dense uranium, this is very difficult to achieve in naturally occurring circumstances. Areas of the uranium surface can lose heat but not generate heat. Heat can be lost by conduction, through contact with other materials, and by convection and radiation, e.g. from areas where the uranium surface is covered with a layer of oxidised material, such as burned-out hydride or from fuel cladding. These rates of heat loss are highly significant in relation to the rate of heat generation by sustained oxidation of uranium in air. Finite volume modelling has been used to examine the behaviour of a magnesium-clad uranium metal fuel element within a bottle surrounded by other un-bottled fuel elements. In the event that the bottle is breached, suddenly, in air, it can be concluded that the bulk uranium metal oxidation reaction will not reach a self-sustaining level and the mass of uranium oxidised will likely to be small in relation to mass of uranium hydride oxidised. (authors)

Reactive Desorption of CO Hydrogenation Products under Cold Pre-stellar Core Conditions

Science.gov (United States)

Chuang, K.-J.; Fedoseev, G.; Qasim, D.; Ioppolo, S.; van Dishoeck, E. F.; Linnartz, H.

2018-02-01

The astronomical gas-phase detection of simple species and small organic molecules in cold pre-stellar cores, with abundances as high as ∼10‑8–10‑9 n H, contradicts the generally accepted idea that at 10 K, such species should be fully frozen out on grain surfaces. A physical or chemical mechanism that results in a net transfer from solid-state species into the gas phase offers a possible explanation. Reactive desorption, i.e., desorption following the exothermic formation of a species, is one of the options that has been proposed. In astronomical models, the fraction of molecules desorbed through this process is handled as a free parameter, as experimental studies quantifying the impact of exothermicity on desorption efficiencies are largely lacking. In this work, we present a detailed laboratory study with the goal of deriving an upper limit for the reactive desorption efficiency of species involved in the CO–H2CO–CH3OH solid-state hydrogenation reaction chain. The limit for the overall reactive desorption fraction is derived by precisely investigating the solid-state elemental carbon budget, using reflection absorption infrared spectroscopy and the calibrated solid-state band-strength values for CO, H2CO and CH3OH. We find that for temperatures in the range of 10 to 14 K, an upper limit of 0.24 ± 0.02 for the overall elemental carbon loss upon CO conversion into CH3OH. This corresponds with an effective reaction desorption fraction of ≤0.07 per hydrogenation step, or ≤0.02 per H-atom induced reaction, assuming that H-atom addition and abstraction reactions equally contribute to the overall reactive desorption fraction along the hydrogenation sequence. The astronomical relevance of this finding is discussed.

Molar enthalpy of mixing and refractive indices of choline chloride-based deep eutectic solvents with water

International Nuclear Information System (INIS)

Ma, Chunyan; Guo, Yanhua; Li, Dongxue; Zong, Jianpeng; Ji, Xiaoyan; Liu, Chang

2017-01-01

Highlights: • Molar enthalpy of mixing and refractive indices for binary mixtures of different deep eutectic solvents with water. • The Redlich–Kister equation and the NRTL model was used to fit the experimental data. • The NRTL model with fitted parameters were used to predict the vapour pressure and compared with experimental data. - Abstract: The molar enthalpies of mixing were measured for binary systems of choline chloride-based deep eutectic solvents (glycerol, ethylene glycol and malonic acid) with water at 298.15 K and 308.15 K, and atmospheric pressure with an isothermal calorimeter. Refractive indices were also measured at 303.15 K and atmospheric pressure. The binary mixtures of {chcl/glycerol (1:2) + water, chcl/ethylene glycol (1:2) + water} showed exothermic behaviour over the entire range of composition, while the binary mixture of {chcl/malonic acid (1:1) + water} showed endothermic behaviour at first and then changed to be exothermic with the increasing content of chcl/malonic acid (1:1). Experimental refractive indices were fitted with the Redlich–Kister equation, and experimental molar enthalpies of mixing were correlated with the Redlich–Kister equation and the non-random two-liquid (NRTL) model. The NRTL model with the fitted parameters was used to predict the vapour pressures of these three mixtures. For mixtures of {chcl/glycerol (1:2) + water} and {chcl/ethylene glycol (1:2) + water}, the predicted vapour pressures agreed well with the experimental results from the literature. While for mixture of {chcl/malonic acid (1:1) + water}, the predicted vapour pressures showed deviation at the high concentration of chcl/malonic acid (1:1), and this was probably because of the complex molecular interaction between chcl/malonic acid (1:1) and water.

