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Sample records for char structure properties

  1. Study on pore structure properties of steam activated biomass chars

    Energy Technology Data Exchange (ETDEWEB)

    Shu, Tong; Lu, Fei; Wang, Qinchao; Lu, Ping [Nanjing Normal Univ. (China). School of Energy and Mechanical Engineering

    2013-07-01

    Wheat straw and rice husk chars were prepared in a fixed bed reactor at different pyrolysis temperatures (673, 873 and 1,073K) and different pyrolysis procedure. The steam activated chars were also prepared in a fixed bed reactor at the following conditions: activation temperature is 1,073K, the flow rate of N{sub 2} is 5L/min, and N{sub 2} and H{sub 2}O molar ratio is 1:1. The specific surface area, pore structure and micro-morphology of different kinds of prepared biomass chars were measured by NOVA1000e analysis instrument and JSM-5610LV scanning electron microscopy (SEM), respectively. Results indicated that the internal structure was improved significantly by steam activation through enlarging the specific surface area and enriching the porosity. The wheat straw char prepared by both rapid pyrolysis at 873K and activation by steam is better than others, whose DR surface area increases from 3.10 to 1099.99m{sup 2}/g. The N{sub 2} adsorption volume of steam activated biomass chars has been significant promoted.

  2. Thermogravimetric study on the influence of structural, textural and chemical properties of biomass chars on CO2 gasification reactivity

    International Nuclear Information System (INIS)

    Bouraoui, Zeineb; Jeguirim, Mejdi; Guizani, Chamseddine; Limousy, Lionel; Dupont, Capucine; Gadiou, Roger

    2015-01-01

    The present investigation aims to examine the influence of textural, structural and chemical properties of biomass chars on the CO 2 gasification rate. Various lignocellulosic biomass chars were prepared under the same conditions. Different analytical techniques were used to determine the char properties such as Scanning Electronic Microscopy, nitrogen adsorption manometry, Raman spectroscopy and X Ray Fluorescence. Gasification tests were carried out in a thermobalance under 20% CO 2 in nitrogen at 800 °C. Significant differences of the total average reactivity were observed with a factor of 2 between the prepared chars. Moreover, different behaviors of gasification rate profiles versus conversion were obtained. This difference of behavior appeared to be correlated with the biomass char properties. Hence, up to 70% of conversion, the gasification rate was shown to depend on the char external surface and the potassium content. At higher conversion ratio, a satisfactory correlation between the Catalytic Index and the average gasification rate was identified. The results highlight the importance of knowing both textural and structural properties and mineral contents of biomass chars to predict fuel reactivity during CO 2 gasification processes. Such behavior prediction is highly important in the gasifiers design for char conversion. - Highlights: • CO 2 gasification reactivity of various lignocellulosic chars were examined. • Chars properties affect strongly samples gasification behavior. • Initial gasification rate is affected by external surface, K content and D3/G ratio. • Gasification rate behavior depends on the Alkali index at high conversion

  3. Influence of char structure on reactivity and nitric oxide emissions

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    Arenillas, Ana; Rubiera, Fernando; Parra, Jose B.; Pis, Jose J. [Department of Energy and Environment, Instituto Nacional del Carbon, CSIC, Apartado 73, 33080 Oviedo (Spain)

    2002-06-20

    The aim of this study was to investigate the influence of coal rank and operating conditions during coal pyrolysis on the resultant char texture properties, morphology and reactivity. A range of bituminous coals were pyrolysed in a fixed bed reactor at different heating rates. It was found that the higher the heating rate and the lower the coal rank, the more microporous chars were obtained. Isothermal (500 C) gasification in 20% oxygen in argon of the chars was carried out using a differential thermogravimetric system (DTG). The results of this work indicated that the increase in the availability of char-active surface sites led to an increase in char reactivity, not only for oxygen but also for other reactive gases, in particular NO, diminishing emissions during the combustion process.

  4. Temperature induced development of porous structure of bituminous coal chars at high pressure

    Directory of Open Access Journals (Sweden)

    Natalia Howaniec

    2016-01-01

    Full Text Available The porous structure of chars affects their reactivity in gasification, having an impact on the course and product distribution of the process. The shape, size and connections between pores determine the mechanical properties of chars, as well as heat and mass transport in thermochemical processing. In the study the combined effects of temperature in the range of 973–1273 °K and elevated pressure of 3 MPa on the development of porous structure of bituminous coal chars were investigated. Relatively low heating rate and long residence time characteristic for the in-situ coal conversion were applied. The increase in the temperature to 1173 °K under pressurized conditions resulted in the enhancement of porous structure development reflected in the values of the specific surface area, total pore volume, micropore area and volume, as well as ratio of the micropore volume to the total pore volume. These effects were attributed to the enhanced vaporization and devolatilization, as well as swelling behavior along the increase of temperature and under high pressure, followed by a collapse of pores over certain temperature value. This proves the strong dependence of the porous structure of chars not only on the pyrolysis process conditions but also on the physical and chemical properties of the parent fuel.

  5. Relation between coal rank, char reactivity, textural properties and NO emissions

    Energy Technology Data Exchange (ETDEWEB)

    Arenillas, A.; Rubiera, F.; Parra, J.B.; Pis, J.J. [Instituto Nacional del Carbon, Oviedo (Spain)

    1999-07-01

    A low volatile bituminous coal was pyrolysed at different heating rates to produce chars with different textural properties. There was a linear relationship between char reactivity and active surface area. The effect of coal rank on coal char textural properties was studied using a range of bituminous coals. The influence of textural properties and reactivity on NO emissions, and on the heterogeneous reduction of NO is discussed. 6 refs., 2 figs., 2 tabs.

  6. Porous structure and morphology of granular chars from flash and conventional pyrolysis of grape seeds

    International Nuclear Information System (INIS)

    Jimenez-Cordero, Diana; Heras, Francisco; Alonso-Morales, Noelia; Gilarranz, Miguel A.; Rodriguez, Juan J.

    2013-01-01

    This work studies the influence of the operating conditions used in the pyrolysis of grape seeds on the morphology and textural properties of the chars resulting. Flash and conventional (283 K min −1 heating rate) pyrolysis have been used within a wide range of temperature (300–1000 °C). The effect of a pretreatment for oil extraction has also been studied. The porous structure of the chars was characterized by adsorption of N 2 at 77 K, Ar at 77 K and 87 K, and CO 2 at 273 K and mercury intrusion porosimetry. The morphology was analyzed by scanning electron microscopy. All the materials prepared revealed an essentially microporous structure, with a poor or even negligible contribution of mesopores. Increasing pyrolysis temperature led to higher specific surface areas and lower pore size. The highest specific surface area values occurred within 700–800 °C, reaching up to 500 m 2 g −1 with pore sizes in the 0.4–1.1 nm range. No significant morphological changes were observed upon carbonization so that the resulting chars were granular materials of similar size than the starting grape seeds. The hollow core structure of the chars, with most of the material allocated at the periphery of the granules can help to overcome the mass transfer limitations of most common (solid or massive) granular activated carbons. The chars showed a good mechanical strength during attrition tests. These chars can be potential candidates for the preparation of granular carbons molecular sieve or activated carbons raw materials. -- Highlights: •We use a raw material that has a very low price and a high availability. •Not very much attention has been paid to this waste for carbonaceous materials preparation. •The chars obtained have high specific surface area that is an interesting starting point for later activation processes. •The chars show a micro-macro porous bimodal distribution. •Pyrolysis does not affect to morphology or initial seed, leading a carbonized

  7. Influence of pyrolysis conditions on the structure and gasification reactivity of biomass chars

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    E. Cetin; B. Moghtaderi; R. Gupta; T.F. Wall [University of Newcastle, Callaghan, NSW (Australia). Discipline of Chemical Engineering, Faculty of Engineering and Built Environment, School of Engineering

    2004-11-01

    The physical and chemical structure as well as gasification reactivities of chars generated from several biomass species (i.e. pinus radiata, eucalyptus maculata and sugar cane bagasse) were studied to gain insight into the role of heating rate and pressure on the gasification characteristics of biomass chars. Char samples were generated in a suite of reactors including a wire mesh reactor, a tubular reactor, and a drop tube furnace. Scanning electron microscopy analysis, X-ray diffractometry, digital cinematography and surface area analysis were employed to determine the impact of operating conditions on the char structure. The global gasification reactivities of char samples were also determined for a range of pressures between 1 and 20 bar using pressurised thermogravimetric analysis technique. Char reactivities were found to increase with increasing pyrolysis heating rates and decreasing pyrolysis pressure. It was found that under high heating rates the char particles underwent plastic deformation (i.e. melted) developing a structure different to that of the virgin biomass. Pressure was also found to influence the physical and chemical structures of char particles. The difference in the gasification reactivities of biomass chars at pressure was found to correlate well with the effect of pyrolysis pressure on the graphitisation process in the biomass char structure. 29 refs., 18 figs., 2 tabs.

  8. The effect of char structure on burnout during pulverized coal combustion at pressure

    Energy Technology Data Exchange (ETDEWEB)

    Liu, G.; Wu, H.; Benfell, K.E.; Lucas, J.A.; Wall, T.F.

    1999-07-01

    An Australian bituminous coal sample was burnt in a drop tube furnace (DTF) at 1 atm and a pressurized drop tube furnace (PDTF) at 15 atm. The char samples were collected at different burnout levels, and a scanning electron microscope was used to examine the structures of chars. A model was developed to predict the burnout of char particles with different structures. The model accounts for combustion of the thin-walled structure of cenospheric char and its fragmentation during burnout. The effect of pressure on reaction rate was also considered in the model. As a result, approximately 40% and 70% cenospheric char particles were observed in the char samples collected after coal pyrolysis in the DTF and PDTF respectively. A large number of fine particles (< 30 mm) were observed in the 1 atm char samples at burnout levels between 30% and 50%, which suggests that significant fragmentation occurred during early combustion. Ash particle size distributions show that a large number of small ash particles formed during burnout at high pressure. The time needed for 70% char burnout at 15 atm is approximately 1.6 times that at 1 atm under the same temperature and gas environment conditions, which is attributed to the different pressures as well as char structures. The overall reaction rate for cenospheric char was predicted to be approximately 2 times that of the dense chars, which is consistent with previous experimental results. The predicted char burnout including char structures agrees reasonably well with the experimental measurements that were obtained at 1 atm and 15 atm pressures.

  9. Comparison of char structural characteristics and reactivity during conventional air and oxy-fuel combustion

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    Liu, Xiaowei; Xu, Minghou; Yao, Hong; Gu, Ying; Si, Junping; Xiong, Chao [Huazhong Univ. of Science and Technology, Wuhan (China). State Key Lab. of Coal Combustion

    2013-07-01

    The capture and sequestration of CO{sub 2} generated from large- scale stationary power plants is considered to be one of the leading technologies that could potentially have a significant impact on reducing greenhouse emissions. Among these emerging technologies, the oxy-fuel combustion is a near-zero emission technology that can be adapted to both new and existing pulverized coal-fired power stations. The goal of this work is to make a comparative study on char structural characteristics (including char yield, swelling ratio, BET surface area, pore distribution, morphology) and reactivity during conventional air and oxy-fuel combustion. Specific experimental designs include two series. One is carried out in pure N{sub 2} and CO{sub 2} (pyrolysis experiments), and another is prepared in N{sub 2} + 5%O{sub 2} and CO{sub 2} + 5%O{sub 2}. Coal samples included raw coal, low density fraction coal and medium density fraction coal in all experiments. The present study is a further effort to extend our knowledge about physical and chemical structural characteristics and reactivity of char in the presence of high concentration CO{sub 2}. Combustion and pyrolysis of a density fractionated China coal at drop tube furnace yielded the following conclusions. Compared to oxy-chars obtained under pure CO{sub 2} atmosphere, the swelling ratios of char obtained in pure N{sub 2} atmosphere are higher. When adding 5%O{sub 2}, experimental results are completely different with those of the pyrolysis experiment. In comparison with the oxy-chars obtained under CO{sub 2} + 5%O{sub 2} atmosphere, the swelling ratios of the char obtained in N{sub 2} + 5%O{sub 2} atmosphere are lower. In the pyrolysis experiment, the BET surfaces Area of the oxy-chars are about 10-20 times as much as chars. When adding 5%O{sub 2}, the BET surfaces Area of the oxy-chars are about two to four times as much as chars. During pyrolysis experiment, the total pore volumes of the oxy-chars obtained under pure CO

  10. Effect of pyrolysis pressure and heating rate on radiata pine char structure and apparent gasification reactivity

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    E. Cetin; R. Gupta; B. Moghtaderi [University of Newcastle, Callaghan, NSW (Australia). Discipline of Chemical Engineering, Faculty of Engineering and Built Environment, School of Engineering

    2005-07-01

    The knowledge of biomass char gasification kinetics has considerable importance in the design of advanced biomass gasifiers, some of which operate at high pressure. The char gasification kinetics themselves are influenced by char structure. In this study, the effects of pyrolysis pressure and heating rate on the char structure were investigated using scanning electron microscopy (SEM) analysis, digital cinematography, and surface area analysis. Char samples were prepared at pressures between 1 and 20 bar, temperatures ranging from 800 to 1000{degree}C, and heating rates between 20 and 500{degree}C/s. Our results indicate that pyrolysis conditions have a notable impact on the biomass char morphology. Pyrolysis pressure, in particular, was found to influence the size and the shape of char particles while high heating rates led to plastic deformation of particles (i.e. melting) resulting in smooth surfaces and large cavities. The global gasification reactivities of char samples were also determined using thermogravimetric analysis (TGA) technique. Char reactivities were found to increase with increasing pyrolysis heating rates and decreasing pyrolysis pressure. 22 refs., 8 figs., 2 tabs.

  11. Effects of Biomass Feedstocks and Gasification Conditions on the Physiochemical Properties of Char

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    Raymond L. Huhnke

    2013-08-01

    Full Text Available Char is a low-value byproduct of biomass gasification and pyrolysis with many potential applications, such as soil amendment and the synthesis of activated carbon and carbon-based catalysts. Considering these high-value applications, char could provide economic benefits to a biorefinery utilizing gasification or pyrolysis technologies. However, the properties of char depend heavily on biomass feedstock, gasifier design and operating conditions. This paper reports the effects of biomass type (switchgrass, sorghum straw and red cedar and equivalence ratio (0.20, 0.25 and 0.28, i.e., the ratio of air supply relative to the air that is required for stoichiometric combustion of biomass, on the physiochemical properties of char derived from gasification. Results show that the Brunauer-Emmett-Teller (BET surface areas of most of the char were 1–10 m2/g and increased as the equivalence ratio increased. Char moisture and fixed carbon contents decreased while ash content increased as equivalence ratio increased. The corresponding Fourier Transform Infrared spectra showed that the surface functional groups of char differed between biomass types but remained similar with change in equivalence ratio.

  12. Structural evolution of biomass char and its effect on the gasification rate

    DEFF Research Database (Denmark)

    Fatehi, Hesameddin; Bai, Xue Song

    2017-01-01

    The evolution of char porous structure can affect the conversion rate of the char by affecting the intra-particle transport, especially in the zone II conversion regime. A multi-pore model based on the capillary pore theory is developed to take into account different conversion rates for pores wi...

  13. Properties of gasification-derived char and its utilization for catalytic tar reforming

    Science.gov (United States)

    Qian, Kezhen

    Char is a low-value byproduct of biomass gasification and pyrolysis with many potential applications, such as soil amendment and the synthesis of activated carbon. The overall goal of the proposed research was to develop novel methods to use char derived from gasification for high-value applications in syngas conditioning. The first objective was to investigate effects of gasification condition and feedstock on properties of char derived from fluidized bed gasification. Results show that the surface areas of most of the char were 1--10 m 2/g and increased as the equivalence ratio increased. Char moisture and fixed carbon contents decreased while ash content increased as equivalence ratio increased. The next objective was to study the properties of sorghum and red cedar char derived from downdraft gasifier. Red cedar char contained more aliphatic carbon and o-alkyl carbon than sorghum char. Char derived from downdraft gasification had higher heating values and lower ash contents than char derived from fluidized bed gasification. The gasification reactivity of red cedar char was higher than that of sorghum char. Then, red cedar char based catalysts were developed with different preparation method to reform toluene and naphthalene as model tars. The catalyst prepared with nickel nitrate was found to be better than that with nickel acetate. The nickel particle size of catalyst impregnated with nickel nitrate was smaller than that of catalyst impregnated with nickel acetate. The particle size of catalyst impregnated with nickel acetate decreased by hydrazine reduction. The catalyst impregnated with nickel nitrate had the highest toluene removal efficiency, which was 70%--100% at 600--800 °C. The presence of naphthalene in tar reduced the catalyst efficiency. The toluene conversion was 36--99% and the naphthalene conversion was 37%--93% at 700--900 °C. Finally, effects of atmosphere and pressure on catalytic reforming of lignin-derived tars over the developed catalyst

  14. Investigation of char strength and expansion properties of an intumescent coating exposed to rapid heating rates

    DEFF Research Database (Denmark)

    Nørgaard, Kristian Petersen; Dam-Johansen, Kim; Català, Pere

    2013-01-01

    , char properties, measured at room temperature, were dependent on the preceding storage conditions (in air or in a desiccator). The char was found to have the highest mechanical strength against compression in the outer crust facing the heat source. For thin (147μm) free coating films, a tendency...... with respect to the mechanical resistance against compression, degree of expansion, and residual mass fraction. Experimental results show that when using this type of shock heating, the mechanical resistance of the char against compression cannot meaningfully be correlated to the expansion factor. In addition...

  15. Influence of post-treatment strategies on the properties of activated chars from broiler manure.

    Science.gov (United States)

    Lima, Isabel M; Boykin, Debbie L; Thomas Klasson, K; Uchimiya, Minori

    2014-01-01

    There are a myriad of carbonaceous precursors that can be used advantageously to produce activated carbons or chars, due to their low cost, availability and intrinsic properties. Because of the nature of the raw material, production of granular activated chars from broiler manure results in a significant ash fraction. This study was conducted to determine the influence of several pre- and post-treatment strategies in various physicochemical and adsorptive properties of the resulting activated chars. Pelletized samples of broiler litter and cake were pyrolyzed at 700 °C for 1h followed by a 45 min steam activation at 800 °C at different water flow rates from 1 to 5 mL min(-1). For each activation strategy, samples were either water-rinsed or acid-washed and rinsed or used as is (no acid wash/rinse). Activated char's physicochemical and adsorptive properties towards copper ions were selectively affected by both pre- and post-treatments. Percent ash reduction after either rinsing or acid washing ranged from 1.1 to 15.1% but washed activated chars were still alkaline with pH ranging from 8.4 to 9.1. Acid washing or water rinsing had no significant effect in the ability of the activated char to adsorb copper ions, however it significantly affected surface area, pH, ash content and carbon content. Instead, manure type (litter versus cake) and the activation water flow rate were determining factors in copper ion adsorption which ranged from 38 mg g(-1) to 104 mg g(-1) of activated char. Moreover, strong positive correlations were found between copper uptake and concentration of certain elements in the activated char such as phosphorous, sulfur, calcium and sodium. Rinsing could suffice as a post treatment strategy for ash reduction since no significant differences in the carbon properties were observed between rinsed and acid wash treatments. Published by Elsevier Ltd.

  16. Effect of chemical modification on reduction and sorptive properties of chars from hydropyrolysis of coal

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    Stanczyk, K.; Miga, K.; Fabis, G.; Jastrzab, K. [Polskiej Akademii Nauk, Gliwice (Poland)

    1998-01-01

    Hydropyrolysis of bituminous coal and lignite as way of synthesis of adsorbents has been applied. Chemical modification of chars based on simultaneous carbonization of coal and plastics containing sulfur and nitrogen has been carried out. It was stated that modified chars exhibit better reduction and sorptive properties than non-modified and that modified adsorbents made of lignite exceed commercial ones. 7 refs., 4 figs., 3 tabs.

  17. Effects of pressure on morphology and structure of bio-char from pressurized entrained-flow pyrolysis of microalgae

    Directory of Open Access Journals (Sweden)

    Kristina Maliutina

    2018-06-01

    Full Text Available The present dataset describes the entrained-flow pyrolysis of Microalgae Chlorella vulgaris and the results obtained during bio-char characterization. The dataset includes a brief explanation of the experimental procedure, experimental conditions and the influence of pyrolysis conditions on bio-chars morphology and carbon structure. The data show an increase in sphericity and surface smoothness of bio-chars at higher pressures and temperatures. Data confirmed that the swelling ratio of bio-chars increased with pressure up to 2.0 MPa. Consequently, changes in carbon structure of bio-chars were investigated using Raman spectroscopy. The data showed the increase in carbon order of chars at elevated pressures. Changes in the chemical structure of bio-char as a function of pyrolysis conditions were investigated using FTIR analysis. Keywords: Microalgae, Bio-char, Particle swelling, Pressurized pyrolysis

  18. Structural evolution of biomass char and its effect on the gasification rate

    International Nuclear Information System (INIS)

    Fatehi, Hesameddin; Bai, Xue-Song

    2017-01-01

    Highlights: • A comprehensive model was developed to describe the evolution of biomass char structure. • An effectiveness factor was used to account for the intra-particle chemical and physical processes. • The effect of the structural evolution of the multi-pore structure on biomass char reactivity was analyzed. • The multi-pore model yields results in satisfactory agreement with experiments. - Abstract: The evolution of char porous structure can affect the conversion rate of the char by affecting the intra-particle transport, especially in the zone II conversion regime. A multi-pore model based on the capillary pore theory is developed to take into account different conversion rates for pores with different radii. The model is valid for biomass chars produced under relatively low heating rates, when the original beehive structure of the biomass is not destroyed during the pyrolysis stage. The contribution of different pores with different radius is taken into account using an effectiveness factor presented for each pore radius with respect to different reactions. As the char conversion proceeds, the pore enlargement increases the contribution of micro-pores; consequently the effective surface area will increase. The increase in the effective surface area leads to an increased reactivity of char during the entire conversion process. This model is used to analyze the steam gasification process of biomass char of centimeter sizes. The results from the present multi-pore model are in better agreement with experimental data than those from a corresponding single pore model. Since the multi-pore model accommodates the detailed intra-particle transport, it is a useful basis toward developing a more predictive model for biomass char gasification.

  19. Structural and Compositional Transformations of Biomass Chars during Fast Pyrolysis

    DEFF Research Database (Denmark)

    Trubetskaya, Anna; Steibel, Markus; Spliethoff, Hartmut

    In this work the physical and chemical transformations of biomass chars during fast pyrolysis, considered as a 2nd stage of combustion, has been investigated. Seven biomasses containing different amount of ash and organic components were reacted at up to 1673 K with high heating rates in a wire...

  20. Effect of burn-off on physical and chemical properties of coal char; Gas ka shinko ni tomonau sekitan char no tokusei henka

    Energy Technology Data Exchange (ETDEWEB)

    Yamada, T.; Tamura, K.; Hashimoto, H.; Funaki, M.; Suzuki, T. [Kitami Institute of Technology, Hokkaido (Japan)

    1996-10-28

    For high-efficiency coal gasification, investigations were given on effect of coal chars with different conversion rates on coal gasification reactivity. In coal gasification, reactivity of char after pyrolysis governs the efficiency. The reference char conversion in CO2 gasification of coal (weight loss) changes linearly in the initial stage of the reaction, but the reactivity declines as the end point is approached. Char surface area is as large as 400 m{sup 2}/g in the initial stage with the conversion at 20%, but it decreases in the final stage. This phenomenon relates closely with changes in pore size and crystalline structure. Change in the Raman value R which shows incompleteness of char graphite structure and amorphous carbon ratio suggests that an active portion with high reactivity is oxidized preferentially, and a portion with low reactivity remains finally. Minerals in coal are known to accelerate the gasification. However, their catalytic effect is related with chemical forms, and complex as they may change into inactive sulfides and silicates under severe reaction conditions. Change in forms of calcium compounds may also be involved in decline of the reactivity in the latter stage. 8 refs., 4 figs.

  1. Ash liberation from included minerals during combustion of pulverized coal: the relationship with char structure and burnout

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    Wu, H.; Wall, T.; Liu, G.; Bryant, G. [University of Newcastle, Callaghan, NSW (Australia). CRC for Black Coal Utilization and Dept. of Chemical Engineering

    1999-12-01

    In this study, the float fraction ({lt} specific gravity of 2.0) of a size cut (63-90 {mu}m) bituminous coal was combusted in a drop tube furnace (DTF) at a gas temperature of 1300{degree}C under an atmosphere of air, to investigate the ash liberation at five coal burnoff levels (35.5%, 54.3%, 70.1%, 87.1% and 95.6%). The data indicated that char structure determines the ash liberation at different burnoff levels. Fragmentation of porous char was found to be the determinative mechanism for formation of fine ash during the early and middle stages of char combustion, while coalescence of included mineral matter determines the coarse ash formed in the later stages of combustion. The investigation confirmed that the char morphology and structure play a key role in determining char fragmentation, char burnout history, and the ash liberation during combustion. 35 refs., 5 figs., 2 tabs.

  2. Analysis of Porous Structure Parameters of Biomass Chars Versus Bituminous Coal and Lignite Carbonized at High Pressure and Temperature—A Chemometric Study

    Directory of Open Access Journals (Sweden)

    Adam Smoliński

    2017-09-01

    Full Text Available The characteristics of the porous structure of carbonized materials affect their physical properties, such as density or strength, their sorption capacity, and their reactivity in thermochemical processing, determining both their applicability as fuels or sorbents and their efficiency in various processes. The porous structure of chars is shaped by the combined effects of physical and chemical properties of a carbonaceous material and the operating parameters applied in the carbonization process. In the study presented, the experimental dataset covering parameters of various fuels, ranging from biomass through lignite to bituminous coal, and chars produced at 1273 K and under the pressure of 1, 2, 3, and 4 MPa was analyzed with the application of the advanced method of data exploration. The principal component analysis showed that the sample of the highest coal rank was characterized by lower values of parameters reflecting the development of the porous structure of chars. A negative correlation was also observed between the carbon content in a fuel and the evolution of the porous structure of chars at high pressure. The highest total pore volume of chars produced under 1 and 3 MPa and the highest micropore surface area under 3 MPa were reported for a carbonized fuel sample of the highest moisture content.