Comparison of Spirulina platensis microalgae and commercial activated carbon as adsorbents for the removal of Reactive Red 120 dye from aqueous effluents

International Nuclear Information System (INIS)

Cardoso, Natali F.; Lima, Eder C.; Royer, Betina; Bach, Marta V.; Dotto, Guilherme L.; Pinto, Luiz A.A.; Calvete, Tatiana

2012-01-01

Highlights: ► Spirulina platensis (SP) and activated carbon (AC) were used to remove RR-120 dye. ► The maximum adsorption capacities were found at pH 2 and 298 K. ► The values were 482.2 and 267.2 mg g −1 for SP and AC, respectively. ► Adsorption was exothermic, spontaneous and favorable. ► SP and AC were effective to treat a simulated dye-house effluent. - Abstract: Spirulina platensis microalgae (SP) and commercial activated carbon (AC) were compared as adsorbents to remove Reactive Red 120 (RR-120) textile dye from aqueous effluents. The batch adsorption system was evaluated in relation to the initial pH, contact time, initial dye concentration and temperature. An alternative kinetic model (general order kinetic model) was compared with the traditional pseudo-first order and pseudo-second order kinetic models. The equilibrium data were fitted to the Langmuir, Freundlich and Liu isotherm models, and the thermodynamic parameters were also estimated. Finally, the adsorbents were employed to treat a simulated dye-house effluent. The general order kinetic model was more appropriate to explain RR-120 adsorption by SP and AC. The equilibrium data were best fitted to the Liu isotherm model. The maximum adsorption capacities of RR-120 dye were found at pH 2 and 298 K, and the values were 482.2 and 267.2 mg g −1 for the SP and AC adsorbents, respectively. The thermodynamic study showed that the adsorption was exothermic, spontaneous and favourable. The SP and AC adsorbents presented good performance for the treatment of simulated industrial textile effluents, removing 94.4–99.0% and 93.6–97.7%, respectively, of the dye mixtures containing high saline concentrations.

Thermochemistry of rare earth doped uranium oxides Ln{sub x}U{sub 1−x}O{sub 2−0.5x+y} (Ln = La, Y, Nd)

Energy Technology Data Exchange (ETDEWEB)

Zhang, Lei; Navrotsky, Alexandra, E-mail: anavrotsky@ucdavis.edu

2015-10-15

Lanthanum, yttrium, and neodymium doped uranium dioxide samples in the fluorite structure have been synthesized, characterized in terms of metal ratio and oxygen content, and their enthalpies of formation measured by high temperature oxide melt solution calorimetry. For oxides doped with 10–50 mol % rare earth (Ln) cations, the formation enthalpies from constituent oxides (LnO{sub 1.5}, UO{sub 2} and UO{sub 3} in a reaction not involving oxidation or reduction) become increasingly exothermic with increasing rare earth content, while showing no significant dependence on the varying uranium oxidation state. The oxidation enthalpy of Ln{sub x}U{sub 1−x}O{sub 2−0.5x+y} is similar to that of UO{sub 2} to UO{sub 3} for all three rare earth doped systems. Though this may suggest that the oxidized uranium in these systems is energetically similar to that in the hexavalent state, thermochemical data alone can not constrain whether the uranium is present as U{sup 5+}, U{sup 6+}, or a mixture of oxidation states. The formation enthalpies from elements calculated from the calorimetric data are generally consistent with those from free energy measurements. - Highlights: • We synthesize, characterize Ln{sub x}U{sub 1−x}O{sub 2−0.5x+y} solid solutions (Ln = La, Y, Nd). • Formation enthalpies become more exothermic with increasing rare earth content. • Oxidation enthalpy of Ln{sub x}U{sub 1−x}O{sub 2−0.5x+y} is similar to that of UO{sub 2} to UO{sub 3}. • Direct calorimetric measurements are in good agreement with free energy data.

Influence of uranium hydride oxidation on uranium metal behaviour

Energy Technology Data Exchange (ETDEWEB)

Patel, N.; Hambley, D. [National Nuclear Laboratory (United Kingdom); Clarke, S.A. [Sellafield Ltd (United Kingdom); Simpson, K.

2013-07-01

This work addresses concerns that the rapid, exothermic oxidation of active uranium hydride in air could stimulate an exothermic reaction (burning) involving any adjacent uranium metal, so as to increase the potential hazard arising from a hydride reaction. The effect of the thermal reaction of active uranium hydride, especially in contact with uranium metal, does not increase in proportion with hydride mass, particularly when considering large quantities of hydride. Whether uranium metal continues to burn in the long term is a function of the uranium metal and its surroundings. The source of the initial heat input to the uranium, if sufficient to cause ignition, is not important. Sustained burning of uranium requires the rate of heat generation to be sufficient to offset the total rate of heat loss so as to maintain an elevated temperature. For dense uranium, this is very difficult to achieve in naturally occurring circumstances. Areas of the uranium surface can lose heat but not generate heat. Heat can be lost by conduction, through contact with other materials, and by convection and radiation, e.g. from areas where the uranium surface is covered with a layer of oxidised material, such as burned-out hydride or from fuel cladding. These rates of heat loss are highly significant in relation to the rate of heat generation by sustained oxidation of uranium in air. Finite volume modelling has been used to examine the behaviour of a magnesium-clad uranium metal fuel element within a bottle surrounded by other un-bottled fuel elements. In the event that the bottle is breached, suddenly, in air, it can be concluded that the bulk uranium metal oxidation reaction will not reach a self-sustaining level and the mass of uranium oxidised will likely to be small in relation to mass of uranium hydride oxidised. (authors)