  3. The effect of the textural properties of bituminous coal chars on NO emissions

    Energy Technology Data Exchange (ETDEWEB)

    Arenillas, A.; Rubiera, F.; Pis, J.J.; Jones, J.M.; Williams, A. [CSIC, Oviedo (Spain). Inst. Nacional del Carbon

    1999-11-01

    NO is the primary product of the oxidation of char nitrogen, and in some combustion processes the NO can be reduced on the char surface to give N{sub 2}O and/or N{sub 2}. In this study a range of bituminous coal (low, medium and high volatile matter content) were pyrolysed in a fixed bed reactor at various heating rates. Textural characterisation was carried out by measuring true (He) and apparent (Hg) densities and N{sub 2} (-196{degree}C) and CO{sub 2} (0{degree}C) adsorption isotherms. Pore volume distributions and surface areas were obtained for the chars studied. A thermogravimetric analyser coupled to a quadrupole mass spectrometer (TG-MS) was used to study the combustion behaviour of the samples and the nitrogen compounds evolved during temperature-programmed combustion. Results are discussed in terms of the influence of both textural properties and reactivity on NO emissions and on the heterogeneous reduction of NO. 23 refs., 8 figs., 4 tabs.

  4. Structural features of resorcinol–formaldehyde resin chars and interfacial behavior of water co-adsorbed with low-molecular weight organics

    International Nuclear Information System (INIS)

    Gun’ko, Vladimir M.; Bogatyrov, Viktor M.; Turov, Vladimir V.; Leboda, Roman; Skubiszewska-Zięba, Jadwiga; Urubkov, Iliya V.

    2013-01-01

    Products of resorcinol–formaldehyde resin carbonization (chars) are characterized by different morphology (particle shape and sizes) and texture (specific surface area, pore volume and pore size distribution) depending on water content during resin polymerization. At a low amount of water (C w = 37.8 wt.%) during synthesis resulting in strongly cross-linked polymers, carbonization gives nonporous particles. An increase in the water content to 62.7 wt.% results in a nano/mesoporous char, but if C w = 73.3 wt.%, a char is purely nanoporous. Despite these textural differences, the Raman spectra of all the chars are similar because of the similarity in the structure of their carbon sheets with a significant contribution of sp 3 C atoms. However, the difference in the spatial organization of the carbon sheet stacks in the particles results in the significant differences in the textural and morphological characteristics and in the adsorption properties of chars with respect to water, methane, benzene, hydrogen, methylene chloride, and dimethylsulfoxide.

  5. Structural features of resorcinol–formaldehyde resin chars and interfacial behavior of water co-adsorbed with low-molecular weight organics

    Energy Technology Data Exchange (ETDEWEB)

    Gun’ko, Vladimir M., E-mail: vlad_gunko@ukr.net [Chuiko Institute of Surface Chemistry, 17 General Naumov Street, 03164 Kyiv (Ukraine); Bogatyrov, Viktor M.; Turov, Vladimir V. [Chuiko Institute of Surface Chemistry, 17 General Naumov Street, 03164 Kyiv (Ukraine); Leboda, Roman; Skubiszewska-Zięba, Jadwiga [Faculty of Chemistry, Maria Curie-Skłodowska University, 20031 Lublin (Poland); Urubkov, Iliya V. [Kurdyumov Institute of Metal Physics, 36 Vernadsky Boulevard, 03142 Kyiv (Ukraine)

    2013-10-15

    Products of resorcinol–formaldehyde resin carbonization (chars) are characterized by different morphology (particle shape and sizes) and texture (specific surface area, pore volume and pore size distribution) depending on water content during resin polymerization. At a low amount of water (C{sub w} = 37.8 wt.%) during synthesis resulting in strongly cross-linked polymers, carbonization gives nonporous particles. An increase in the water content to 62.7 wt.% results in a nano/mesoporous char, but if C{sub w} = 73.3 wt.%, a char is purely nanoporous. Despite these textural differences, the Raman spectra of all the chars are similar because of the similarity in the structure of their carbon sheets with a significant contribution of sp{sup 3} C atoms. However, the difference in the spatial organization of the carbon sheet stacks in the particles results in the significant differences in the textural and morphological characteristics and in the adsorption properties of chars with respect to water, methane, benzene, hydrogen, methylene chloride, and dimethylsulfoxide.

  6. Bio-oil and bio-char production from biomass and their structural analyses

    International Nuclear Information System (INIS)

    Kilic, Murat; Özsin, Gamzenur; Pütün, Ayşe E.; Pütün, Ersan

    2015-01-01

    Energy demand is increasing day by day because of the rapid developments in the population, industrialization and urbanisation. Since, fossil fuels will be at the verge of getting extinct, researches are mostly focused on the renewable sources, such as biomass, in recent years. This paper provides an environmentally friendly process to convert waste biomass samples to bio-oil and bio-char by pyrolysis. For this purpose, pyrolysis characteristics of pomegranate peels under inert atmosphere were studied by using both TGA to analysis decomposition behaviour and a batch reactor to investigate product yields and properties. The properties of bio-oil and bio-char were investigated by different analytical techniques such as GC-MS, FT-IR, SEM, He pycnometry and elemental analysis. As a consequence, it is possible to obtain bio-oil, which has similar properties like petroleum hydrocarbons, and to obtain bio-char, which can be further used as a solid fuel or a carbonaceous adsorbent material via pyrolysis process. (full text)

  7. Type of litter determines the formation and properties of charred material during wildfires

    Science.gov (United States)

    Chavez, Bruno; Fonturbel, M. Teresa; Salgado, Josefa; García-Oliva, Felipe; Vega, Jose A.; Merino, Agustin

    2014-05-01

    Wildfire is one of the most important disturbances all over the World, affecting both the amount and composition of forest floor and mineral soils. In comparison with unburnt areas, wildfire-affected forest floor usually shows lower contents of labile C compounds and higher concentrations of recalcitrant aromatic forms. These changes in composition can have important impact on biogeochemical cycles and therefore ecosystem functions. Although burning of different types of litter can lead to different amount and types of pyrogenic compounds, this aspect has not been evaluated yet. The effect of wildfire on SOM composition and stability were evaluated in five major types of non-wood litter in Mediterranean ecosystems: Pinus nigra, E. arborea, P. pinaster, U. europaeus and Eucalyptus globulus. In each of these ecosystems, forest floor samples from different soil burn severities were sampled. Soil burnt severities were based on visual signs of changes in forest floor and deposition of ash. Pyrogenic carbon quality were analysed using elementary analysis, solid-state 13 C nuclear magnetic resonance spectroscopy, Reflectance Infrared Fourier Transform (FTIR) and thermal analysis (simultaneous DSC-TG). The study showed that the different types of litter influenced the formation and characteristics of charred material. They differed in the temperature at which they start to be formed, the amounts of charred compounds and in their chemical composition. The resulting charred materials from the different litter, showed an important variability in the degree of carbonitation/aromatization. Unlike the biochar obtained through pyrolysis of woody sources, which contains exclusively aromatic structures, in the charred material produced in some litter, lignin, cellulose and even cellulose persist even in the high soil burnt severity. Coinciding with increases in aromatic contents, important decreases in atomic H/C and O/C ratios were recorded. However, the values found in some

  8. Influence of the Pyrolysis Temperature on Sewage Sludge Product Distribution, Bio-Oil, and Char Properties

    DEFF Research Database (Denmark)

    Trinh, Ngoc Trung; Jensen, Peter Arendt; Dam-Johansen, Kim

    2013-01-01

    Fast pyrolysis may be used for sewage sludge treatment with the advantages of a significant reduction of solid waste volume and production of a bio-oil that can be used as fuel. A study of the influence of the reaction temperature on sewage sludge pyrolysis has been carried out using a pyrolysis...... of 392 g/mol, and metal concentrations lower than 0.14 wt % on a dry basis (db). Less optimal oil properties with respect to industrial applications were observed for oil samples obtained at 475 and 625 °C. Char properties of the 575 °C sample were an ash content of 81 wt % and a HHV of 6.1 MJ/kg db...

  9. The effect of temperature and heating rate on char properties obtained from solar pyrolysis of beech wood.

    Science.gov (United States)

    Zeng, Kuo; Minh, Doan Pham; Gauthier, Daniel; Weiss-Hortala, Elsa; Nzihou, Ange; Flamant, Gilles

    2015-04-01

    Char samples were produced from pyrolysis in a lab-scale solar reactor. The pyrolysis of beech wood was carried out at temperatures ranging from 600 to 2000°C, with heating rates from 5 to 450°C/s. CHNS, scanning electron microscopy analysis, X-ray diffractometry, Brunauer-Emmett-Teller adsorption were employed to investigate the effect of temperature and heating rate on char composition and structure. The results indicated that char structure was more and more ordered with temperature increase and heating rate decrease (higher than 50°C/s). The surface area and pore volume firstly increased with temperature and reached maximum at 1200°C then reduced significantly at 2000°C. Besides, they firstly increased with heating rate and then decreased slightly at heating rate of 450°C/s when final temperature was no lower than 1200°C. Char reactivity measured by TGA analysis was found to correlate with the evolution of char surface area and pore volume with temperature and heating rate. Copyright © 2015 Elsevier Ltd. All rights reserved.

  10. Properties and Beneficial Uses of (BioChars, with Special Attention to Products from Sewage Sludge Pyrolysis

    Directory of Open Access Journals (Sweden)

    Arianna Callegari

    2018-03-01

    Full Text Available Residual sludge disposal costs may constitute up to, and sometimes above, 50% of the total cost of operation of a Wastewater Treatment Plant (WWTP and contribute approximately 40% of the total greenhouse gas (GHG emissions associated with its operation. Traditionally, wastewater sludges are processed for: (a reduction of total weight and volume to facilitate their transfer and subsequent treatments; (b stabilization of contained organic material and destruction of pathogenic microorganisms, elimination of noxious odors, and reduction of putrefaction potential and, at an increasing degree; (c value addition by developing economically viable recovery of energy and residual constituents. Among several other processes, pyrolysis of sludge biomass is being experimented with by some researchers. From the process, oil with composition not dissimilar to that of biodiesels, syngas, and a solid residue can be obtained. While the advantage of obtaining sludge-derived liquid and gaseous fuels is obvious to most, the solid residue from the process, or char (also indicated as biochar by many, may also have several useful, initially unexpected applications. Recently, the char fraction is getting attention from the scientific community due to its potential to improve agricultural soils’ productivity, remediate contaminated soils, and supposed, possible mitigation effects on climate change. This paper first discusses sludge-pyrolysis-derived char production fundamentals (including relationships between char, bio-oil, and syngas fractions in different process operating conditions, general char properties, and possible beneficial uses. Then, based on current authors’ experiments with microwave-assisted sludge pyrolysis aimed at maximization of liquid fuel extraction, evaluate specific produced char characteristics and production to define its properties and most appropriate beneficial use applications in this type of setting.

  11. Textural properties of chars as determined by petrographic analysis: comparison between air-blown, oxygen-blown and oxygen-enriched gasification

    CSIR Research Space (South Africa)

    Oboirien, BO

    2012-11-01

    Full Text Available In this study, the textural properties of chars generated from a vitrinite, high ash coal in a fluidised bed gasifier under air-blown, oxygen-blown and oxygen-enriched conditions were determined by detailed petrographic analysis. The char samples...

  12. Synthesis and structural features of resorcinol–formaldehyde resin chars containing nickel nanoparticles

    International Nuclear Information System (INIS)

    Galaburda, M.V.; Bogatyrov, V.M.; Skubiszewska-Zięba, J.; Oranska, O.I.; Sternik, D.; Gun’ko, V.M.

    2016-01-01

    Graphical abstract: - Highlights: • Facile synthesis of the Ni-doped carbon sorbents via carbonization of resorcinol–formaldehyde polymers/nickel(II) acetate mixtures in the inert atmosphere. • Effects of Ni content, as well as water volume and temperature treatment on the morphology and texture of the chars. • Ni/C composites are characterized by a core–shell structure with well-crystallized graphitic shells. • Ni content influences the structure of the carbon. • Nickel-doped carbon nanocomposites were used as a magnetically separable adsorbent. - Abstract: A series of meso- and microporous carbons containing magnetic Ni nanoparticles (Ni/C) with a variety of Ni loadings were synthesized by a simple one-pot procedure through carbonization of resorcinol–formaldehyde polymers containing various amounts of nickel(II) acetate. Such composite materials were characterized by N_2 sorption, Raman spectroscopy, X-ray diffraction (XRD), scanning electron microscopy (SEM) and Transmission electron microscope (TEM). The XRD patterns reveal peaks corresponding to face centered cubic nickel with the average size of crystallites of 17–18 nm. SEM and TEM results reveal that the formation of the nanoparticles took place mainly in the carbon spheres (1–2 μm in size) and on the outer surface as well. The as-prepared composites are characterized by a core–shell structure with well-crystallized graphitic shells about 8–15 nm in thickness. The Raman spectra show that Ni content influences the structure of the carbon. It was also shown that the morphology (particle shape and sizes) and porosity (pore volume and pore size distribution) of the chars are strongly dependent on water and nickel contents in the blends. One of the applications of Ni/C was demonstrated as a magnetically separable adsorbent.

  13. Adding the combination of CNTs and MoS{sub 2} into halogen-free flame retarding TPEE with enhanced the anti-dripping behavior and char forming properties

    Energy Technology Data Exchange (ETDEWEB)

    Zhong, Yuhua; Li, Maolin; Zhang, Luchong; Zhang, Xuewei; Zhu, Songwei; Wu, Wei, E-mail: wuwei@ecust.edu.cn

    2015-08-10

    Highlights: • Introduction the combination of the CNTs and MoS{sub 2} into P–N flame retarding TPEE. • Binary synergists for P–N flame retardants in TPEE. • Increase of char yield and form the stable carbonaceous char. - Abstract: In this paper, the nanocomposites thermoplastic polyester-ether elastomer (TPEE) with phosphorus–nitrogen (P–N) flame retardants, carbon nanotubes (CNTs) and molybdenum disulfide (MoS{sub 2}) was prepared by melt blending. TPEE containing P–N flame retardant, CNTs and MoS{sub 2} achieved UL94 V-0 rating due to the better barrier effect of the special structure. The structure was supported by the result of rheological properties. The thermal stability was studied by thermal gravimetric analysis (TGA) and char residue characterization was investigated by SEM–EDX measurements. The results demonstrated that the combination of CNTs and MoS{sub 2} results in the increase of char yield and the formation of the thermally stable char which can effectively prevent in the dripping behavior during the burning process.

  14. The Effects of a Macromolecular Charring Agent with Gas Phase and Condense Phase Synergistic Flame Retardant Capability on the Properties of PP/IFR Composites

    Science.gov (United States)

    Chen, Hongda; Wang, Jihui; Ding, Anxin; Han, Xia; Sun, Ziheng

    2018-01-01

    In order to improve the efficiency of intumescent flame retardants (IFRs), a novel macromolecular charring agent named poly(ethanediamine-1,3,5-triazine-p-4-amino-2,2,6,6-tetramethylpiperidine) (PETAT) with gas phase and condense phase synergistic flame-retardant capability was synthesized and subsequently dispersed into polypropylene (PP) in combination with ammonium polyphosphate (APP) via a melt blending method. The chemical structure of PETAT was investigated by Fourier transform infrared spectroscopy (FTIR), and 1H nuclear magnetic resonance (NMR) spectroscopy. Thermal properties of the PETAT and IFR systems were tested by thermogravimetric-derivative thermogravimetric analysis (TGA-DTG) and thermogravimetry–Fourier transform infrared spectroscopy (TG-FTIR). The mechanical properties, thermal stability, flame-retardant properties, water resistance, and structures of char residue in flame-retardant composites were characterized using tensile and flexural strength property tests, TGA, limiting oxygen index (LOI) values before and after soaking, underwritten laboratory-94 (UL-94) vertical burning test, cone calorimetric test (CCT), scanning electron microscopy with energy dispersive X-ray spectrometry (SEM-EDXS), and FTIR. The results indicated that PETAT was successfully synthesized, and when the ratio of APP to PETAT was 2:1 with 25 wt % loading, the novel IFR system could reduce the deterioration of tensile strength and enhance the flexural strength of composites. Meanwhile, the flame-retardant composite was able to pass the UL-94 V-0 rating with an LOI value of 30.3%, and the peak of heat release rate (PHRR), total heat release (THR), and material fire hazard values were considerably decreased compared with others. In addition, composites also exhibited excellent water resistance properties compared with traditional IFR composites. SEM-EDXS and FTIR analyses of the char residues, as well as TG-FTIR analyses of IFR were used to investigate the flame

  15. The Effects of a Macromolecular Charring Agent with Gas Phase and Condense Phase Synergistic Flame Retardant Capability on the Properties of PP/IFR Composites

    Directory of Open Access Journals (Sweden)

    Hongda Chen

    2018-01-01

    Full Text Available In order to improve the efficiency of intumescent flame retardants (IFRs, a novel macromolecular charring agent named poly(ethanediamine-1,3,5-triazine-p-4-amino-2,2,6,6-tetramethylpiperidine (PETAT with gas phase and condense phase synergistic flame-retardant capability was synthesized and subsequently dispersed into polypropylene (PP in combination with ammonium polyphosphate (APP via a melt blending method. The chemical structure of PETAT was investigated by Fourier transform infrared spectroscopy (FTIR, and 1H nuclear magnetic resonance (NMR spectroscopy. Thermal properties of the PETAT and IFR systems were tested by thermogravimetric-derivative thermogravimetric analysis (TGA-DTG and thermogravimetry–Fourier transform infrared spectroscopy (TG-FTIR. The mechanical properties, thermal stability, flame-retardant properties, water resistance, and structures of char residue in flame-retardant composites were characterized using tensile and flexural strength property tests, TGA, limiting oxygen index (LOI values before and after soaking, underwritten laboratory-94 (UL-94 vertical burning test, cone calorimetric test (CCT, scanning electron microscopy with energy dispersive X-ray spectrometry (SEM-EDXS, and FTIR. The results indicated that PETAT was successfully synthesized, and when the ratio of APP to PETAT was 2:1 with 25 wt % loading, the novel IFR system could reduce the deterioration of tensile strength and enhance the flexural strength of composites. Meanwhile, the flame-retardant composite was able to pass the UL-94 V-0 rating with an LOI value of 30.3%, and the peak of heat release rate (PHRR, total heat release (THR, and material fire hazard values were considerably decreased compared with others. In addition, composites also exhibited excellent water resistance properties compared with traditional IFR composites. SEM-EDXS and FTIR analyses of the char residues, as well as TG-FTIR analyses of IFR were used to investigate the flame

  16. The Effects of a Macromolecular Charring Agent with Gas Phase and Condense Phase Synergistic Flame Retardant Capability on the Properties of PP/IFR Composites.

    Science.gov (United States)

    Chen, Hongda; Wang, Jihui; Ni, Aiqing; Ding, Anxin; Han, Xia; Sun, Ziheng

    2018-01-11

    In order to improve the efficiency of intumescent flame retardants (IFRs), a novel macromolecular charring agent named poly(ethanediamine-1,3,5-triazine-p-4-amino-2,2,6,6-tetramethylpiperidine) (PETAT) with gas phase and condense phase synergistic flame-retardant capability was synthesized and subsequently dispersed into polypropylene (PP) in combination with ammonium polyphosphate (APP) via a melt blending method. The chemical structure of PETAT was investigated by Fourier transform infrared spectroscopy (FTIR), and ¹H nuclear magnetic resonance (NMR) spectroscopy. Thermal properties of the PETAT and IFR systems were tested by thermogravimetric-derivative thermogravimetric analysis (TGA-DTG) and thermogravimetry-Fourier transform infrared spectroscopy (TG-FTIR). The mechanical properties, thermal stability, flame-retardant properties, water resistance, and structures of char residue in flame-retardant composites were characterized using tensile and flexural strength property tests, TGA, limiting oxygen index (LOI) values before and after soaking, underwritten laboratory-94 (UL-94) vertical burning test, cone calorimetric test (CCT), scanning electron microscopy with energy dispersive X-ray spectrometry (SEM-EDXS), and FTIR. The results indicated that PETAT was successfully synthesized, and when the ratio of APP to PETAT was 2:1 with 25 wt % loading, the novel IFR system could reduce the deterioration of tensile strength and enhance the flexural strength of composites. Meanwhile, the flame-retardant composite was able to pass the UL-94 V-0 rating with an LOI value of 30.3%, and the peak of heat release rate (PHRR), total heat release (THR), and material fire hazard values were considerably decreased compared with others. In addition, composites also exhibited excellent water resistance properties compared with traditional IFR composites. SEM-EDXS and FTIR analyses of the char residues, as well as TG-FTIR analyses of IFR were used to investigate the flame

  17. The hierarchical porous structure bio-char assessments produced by co-pyrolysis of municipal sewage sludge and hazelnut shell and Cu(II) adsorption kinetics.

    Science.gov (United States)

    Zhao, Bing; Xu, Xinyang; Zeng, Fanqiang; Li, Haibo; Chen, Xi

    2018-05-04

    The co-pyrolysis technology was applied to municipal sewage sludge (MSS) and hazelnut shell with alkaline activating agent K 2 CO 3 under N 2 atmosphere. The innovative bio-char produced by co-pyrolysis had significant physical and chemical characteristics. The specific surface area reached 1990.23 m 2 /g, and the iodine absorption number was 1068.22 mg/g after co-pyrolysis at 850 °C. Although hazelnut shell was a kind of solid waste, it also had abundant cellulose resource, which could contribute to porous structure of bio-char during co-pyrolysis with MSS and decrease total heavy metals contents of raw material to increase security of bio-chars. Meanwhile, the residual fractions of heavy metals in bio-char were above 92.95% after co-pyrolysis at 900 °C except Cd to prevent heavy metals digestion, and the bio-char presented significant immobilization behavior from co-pyrolysis technology. Moreover, the yield and the iodine absorption number of bio-chars under different process variables were analyzed, and it was confirmed that appropriate process variables could contribute the yield and the iodine absorption number of bio-char and prevent to etch pore structure excessively to collapse. The changes of surface functional groups and crystallographic structure before and after co-pyrolysis were analyzed by FTIR and XRD, respectively. The hierarchical porous structure of bio-char was presented by SEM and N 2 adsorption-desorption isotherm. The Cu(II) adsorption capacity of the bio-char was 42.28 mg/g after 24 h, and surface functional groups acted as active binding sites for Cu(II) adsorption. Langmuir model and pseudo-second-order model can describe process of Cu(II) adsorption well.

  18. Structural characteristics and gasification reactivity of chars prepared from K{sub 2}CO{sub 3} mixed HyperCoals and coals

    Energy Technology Data Exchange (ETDEWEB)

    Atul Sharma; Hiroyuki Kawashima; Ikuo Saito; Toshimasa Takanohashi [National Institute of Advanced Industrial Science and Technology, Ibaraki (Japan). Advanced Fuel Group

    2009-04-15

    HyperCoal is a clean coal with mineral matter content <0.05 wt %. Oaky Creek (C = 82%), and Pasir (C = 68%) coals were subjected to solvent extraction method to prepare Oaky Creek HyperCoal, and Pasir HyperCoal. Experiments were carried out to compare the gasification reactivity of HyperCoals and parent raw coals with 20, 40, 50 and 60% K{sub 2}CO{sub 3} as a catalyst at 600, 650, 700, and 775{sup o}C with steam. Gasification rates of coals and HyperCoals were strongly influenced by the temperature and catalyst loading. Catalytic steam gasification of HyperCoal chars was found to be chemical reaction controlled in the 600-700{sup o}C temperature range for all catalyst loadings. Gasification rates of HyperCoal chars were found to be always higher than parent coals at any given temperature for all catalyst loadings. However, X-ray diffraction results showed that the microstructures of chars prepared from coals and HyperCoals were similar. Results from nuclear magnetic resonance spectroscopy show no significant difference between the chemical compositions of the chars. Significant differences were observed from scanning electron microscopy images, which showed that the chars from HyperCoals had coral-reef like structures whereas dense chars were observed for coals. 26 refs., 8 figs., 2 tabs.

  19. Which kind of aromatic structures are produced during biomass charring? New insights provided by modern solid-state NMR spectroscopy

    Science.gov (United States)

    Knicker, Heike; Paneque-Carmona, Marina; Velasco-Molina, Marta; de la Rosa, José Maria; León-Ovelar, Laura Regina; Fernandez-Boy, Elena

    2017-04-01

    Intense research on biochar and charcoal of the last years has revealed that depending on the production conditions, the chemical and physical characteristics of their aromatic network can greatly vary. Since such variations are determining the behavior and stability of charred material in soils, a better understanding of the structural changes occurring during their heating and the impact of those changes on their function is needed. One method to characterize pyrogenic organic matter (PyOM) represents solid-state 13C NMR spectroscopy applying the cross polarization (CP) magic angle spinning technique (MAS). A drawback of this technique is that the quantification of NMR spectra of samples with highly condensed and proton-depleted structures is assumed to be bias. Typical samples with such attributes are charcoals produced at temperatures above 700°C under pyrolytic conditions. Commonly their high condensation degree leads to graphenic structures that are not only reducing the CP efficiency but create also a conductive lattice which acts as a shield and prevents the entering of the excitation pulse into the sample during the NMR experiments. Since the latter can damage the NMR probe and in the most cases the obtained NMR spectra show only one broad signal assignable to aromatic C, this technique is rarely applied for characterizing high temperature chars or soot. As a consequence, a more detailed knowledge of the nature of the aromatic ring systems is still missing. The latter is also true for the aromatic domains of PyOM produced at lower temperatures, since older NMR instruments operating at low magnetic fields deliver solid-state 13C NMR spectra with low resolution which turns a more detailed analysis of the aromatic chemical shift region into a challenging task. In order to overcome this disadvantages, modern NMR spectroscopy offers not only instruments with greatly improved resolution but also special pulse sequences for NMR experiments which allow a more

  20. Disintegration of beech wood char during thermal conversion

    DEFF Research Database (Denmark)

    Hindsgaul, Claus

    In the present work the processes occurring in the structures of slowly pyrolysed beech wood char during thermal gasification have been investigated. Emphasis was put on physical changes and gas transport properties during conversion. The highly anisotropic structure of wood was preserved in its ...

  1. Study on the effect of heat treatment and gasification on the carbon structure of coal chars and metallurgical cokes using fourier transform Raman spectroscopy

    Energy Technology Data Exchange (ETDEWEB)

    S. Dong; P. Alvarez; N. Paterson; D.R. Dugwell; R. Kandiyoti [Imperial College London, London (United Kingdom). Department of Chemical Engineering

    2009-03-15

    Differences in the development of carbon structures between coal chars and metallurgical cokes during high-temperature reactions have been investigated using Raman spectroscopy. These are important to differentiate between different types of carbons in dust recovered from the top gas of the blast furnace. Coal chars have been prepared from a typical injectant coal under different heat-treatment conditions. These chars reflected the effect of peak temperature, residence time at peak temperature, heating rate and pressure on the evolution of their carbon structures. The independent effect of gasification on the development of the carbon structure of a representative coal char has also been studied. A similar investigation has also been carried out to study the effect of heat-treatment temperature (from 1300 to 2000{sup o}C) and gasification on the carbon structure of a typical metallurgical coke. Two Raman spectral parameters, the intensity ratio of the D band to the G band (I{sub D}/I{sub G}) and the intensity ratio of the valley between D and G bands to the G band (I{sub V}/I{sub G}), have been found useful in assessing changes in carbon structure. An increase in I{sub D}/I{sub G} indicates the growth of basic graphene structural units across the temperature range studied. A decrease in I{sub V}/I{sub G} appears to suggest the elimination of amorphous carbonaceous materials and ordering of the overall carbon structure. The Raman spectral differences observed between coal chars and metallurgical cokes are considered to result from the difference in the time-temperature history between the raw injectant coal and the metallurgical coke and may lay the basis for differentiation between metallurgical coke fines and coal char residues present in the dust carried over the top of the blast furnace. 41 refs., 17 figs., 3 tabs.

  2. Production and characterization of Lemna minor bio-char and its catalytic application for biogas reforming

    International Nuclear Information System (INIS)

    Muradov, Nazim; Fidalgo, Beatriz; Gujar, Amit C.; Garceau, Nathaniel; T-Raissi, Ali

    2012-01-01

    Pyrolysis of fast-growing aquatic biomass - Lemna minor (commonly known as duckweed) with the emphasis on production, characterization and catalytic application of bio-char is reported in this paper. The yield of bio-char was determined as a function of L. minor pyrolysis temperature and sweep gas flow rate. It was found that the pore development during L. minor pyrolysis was not significant and the changes in the reaction conditions (temperature and sweep gas flow rate) did not alter markedly the textural characteristics and BET surface area of the bio-char produced. Thermogravimetric/differential thermogravimetric (TG/DTG) analyses of L. minor and different bio-char samples in inert (helium) and oxidative (air) media showed substantial differences in their TG/DTG patterns. A comparison of scanning electron micrographs (SEM) of L. minor, bio-char and ash indicated that the basic structural features of L. minor remained intact and were not affected by thermolysis. The inorganic ash content of L. minor derived bio-char is significantly higher than that of typical terrestrial (plant) biomass. The energy dispersive spectroscopic (EDS) analysis of L. minor ash showed that it mostly consisted of silica, and small quantities of Na, K and Ca compounds. The treatment of bio-char with CO 2 at 800 °C increased its BET surface area. It was found that CO 2 -treated bio-char exhibited appreciable initial catalytic activity in biogas reforming. -- Highlights: ► New data on characterization of bio-chars derived from Lemna minor are presented. ► Effect of pyrolysis operational parameters on bio-char properties is determined. ► Basic skeletal structure of Lemna minor leaflets does not change during pyrolysis. ► Bio-chars show an appreciable initial catalytic activity for biogas reforming.

  3. The effect of 150μm expandable graphite on char expansion of intumescent fire retardant coating

    Energy Technology Data Exchange (ETDEWEB)

    Ullah, Sami, E-mail: samichemist1@gmail.com; Shariff, A. M., E-mail: azmish@petronas.com.my, E-mail: azmibustam@petronas.com.my; Bustam, M. A., E-mail: azmish@petronas.com.my, E-mail: azmibustam@petronas.com.my [Research Center for Carbon Dioxide Capture, Department of Chemical Engineering, Universiti Techologi PETRONAS, Bandar Sri Iskandar, Tronoh 31750 Perak (Malaysia); Ahmad, Faiz, E-mail: faizahmadster@gmail.com [Department of Mechanical Engineering, Universiti Techologi PETRONAS, Bandar Sri Iskandar, Tronoh 31750 Perak (Malaysia)

    2014-10-24

    Intumescent is defined as the swelling of certain substances to insulate the underlying substrate when they are heated. In this research work the effect of 150μm expandable graphite (EG) was studied on char expansion, char morphology and char composition of intumescent coating formulations (ICFs). To study the expansion and thermal properties of the coating, nine different formulations were prepared. The coatings were tested at 500 °C for one hour and physically were found very stable and well bound with the steel substrate. The morphology was studied by Scanning Electron Microscopy (SEM). The char composition was analysed by X-ray Diffraction (XRD) and Fourier transform infrared spectroscopy (FTIR) techniques. EG above than 10.8wt% expands the char abruptly with uniform network structure and affect the outer surface of the char.

  4. The effect of 150μm expandable graphite on char expansion of intumescent fire retardant coating

    International Nuclear Information System (INIS)

    Ullah, Sami; Shariff, A. M.; Bustam, M. A.; Ahmad, Faiz

    2014-01-01

    Intumescent is defined as the swelling of certain substances to insulate the underlying substrate when they are heated. In this research work the effect of 150μm expandable graphite (EG) was studied on char expansion, char morphology and char composition of intumescent coating formulations (ICFs). To study the expansion and thermal properties of the coating, nine different formulations were prepared. The coatings were tested at 500 °C for one hour and physically were found very stable and well bound with the steel substrate. The morphology was studied by Scanning Electron Microscopy (SEM). The char composition was analysed by X-ray Diffraction (XRD) and Fourier transform infrared spectroscopy (FTIR) techniques. EG above than 10.8wt% expands the char abruptly with uniform network structure and affect the outer surface of the char

  5. Understanding how lake populations of arctic char are structured and function with special consideration of the potential effects of climate change: A multi-faceted approach.

    Science.gov (United States)

    Budy, Phaedra; Luecke, Chris

    2014-01-01

    Size dimorphism in fish populations, both its causes and consequences, has been an area of considerable focus; however, uncertainty remains whether size dimorphism is dynamic or stabilizing and about the role of exogenous factors. Here, we explored patterns among empirical vital rates, population structure, abundance and trend, and predicted the effects of climate change on populations of arctic char (Salvelinus alpinus) in two lakes. Both populations cycle dramatically between dominance by small (≤300 mm) and large (>300 mm) char. Apparent survival (Φ) and specific growth rates (SGR) were relatively high (40–96 %; SGR range 0.03–1.5 %) and comparable to those of conspecifics at lower latitudes. Climate change scenarios mimicked observed patterns of warming and resulted in temperatures closer to optimal for char growth (15.15 °C) and a longer growing season. An increase in consumption rates (28–34 %) under climate change scenarios led to much greater growth rates (23–34 %). Higher growth rates predicted under climate change resulted in an even greater predicted amplitude of cycles in population structure as well as an increase in reproductive output (Ro) and decrease in generation time (Go). Collectively, these results indicate arctic char populations (not just individuals) are extremely sensitive to small changes in the number of ice-free days. We hypothesize years with a longer growing season, predicted to occur more often under climate change, produce elevated growth rates of small char and act in a manner similar to a “resource pulse,” allowing a sub-set of small char to “break through,” thus setting the cycle in population structure.

  6. Understanding how lake populations of arctic char are structured and function with special consideration of the potential effects of climate change: a multi-faceted approach.

    Science.gov (United States)

    Budy, Phaedra; Luecke, Chris

    2014-09-01

    Size dimorphism in fish populations, both its causes and consequences, has been an area of considerable focus; however, uncertainty remains whether size dimorphism is dynamic or stabilizing and about the role of exogenous factors. Here, we explored patterns among empirical vital rates, population structure, abundance and trend, and predicted the effects of climate change on populations of arctic char (Salvelinus alpinus) in two lakes. Both populations cycle dramatically between dominance by small (≤300 mm) and large (>300 mm) char. Apparent survival (Φ) and specific growth rates (SGR) were relatively high (40-96%; SGR range 0.03-1.5%) and comparable to those of conspecifics at lower latitudes. Climate change scenarios mimicked observed patterns of warming and resulted in temperatures closer to optimal for char growth (15.15 °C) and a longer growing season. An increase in consumption rates (28-34%) under climate change scenarios led to much greater growth rates (23-34%). Higher growth rates predicted under climate change resulted in an even greater predicted amplitude of cycles in population structure as well as an increase in reproductive output (Ro) and decrease in generation time (Go). Collectively, these results indicate arctic char populations (not just individuals) are extremely sensitive to small changes in the number of ice-free days. We hypothesize years with a longer growing season, predicted to occur more often under climate change, produce elevated growth rates of small char and act in a manner similar to a "resource pulse," allowing a sub-set of small char to "break through," thus setting the cycle in population structure.

  7. Char characterisation and its application in a coal burnout mode

    Energy Technology Data Exchange (ETDEWEB)

    Michael Cloke; Tao Wu; Richelieu Barranco; Ed Lester [University of Nottingham, Nottingham (United Kingdom). Nottingham Fuel and Energy Centre, School of Chemical, Environmental and Mining Engineering, Coal Technology Research Group

    2003-10-01

    In this study, char image analysis techniques have been employed to investigate the morphology of chars obtained from a Drop-Tube furnace. Char image analysis results have been incorporated as inputs to a char burnout model based on Hurt's CBK model. It has been observed that the char combustion rate was strongly affected by char structural parameters and the inclusion of char morphology has led to a better prediction of char burnout. It has also been suggested by the model that the inclusion of ash inhibition overestimates the resistance attributed by ash film and the consideration of ash film resistance should be undertaken in a different way to give a better prediction at the later stages of char combustion. 12 refs., 13 figs., 5 tabs.

  8. Pyrolysis of superfine pulverized coal. Part 4. Evolution of functionalities in chars

    International Nuclear Information System (INIS)

    Liu, Jiaxun; Ma, Yang; Luo, Lei; Ma, Junfang; Zhang, Hai; Jiang, Xiumin

    2017-01-01

    Highlights: • A combination of XPS and NMR is adopted for analyzing char chemical structures during superfine pulverized coal pyrolysis. • The chemisorbed NO can be transformed into pyridine N with the favor of adjacent oxygenated groups in chars. • Particle size has significant influence on oxygen-containing configurations in chars. - Abstract: The properties of the coal-derived char play crucial roles in coal conversion reactions and the formation of air pollutants. The nascent char is highly reactive due to the existence of numerous free radicals, active sites, and organic functional groups on its surface. Here, we showed that a combination of nuclear magnetic resonance spectroscopy (NMR) and X-ray photoelectron spectroscopy (XPS) techniques is an effective and precise way to characterize the occurrence, distribution, and evolution of organic functionalities in coal chars. Using these methods, we explored detailed information about chemical features of superfine pulverized coal chars in different atmospheres, and we also discussed the influence of particle size on the evolutionary behavior of functionalities. Results indicate that, in both N_2 and CO_2 atmospheres, the content of C−O species increases with the reduction in char particle sizes. This increment facilitates the heterogeneous reduction of NOx on char surfaces. The chemisorbed NO is susceptible to being incorporated into chars, and being transformed into pyridine-type nitrogen with the favor of adjacent oxygen-containing groups. Moreover, the significant increment in oxygen-containing groups with the reduction of particle size is further confirmed through "1"3C NMR analysis. It was shown that there is an excellent correlation between estimates derived from XPS and NMR for oxygen configuration. The findings from this work provide some new insights into NOx reduction mechanisms and shed light on the practical application of superfine pulverized coal in the future.

  9. Properties and Developments of Combustion and Gasification of Coal and Char in a CO2-Rich and Recycled Flue Gases Atmosphere by Rapid Heating

    Directory of Open Access Journals (Sweden)

    Zhigang Li

    2012-01-01

    Full Text Available Combustion and gasification properties of pulverized coal and char have been investigated experimentally under the conditions of high temperature gradient of order 200°C·s−1 by a CO2 gas laser beam and CO2-rich atmospheres with 5% and 10% O2. The laser heating makes a more ideal experimental condition compared with previous studies with a TG-DTA, because it is able to minimize effects of coal oxidation and combustion by rapid heating process like radiative heat transfer condition. The experimental results indicated that coal weight reduction ratio to gases followed the Arrhenius equation with increasing coal temperature; further which were increased around 5% with adding H2O in CO2-rich atmosphere. In addition, coal-water mixtures with different water/coal mass ratio were used in order to investigate roles of water vapor in the process of coal gasification and combustion. Furthermore, char-water mixtures with different water/char mass ratio were also measured in order to discuss the generation ratio of CO/CO2, and specified that the source of Hydrocarbons is volatile matter from coal. Moreover, it was confirmed that generations of CO and Hydrocarbons gases are mainly dependent on coal temperature and O2 concentration, and they are stimulated at temperature over 1000°C in the CO2-rich atmosphere.

  10. NMR studies on the chemical alteration of soil organic matter precursors during controlled charring

    Science.gov (United States)

    Knicker, Heike

    2010-05-01

    Beside the production of volatiles, vegetation fire transforms various amounts of labile organic components into recalcitrant dark colored and highly aromatic structures. They are incorporated into soils and are assumed to represent an important sink within the global carbon cycle. In order to elucidate the real importance of PyOM as a C-sink, a good understanding of its chemistry is crucial. Although several 'Black Carbon' (BC) models are reported, a commonly accepted view of the chemistry involved in its formation is still missing. Its biogeochemical recalcitrance is commonly associated with a highly condensed aromatic structure. However, recent studies indicated that this view may be oversimplified for PyOM derived from vegetation fire. In order to bring some more light on the structural properties of PyOM produced during vegetation fire, charred plant residues and model chars derived from typical plant macromolecules (casein, cellulose, lignin and condensed tannins) were subjected to controlled charring under oxic conditions (350°C and 450°C) and then characterized by nuclear magnetic resonance (NMR) spectroscopy and elemental analysis. Subsequently, the chemical features of the PyOM were related to its chemical recalcitrance as determined by chemical oxidation with acid potassium dichromate. Charring cellulose (350°C, 8 min) yielded in a low C-recovery (11%). Treating casein in the same way resulted in a survival of 62% of its C and 46% of its N. Comparable high C-recoveries are reported for lignin. After charring Lolium perenne, 34% of its N and C were recovered. NMR-spectroscopic studies revealed that for this sample most of the charred N and C occurred in pyrrole-type structures. Our studies further indicate that the aromatic skeleton of char accumulating after a vegetation fire must contain remains of the lignin backbone and considerable contributions of furans and anhydrosugars from thermally altered cellulose. Enhancing the temperature during the

  11. Active sites in char gasification: Final technical report

    Energy Technology Data Exchange (ETDEWEB)

    Wojtowicz, M.; Lilly, W.D.; Perkins, M.T.; Hradil, G.; Calo, J.M.; Suuberg, E.M.

    1987-09-01

    Among the key variables in the design of gasifiers and combustors is the reactivity of the chars which must be gasified or combusted. Significant loss of unburned char is unacceptable in virtually any process; the provision of sufficient residence time for complete conversion is essential. A very wide range of reactivities are observed, depending upon the nature of the char in a process. The current work focuses on furthering the understanding of gasification reactivities of chars. It has been well established that the reactivity of char to gasification generally depends upon three principal factors: (1) the concentration of ''active sites'' in the char; (2) mass transfer within the char; and (3) the type and concentration of catalytic impurities in the char. The present study primarily addresses the first factor. The subject of this research is the origin, nature, and fate of active sites in chars derived from parent hydrocarbons with coal-like structure. The nature and number of the active sites and their reactivity towards oxygen are examined in ''model'' chars derived from phenol-formaldehyde type resins. How the active sites are lost by the process of thermal annealing during heat treatment of chars are studied, and actual rate for the annealing process is derived. Since intrinsic char reactivities are of primary interest in the present study, a fair amount of attention was given to the model char synthesis and handling so that the effect of catalytic impurities and oxygen-containing functional groups in the chemical structure of the material were minimized, if not completely eliminated. The project would not be considered complete without comparing characteristic features of synthetic chars with kinetic behavior exhibited by natural chars, including coal chars.

  12. Impact of Char Livelihood Program (CLP of Char land Dwellers around the Char Areas in Sirajgonj District of Bangladesh

    Directory of Open Access Journals (Sweden)

    Mohammad Anamul Haque

    2017-12-01

    Full Text Available In an attempt to address the impact of Char Livelihood Program (CLP of Char land dwellers, this study is carried out to examine the livelihood and income generation activities of the people of Bangala Char in Sirajgonj District, due to intervention of Char Livelihood Program (CLP by the DFID of United Kingdom (UK. The research question of the study was whether and to what extent the Char Livelihood Program (CLP brings any changes in the livelihood and income generation activities of the people of Bangala Char. Two areas have been studied, one area is under the intervention of the project (Bangala Char as program intervention area another is not under the program intervention (Sonatoni Char as control area. Both areas have been chosen of the vicinity of similar characteristics and geographical location for the ease of addressing the problems and analytical comparison. The study uses semi-structured questionnaire for household interview both for the program intervention and the control area as random sampling basis. This study a total of 96 households’ interviews conducted of the study areas among them 48 households from Bangala Char and 48 households from the Sonatoni Char (control area. Primary data collected from house hold respondent and secondary data were used from published and unpublished sources. Four variables are access to land, income and assets , food security and vulnerability identified and the analysis shows that access to land resources among the char dwellers has established legal ownership and entitlement of land and resolve the crisis of permanent settlement which bring change in livelihood in terms of access to land resources to some extent. The islands of char dwellers are in general disadvantaged with respect to their mainland counterparts in terms of physical isolation and vulnerability to flooding and erosion have created seasonal migration and higher dependency on traditional money lenders for accessing credit supply

  13. Computational Modelling of the Structural Integrity following Mass-Loss in Polymeric Charred Cellular Solids

    OpenAIRE

    J. P. M. Whitty; J. Francis; J. Howe; B. Henderson

    2014-01-01

    A novel computational technique is presented for embedding mass-loss due to burning into the ANSYS finite element modelling code. The approaches employ a range of computational modelling methods in order to provide more complete theoretical treatment of thermoelasticity absent from the literature for over six decades. Techniques are employed to evaluate structural integrity (namely, elastic moduli, Poisson’s ratios, and compressive brittle strength) of honeycomb systems known to approximate t...

  14. Characterization of bio char derived from tapioca skin

    Science.gov (United States)

    Hasnan, F. I.; Iamail, K. N.; Musa, M.; Jaapar, J.; Alwi, H.; Hamid, K. K. K.

    2018-03-01

    Pyrolysis of tapioca skin was conducted to produce bio chars in the range between 500°C–800°C. Surface modification treatment were performed on bio chars by using chemicals within 24 hours at 30°C and hot water within 1 hour to enhance the bio char’s adsorption properties according to surface area, pore volume, pore size, crystallinity structure and functional groups. The samples were characterized by using BET, XRD, FTIR and Methylene Blue adsorption. Based on BET result, it showed the surface area increased as the pyrolysis temperature increased followed by pore volume and pore size for S0. The optimum temperature for SNaOH, SHW and SMeOH was at 600°C, 700°C and 800°C with the surface area of 75.9874, 274.5066 and 351.5531 m2/g respectively compared to S0 while SP3HO4 has the worst result since it felt on macroporous structure. The percentage of MB adsorption was followed the size of bio chars surface area. Based on FTIR result, at temperature 500°C to 700°C, the bio chars still have functional groups while at 800°C, many functional groups were diminished due to high temperature struck on them. XRD result showed all the bio chars were amorphous. In conclusion, the best surface modification treatment was by Methanol followed by hot water and Sodium Hydroxide at temperature of 700°C and 800°C while Ortho-Phosphoric acid was the worst one and was not suitable for bio char’s surface modification for adsorption purpose.

  15. The Hopf algebra structure of the character rings of classical groups

    International Nuclear Information System (INIS)

    Fauser, Bertfried; Jarvis, Peter D; King, Ronald C

    2013-01-01

    The character ring Char-GL of covariant irreducible tensor representations of the general linear group admits a Hopf algebra structure isomorphic to the Hopf algebra Symm-Λ of symmetric functions. Here we study the character rings Char-O and Char-Sp of the orthogonal and symplectic subgroups of the general linear group within the same framework of symmetric functions. We show that Char-O and Char-Sp also admit natural Hopf algebra structures that are isomorphic to that of Char-GL, and hence to Symm-Λ. The isomorphisms are determined explicitly, along with the specification of standard bases for Char-O and Char-Sp analogous to those used for Symm-Λ. A major structural change arising from the adoption of these bases is the introduction of new orthogonal and symplectic Schur–Hall scalar products. Significantly, the adjoint with respect to multiplication no longer coincides, as it does in the Char-GL case, with a Foulkes derivative or skew operation. The adjoint and Foulkes derivative now require separate definitions, and their properties are explored here in the orthogonal and symplectic cases. Moreover, the Hopf algebras Char-O and Char-Sp are not self-dual. The dual Hopf algebras Char-O * and Char-Sp are identified. Finally, the Hopf algebra of the universal rational character ring Char-GLrat of mixed irreducible tensor representations of the general linear group is introduced and its structure maps identified. (paper)

  16. Production of activated carbon from TCR char

    Science.gov (United States)

    Stenzel, Fabian; Heberlein, Markus; Klinner, Tobias; Hornung, Andreas

    2016-04-01

    The utilization of char for adsorptive purposes is known since the 18th century. At that time the char was made of wood or bones and used for decoloration of fluids. In the 20th century the production of activated carbon in an industrial scale was started. The today's raw materials for activated carbon production are hard coal, peat, wood or coconut shells. All these materials entail costs especially the latter. Thus, the utilization of carbon rich residues (biomass) is an interesting economic opportunity because it is available for no costs or even can create income. The char is produced by thermo-catalytic reforming (TCR®). This process is a combination of an intermediate pyrolysis and subsequently a reforming step. During the pyrolysis step the material is decomposed in a vapor and a solid carbon enriched phase. In the second step the vapor and the solid phase get in an intensive contact and the quality of both materials is improved via the reforming process. Subsequently, the condensables are precipitated from the vapor phase and a permanent gas as well as oil is obtained. Both are suitable for heat and power production which is a clear advantage of the TCR® process. The obtained biochar from the TCR® process has special properties. This material has a very low hydrogen and oxygen content. Its stability is comparable to hard coal or anthracite. Therefore it consists almost only of carbon and ash. The latter depends from input material. Furthermore the surface structure and area can be influenced during the reforming step. Depending from temperature and residence time the number of micro pores and the surface area can be increased. Preliminary investigations with methylene blue solution have shown that a TCR® char made of digestate from anaerobic digestion has adsorptive properties. The decoloration of the solution was achieved. A further influencing factor of the adsorption performance is the particle size. Based on the results of the preliminary tests a

  17. Catalytic Pyrolysis of Tar Model Compound with Various Bio-Char Catalysts to Recycle Char from Biomass Pyrolysis

    Directory of Open Access Journals (Sweden)

    Jinmiao Liu

    2016-03-01

    Full Text Available Tar and char can be regarded as unwanted byproducts during the gasification process. In this study, three types of catalyst, i.e., biomass char (bio-char, nickel supported on biomass (Ni+bio-char, and nickel supported on bio-char (bio-char+Ni, were studied to compare the catalytic effects of different preparation methods on tar model compound removal. The structural characteristics of the three catalysts were also investigated by X-ray diffraction (XRD, scanning electron microscopy (SEM, and Brunauer-Emmett-Teller (BET methods. The results revealed that Ni+bio-char catalyst showed much higher activity for the reformation of toluene (C7H8 as a tar model compound than the other two catalysts. Toluene could be completely converted to small gas molecules at a conversion rate of 99.92% at 800 °C, and the maximum yield of gas was 432 mL/(mL C7H8. In particular, the H2 and CH4 yields were 339 and 85 mL/(mL C7H8 at 850 °C, respectively. An N2 absorption-desorption experiment demonstrated that the specific surface area of Ni+bio-char was 32.87 times that of bio-char and 8.39 times that of bio-char+Ni. Moreover, metallic nickel (Ni0 particles could be generated in the carbon matrix of Ni+bio-char catalyst. SEM analysis confirmed that the Ni+bio-char catalyst had a more porous structure. Nickel supported on biomass might be a promising catalyst for tar reformation because of its excellent catalytic activities.

  18. Adsorption of Pb(II by Activated Pyrolytic Char from Used Tire

    Directory of Open Access Journals (Sweden)

    Lu Ping

    2016-01-01

    Full Text Available As a renewable resource, the pyrolytic char derived from used tire has promising adsorption capacities owing to its similar structure and properties with active carbon. The purification and activation of the pyrolytic char from used tire, as well as the application of this material in the adsorption of Pb(II in water is conducted. The influences on the adsorption capacity by temperature and pH value are investigated and discussed; the adsorption thermodynamics and kinetics are also studied. The results show that the pyrolytic char from used tire has remarkable adsorption capacity for Pb(II, and the adsorption is an endothermic process complying with the Langmuir isotherm. The adsorption kinetics is a pseudo second-order reaction.

  19. The catalytic cracking mechanism of lignite pyrolysis char on tar

    International Nuclear Information System (INIS)

    Lei, Z.; Huibin, H.; Xiangling, S.; Zhenhua, M.; Lei, Z.

    2017-01-01

    The influence of different pyrolysis conditions for tar catalytic cracking will be analyzed according to the lignite pyrolysis char as catalyst on pyrolytic tar in this paper. The pyrolysis char what is the by-product of the cracking of coal has an abundant of pore structure and it has good catalytic activity. On this basis, making the modified catalyst when the pyrolysis char is activation and loads Fe by impregnation method. The cracking mechanism of lignite pyrolytic tar is explored by applying gas chromatograph to analyze splitting products of tar. The experimental results showed that: (1) The effect of tar cracking as the pyrolysis temperature, the heating rate, the volatilization of pyrolysis char and particle size increasing is better and better. The effect of the catalytic and cracking of lignite pyrolysis char in tar is best when the heating rate, the pyrolysis temperature, the volatiles of pyrolysis char, particle size is in specific conditions.(2) The activation of pyrolysis char can improve the catalytic effect of pyrolysis char on the tar cracking. But it reduces the effect of the tar cracking when the pyrolysis char is activation loading Fe. (author)

  20. Particle-based characterisation of pulverised coals and chars for carbon burnout studies

    Energy Technology Data Exchange (ETDEWEB)

    Gibbins, J.R.; Seitz, M.H.; Kennedy, S.M.; Beeley, T.J.; Riley, G.S. [Imperial College of Science, Technology and Medicine, London (United Kingdom). Mechanical Engineering Department

    1999-07-01

    The study of individual particle properties, as opposed to averaged behaviour of differing particles, was carried out for the combustion of coals and chars using optical microscopy and digital image processing. Chars from entrained flow reactors and corresponding pulverized fuel samples were characterized to examine possible char particle origins for real heterogeneous particles. 7 refs., 5 figs., 1 tab.

  1. Combustion char characterisation. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Rosenberg, P; Ingermann Petersen, H; Sund Soerensen, H; Thomsen, E; Guvad, C

    1996-06-01

    The aim was to correlate reactivity measures of raw coals and the maceral concentrates of the coals obtained in a previous project with the morphology of the produced chars by using a wire grid devolatilization method. Work involved determination of morphology, macroporosity and a detailed study by Scanning Electron Microscopy (SEM). Systematic variations in the texture of chars produced in different temperature domains and heating rates were demonstrated by using incident light microscopy on polished blocks and by SEM studies directly on the surfaces of untreated particles. Results suggest that work in the field of char reactivity estimates and correlations between char morphology and coal petrography can be accomplished only on chars produced under heating rates and temperatures comparable to those for the intended use of coal. A general correlation between the coals` petrography and the the morphology of high temperature chars was found. The SEM study of the chars revealed that during the devolatilization period the particles fuse and the macroporosity and thus the morphotypes are formed. After devolatilization ceases, secondary micropores are formed. These develop in number and size throughout the medium combustion interval. At the end of the combustion interval the macrostructure breaks down, caused by coalescence of the increased number of microspores. This can be observed as a change in the morphology and the macroporosity of the chars. Results indicate that char reactivity is a function of the macroporosity and thus the morphology of combustion chars. (AB) 34 refs.

  2. Characterization of chars form biomass-derived materials: pectin chars

    Energy Technology Data Exchange (ETDEWEB)

    Sharma, R.K.; Wooten, J.B.; Baliga, V.L.; Hajaligol, M.R. [Philip Morris USA, Richmond, VA (United States). Research Center

    2001-10-09

    The effect of pyrolysis conditions on the yield and composition of char from pectin was studied. The volatile product was analyzed by gas chromatography/mass spectrometry (GC/MS). The solid product, i.e. char, was characterised by solid-state {sup 13}C nuclear magnetic resonance (NMR) and Fourier-transform infrared (FTIR) spectrsocopy. The char was also analysed for its elemental composition and surface area. The surface morphology of the char was studied by scanning electron microscopy (SEM). The results were compared to those from chlorogenic acid (CA). For both pectin and CA, the char yield decreased with increasing temperature before levelling-off at ca.20% of the starting substrate in non-oxidative runs. In oxidative runs, the char yields from both substrates became negligible at 550{degree}C. NMR analysis indicated that the aromatic character of char increased as the pyrolysis temperature increased. The oxygen functionality was progressively lost and the resonance bands corresponding to carbonyl groups mostly disappeared above 350{degree}C. FTIR analysis also suggested the loss of hydroxyl and carbonyl groups from chars at high temperatures. The H/C and O/C ratios of chars decreased continuously with increasing temperature. The oxidative chars showed characteristics essentially similar to those of the non-oxidative chars. The surface area of char was negligible at low temperatures, but increased dramatically to a maximum of 70 m{sup 2}g{sup -1} at 450{degree}C before decreasing at 500{degree}C. SEM analysis indicated that the pyrolysis of pectin occurred via softening and melting of the substrate followed by bubble formation. At high temperatures, surface etching followed by the appearance of crystal

  3. Synthesis and characterization of poly (dihydroxybiphenyl borate) with high char yield for high-performance thermosetting resins

    Science.gov (United States)

    Wang, Shujuan; Xing, Xiaolong; Li, Jian; Jing, Xinli

    2018-01-01

    The objective of the current work is to synthesize novel boron-containing polymers with excellent thermal resistance, and reveal the structure and the reason for the high char yield. Thus, poly (dihydroxybiphenyl borate) (PDDB) with a more rigid molecular chain, was successfully synthesized using 4,4‧-dihydroxybiphenyl and boric acid. Structural characterizations of the prepared PDDB were performed via NMR, FTIR, XPS, and XRD analyses. The results reveal that PDDB consists of aromatic, Phsbnd Osbnd B and Bsbnd Osbnd B structures as well as a small number of boron hydroxyl and phenolic hydroxyl groups. PDDB shows good solubility in strong polar solvents, which is of great importance for the modification of thermosetting resins. TGA combined with DSC were employed to evaluate the thermal properties of PDDB, and increases in the glass transition temperature (Tg) and char yield were observed with increased boron content. Tg and char yield of PDDB (800 °C, nitrogen atmosphere) reached up to 219 °C and 66.5%, respectively. PDDB was extensively characterized during pyrolysis to reveal the high char yield of PDDB. As briefly discussed, the boron oxide and boron carbide that formed during pyrolysis play a crucial role in the high char yield of PDDB, which reduces the release of volatile carbon dioxide and carbon. This research suggests that PDDB has great potential as a novel modified agent for the improvement of the comprehensive performance of thermosetting resins to broaden their applicability in the field of advanced composites.

  4. Formation of structure, phase composition and properties of electro explosion resistant coatings using electron-beam processing

    International Nuclear Information System (INIS)

    Romanov, Denis A.; Sosnin, Kirill V.; Budovskikh, Evgenij A.; Gromov, Viktor E.; Semin, Alexander P.

    2014-01-01

    For the first time, the high intensity electron beam modification of electroexplosion composite coatings of Mochar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Mochar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Wchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Wchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu and TiB 2 char description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu systems was done. The studies of phase and elemental composition, defective structure conditions of these coatings were carried out. The regimes of electron-beam processing making possible to form the dense, specular luster surface layers having a submicrocrystalline structure were revealed. It was established that electron-beam processing of elecroexplosion spraying of layer of elecroexplosion spraying carried out in the regime of melting results in the formation of structurally and contrationally homogeneous surface layer. Investigation of the effect of electron-beam processing of electroexplosion electroerosion resistant coatings on their tribological properties (wear resistanse and coefficient of friction) and electroerosion resistance was done. It was shown that all the examined costings demonstrate the increase of electroerosion resistance in spark erosion up to 10 times

  5. Formation of structure, phase composition and properties of electro explosion resistant coatings using electron-beam processing

    Energy Technology Data Exchange (ETDEWEB)

    Romanov, Denis A., E-mail: romanov-da@physics.sibsiu.ru, E-mail: kos2906@mail.ru, E-mail: budovskih-ea@physics.sibsiu.ru, E-mail: gromov@physics.sibsiu.ru, E-mail: da-rom@live.ru; Sosnin, Kirill V., E-mail: romanov-da@physics.sibsiu.ru, E-mail: kos2906@mail.ru, E-mail: budovskih-ea@physics.sibsiu.ru, E-mail: gromov@physics.sibsiu.ru, E-mail: da-rom@live.ru; Budovskikh, Evgenij A., E-mail: romanov-da@physics.sibsiu.ru, E-mail: kos2906@mail.ru, E-mail: budovskih-ea@physics.sibsiu.ru, E-mail: gromov@physics.sibsiu.ru, E-mail: da-rom@live.ru; Gromov, Viktor E., E-mail: romanov-da@physics.sibsiu.ru, E-mail: kos2906@mail.ru, E-mail: budovskih-ea@physics.sibsiu.ru, E-mail: gromov@physics.sibsiu.ru, E-mail: da-rom@live.ru; Semin, Alexander P., E-mail: romanov-da@physics.sibsiu.ru, E-mail: kos2906@mail.ru, E-mail: budovskih-ea@physics.sibsiu.ru, E-mail: gromov@physics.sibsiu.ru, E-mail: da-rom@live.ru [Siberian State Industrial University, Novokuznetsk, 654007 (Russian Federation)

    2014-11-14

    For the first time, the high intensity electron beam modification of electroexplosion composite coatings of Mochar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Mochar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Wchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu, Wchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu and TiB{sub 2}char description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Cu systems was done. The studies of phase and elemental composition, defective structure conditions of these coatings were carried out. The regimes of electron-beam processing making possible to form the dense, specular luster surface layers having a submicrocrystalline structure were revealed. It was established that electron-beam processing of elecroexplosion spraying of layer of elecroexplosion spraying carried out in the regime of melting results in the formation of structurally and contrationally homogeneous surface layer. Investigation of the effect of electron-beam processing of electroexplosion electroerosion resistant coatings on their tribological properties (wear resistanse and coefficient of friction) and electroerosion resistance was done. It was shown that all the examined costings demonstrate the increase of electroerosion resistance in spark erosion up to 10 times.

  6. Gasification of biomass chars in steam-nitrogen mixture

    International Nuclear Information System (INIS)

    Haykiri-Acma, H.; Yaman, S.; Kucukbayrak, S.

    2006-01-01

    Some agricultural and waste biomass samples such as sunflower shell, pinecone, rapeseed, cotton refuse and olive refuse were first pyrolyzed in nitrogen, and then, their chars were gasified in a gas mixture of steam and nitrogen. Experiments were performed using the thermogravimetric analysis technique. Pyrolysis of the biomass samples was performed at a heating rate of 20 K/min from ambient to 1273 K in a dynamic nitrogen atmosphere of 40 cm 3 min -1 . The obtained chars were cooled to ambient temperature and then gasified up to 1273 K in a dynamic atmosphere of 40 cm 3 min -1 of a mixture of steam and nitrogen. Derivative thermogravimetric analysis profiles from gasification of the chars were derived, and the mass losses from the chars were interpreted in terms of temperature. It was concluded that gasification characteristics of biomass chars were fairly dependent on the biomass properties such as ash and fixed carbon contents and the constituents present in the ash. Different mechanisms in the three temperature intervals, namely water desorption at lower temperatures, decomposition of hydroxide minerals to oxide minerals and formation of carbon monoxide at medium temperatures and production of hydrogen at high temperatures govern the behavior of the char during the gasification process. The chars from pinecone and sunflower shell could be easily gasified under the mentioned conditions. In order to further raise the conversion yields, long hold times should be applied at high temperatures. However, the chars from rapeseed and olive refuse were not gasified satisfactorily. Low ash content and high fixed carbon content biomass materials are recommended for use in gasification processes when char from pyrolysis at elevated temperatures is used as a feedstock

  7. Thermovolumetric investigations of steam gasification of coals and their chars

    Directory of Open Access Journals (Sweden)

    Porada Stanisław

    2017-01-01

    Full Text Available The process of steam gasification of three coals of various rank and three chars obtained from these coals by the ex-situ method at 900 °C was compared. In the coal gasification process, the pyrolysis stage plays a very important part, which is connected with its direct impact on the kinetics of gasification of the resulting char. What is more, taking into consideration the impact of pyrolysis conditions on char properties, it should be anticipated that the gasification kinetics of coal and char, formed from it by the ex situ method, will be different. In order to examine and compare the process of gasification of coals and chars, an isothermal thermovolumetric method, designed by the authors, was applied. For all the examined samples the measurements were performed at three temperatures, i.e. 850, 900, and 950 °C, and at the pressure of 0.1 MPa. An evaluation of the impact of raw material on the steam gasification of the examined samples was made. The carbon conversion degree and the kinetic parameters of CO and H2 formation reaction were calculated. It was observed that the course of gasification is different for coals and chars obtained from them and it can be concluded that coals are more reactive than chars. Values of kinetic parameters of carbon monoxide and hydrogen formation calculated for coals and corresponding chars are also different. Due to the observed differences the process of gasification of coals and of chars with steam should not be equated.

  8. Effect of Kaolin Clay and Alumina on Thermal Performance and Char Morphology of Intumescent fire retardant coating

    Directory of Open Access Journals (Sweden)

    aziz Hammad

    2014-07-01

    Full Text Available Intumescent fire retardant coating (IFRC have been developed by using ammonium polyphosphate, expandable graphite, melamine, boric acid, kaolin clay and alumina as fillers bound together with epoxy resin and cured with the help of curing agent. Five different formulations were developed with and without using fillers. Cured samples were burned in furnace at 500°C for 2h for char expansion. Bunsen burner test was performed for 1h using UL-94 vertical burning test to investigate the thermal performance of IFRC. The resultant char obtained after burning of coated samples were characterized by using field emission scanning electron microscopy for char morphology. Char composition was analyzed by using fourier transform infrared spectroscopy. Thermogravimetric analysis was carried out to investigate the residual weight of coating. Results showed that formulation with 0.5 weight % of kaolin clay and 0.5 weight % of alumina provide best thermal performance, uniform and multi-porous char structure with high anti-oxidation property.

  9. Surface characterisation of synthetic coal chars made from model compounds

    Energy Technology Data Exchange (ETDEWEB)

    Arenillas, A.; Pevida, C.; Rubiera, F.; Palacios, J.M.; Navarrete, R.; Denoyel, R.; Rouquerol, J.; Pis, J.J. [Instituto Nacional del Carbon, CSIC, Oviedo (Spain)

    2004-07-01

    Knowledge of surface properties is essential for understanding the reaction mechanisms involved in several coal conversion processes. However, due to the complexity and heterogeneity of coal this is rather difficult and the use of known model compounds could be a valuable tool. Single model compounds have been widely used, but they give a quite simplified picture. In this work a mixture of model compounds in a phenol-formaldehyde matrix was cured in order to create cross-linked structures. The obtained synthetic coal was pyrolysed in a fixed bed reactor, under helium atmosphere. The surface composition of the chars was evaluated by XPS, adsorption gravimetry of water vapour, temperature-programmed desorption and potentiometric titration. Texture was characterised by N{sub 2} and CO{sub 2} adsorption isotherms at 77 and 273 K, respectively, and immersion calorimetry in benzene. The results obtained from the different techniques were contrasted in order to give an overview of the surface properties (chemical and physical) of the samples studied. Chars obtained under the same operating conditions from a high volatile bituminous coal were used as a reference.

  10. Thermal analysis of charring materials based on pyrolysis interface model

    Directory of Open Access Journals (Sweden)

    Huang Hai-Ming

    2014-01-01

    Full Text Available Charring thermal protection systems have been used to protect hypersonic vehicles from high heat loads. The pyrolysis of charring materials is a complicated physical and chemical phenomenon. Based on the pyrolysis interface model, a simulating approach for charring ablation has been designed in order to obtain one dimensional transient thermal behavior of homogeneous charring materials in reentry capsules. As the numerical results indicate, the pyrolysis rate and the surface temperature under a given heat flux rise abruptly in the beginning, then reach a plateau, but the temperature at the bottom rises very slowly to prevent the structural materials from being heated seriously. Pyrolysis mechanism can play an important role in thermal protection systems subjected to serious aerodynamic heat.

  11. Isothermal CO2 Gasification Reactivity and Kinetic Models of Biomass Char/Anthracite Char

    Directory of Open Access Journals (Sweden)

    Hai-Bin Zuo

    2015-07-01

    Full Text Available Gasification of four biomass chars and anthracite char were investigated under a CO2 atmosphere using a thermo-gravimetric analyzer. Reactivity differences of chars were considered in terms of pyrolysis temperature, char types, crystallinity, and inherent minerals. The results show that the gasification reactivity of char decreased with the increase of pyrolysis temperature. Char gasification reactivity followed the order of anthracite coal char (AC-char ˂ pine sawdust char (PS-char ˂ peanut hull char (PH-char ˂ wheat straw char (WS-char ˂ corncob char (CB-char under the same pyrolysis temperature. Two repesentative gas-solid models, the random pore model (RPM and the modified random pore model (MRPM, were applied to describe the reactive behaviour of chars. The results indicate RPM performs well to describe gasification rates of chars but cannot predict the phenomenon that there appears to exist a peak conversion for biomass chars at a high conversion rate, where the MRPM performs better.

  12. Nitric oxide reduction over a synthetic coal char

    Energy Technology Data Exchange (ETDEWEB)

    C. Pevida; A. Arenillas; F. Rubiera; J.J. Pis [Instituto Nacional del Carbon, CSIC, Oviedo (Spain)

    2003-07-01

    In the present work, the mechanisms involved in the NO heterogeneous reduction have been investigated. A synthetic coal char was used as the carbon source. This synthetic coal was made from a mixture of model compounds and provides well-known functionalities, including nitrogenated ones, similar to those found in a high volatile bituminous coal. The char was obtained by pyrolysis of the synthetic coal, up to 1123 K, under helium atmosphere in a fixed bed reactor. Char texture and structure were characterised by N{sub 2} and CO{sub 2} adsorption isotherms at 77 and 273 K, respectively, X-ray diffraction, immersion calorimetry in C{sub 6}H{sub 6} and scanning electron microscopy (SEM). Temperature programmed reactions (TPR) were carried out in a thermogravimetric analyser using 400 ppm NO diluted in Ar as the reactant gas. The char was heated at 15 K min{sup -1} from room temperature to 1273 K. Gaseous products were simultaneously analysed by mass spectrometry (MS) and Fourier transform infrared spectroscopy (FTIR). The influence of nitrogen in the solid phase on the reduction mechanism was evaluated by comparing the results for chars with and without nitrogen in their composition. The results of this preliminary study showed that the presence of nitrogen in the chars composition did not favour the heterogeneous NO reduction. In addition, low temperature NO chemisorption on the carbon surface creates complexes that take an active part in the subsequent reactions with NO. 5 refs., 4 figs., 3 tabs.

  13. Gasification of Rice Husk in a Downdraft Gasifier: The Effect of Equivalence Ratio on the Gasification Performance, Properties, and Utilization Analysis of Byproducts of Char and Tar

    Directory of Open Access Journals (Sweden)

    Zhongqing Ma

    2015-03-01

    Full Text Available Rice husks (RH are a potential biomass source for bio-energy production in China, such as bio-gas production by gasification technology. In this paper, a bench-scale downdraft fixed bed gasifier (DFBG and a tar sampling system were designed. The effect of equivalence ratio (ER on gasification performance in terms of the temperature in the gasifier, the composition distribution of the producer gas, and the tar content in the producer gas was studied. The maximum lower heating value of 4.44 MJ/Nm3, minimum tar content of 1.34 g/Nm3, and maximum cold gas efficiency of 50.85% were obtained at ER of 0.211. In addition, the characteristics of gasification byproducts, namely bio-char and bio-tar, were analyzed. The proximate and ultimate analysis (especially of the alkali metal, the surface morphology, the surface area, and the pore size distribution of the rice husk char (RHC were obtained by the use of X-ray fluorescence (XRF and scanning electron microscopy (SEM, as well as by using the Brunauer-Emmett-Teller (BET method. The components of light tar and heavy tar were obtained by using gas chromatography-mass spectrometry (GC-MS.

  14. Hot char-catalytic reforming of volatiles from MSW pyrolysis

    International Nuclear Information System (INIS)

    Wang, Na; Chen, Dezhen; Arena, Umberto; He, Pinjing

    2017-01-01

    Highlights: • Volatile from MSW pyrolysis is reformed with hot char from the same pyrolysis process. • The yields of syngas increase evidently with H 2 being the main contributor and the major component of the syngas. • Pyrolysis oil becomes light and its composition distribution is narrowed. • The HHV, volatile elements and alkali metals contents in the char decrease. • The emissions including SO 2 , NO, NO 2 and HCN changed after reforming process. - Abstract: Volatile products obtained from pyrolysis of municipal solid waste (MSW), including syngas and pyrolysis oil, were forced to contact the hot char from the same pyrolysis process at 500–600 °C in a fixed bed reactor to be reformed. The yields and properties of syngas, char and pyrolysis liquid were investigated; and the energy re-distribution among the products due to char reforming was quantified. The preliminary investigation at lab scale showed that hot char-catalytic reforming of the volatiles leads to an increase in the dry syngas yield from 0.25 to 0.37 N m 3 kg −1 MSW at 550 °C. Accordingly, the carbon conversion ratio into syngas increases from 29.6% to 35.0%; and the MSW chemical energy transferred into syngas increased from 41.8% to 47.4%. The yield of pyrolysis liquid products, including pyrolysis oil and water, decreased from 27.3 to 16.5 wt%, and the molecular weight of the oil becoming lighter. Approximately 60% of the water vapour contained in the volatiles converted into syngas. After reforming, the concentrations of SO 2 and HCN in the syngas decreases, while those of NO and NO 2 increase. The char concentrations of N, H, C and alkali metal species decreased and its higher heating value decreased too.

  15. Effects of Bio-char on Soil Microbes in Herbicide Residual Soils

    Directory of Open Access Journals (Sweden)

    WANG Gen-lin

    2015-10-01

    Full Text Available Effects of biological carbon (bio-char on soil microbial community were studied by pot experiments simulating long residual herbicide residues in soil environment, which clarifed the improvement of biochar and its structural properties on soil microenvironment. The results showed that fungi and actinomycetes had the same effect tendency within 0~0.72 mg·kg-1 in clomazone residue which increased the role of stimulation with crop growth process prolonged, especially in high residue treatment, but strong inhibitory effect on bacteria community was occured early which returned to normal until sugar beet growth to fiftieth day. Soil fungi community decreased with bio-char adding, but had no significant difference with the control. When clomazone residue in soil was below 0.24 mg·kg-1, soil actinomycetes community was higher than control without bio-char, bacteria increased first and then reduced after adding carbon as below 0.12 mg·kg-1. Biochar was ‘deep hole’ structure containing C, O, S and other elements. The results showed that a certain concentration clomazone residue in soil would stimulate soil fungi and actinomycetes to grow. After adding the biochar, the inhibition effect of high herbicides residual on bacterial would be alleviated.

  16. Corrosive components of nutshells and their chars

    Directory of Open Access Journals (Sweden)

    Karczewski Mateusz

    2016-01-01

    Full Text Available Biomass combustion stands among various technologies pointed at fossil fuels consumption decrease. Biomass can be found in very diversified sources spread more evenly across the globe, can be burned with use of traditional combustion solutions and is more CO2 neutral in combustion than their fossil fuel counterparts. On the other hand biomass has several problems with composition that despite its potential diversity. Problem of excess moisture can be already solved by material selection or by preliminary pyrolysis. The main problem concerns however biomass ash composition. Biomass ashes are more prone to have higher quantities of potentially corrosive components than their coal counterparts. The example of such constituents are alkali metals, sulphur and chlorine. Ash basic composition is also important due to various ash properties like its melting temperature and slagging or fouling tendencies. To address the problem, several indices for fast properties prediction and earlier problem identification can be appointed. This work concentrates on ash quality evaluation for potentially attractive biomass fuel from nutshell materials and their corresponding char obtained by pyrolysis in 300, 450 and 550 °C. Pistachio and hazelnut shells with their chars will be analysed for corrosive compounds and their potential influence on combustion process.

  17. Physico-Chemical Characterizations of Sawdust-Derived Bio char as Potential Solid Fuels

    International Nuclear Information System (INIS)

    Wan Azlina Wan Ab Karim Ghani

    2014-01-01

    Characterization Malaysian rubber-wood sawdust derived bio char (MRWSB) produced in the fixed bed pyrolysis under different temperatures (450 to 850 degree Celsius) were studied for its applicability as a solid fuel. A range of analyses were carried out, including bio char oxidation reactivity , inorganic species, oxygen and hydrogen contents in the bio chars, release of heteroatoms in bio char as the gaseous product, and bio char structural evolution during pyrolysis process. The results show that the optimum temperature for carbonization to obtain a char having moderately high yield was found as 450 degree Celsius. Thermogravimetric analyses (TG) shows that temperatures induces a progressively more ordered carbonaceous structure and leads to a significant changes in the bio char reactivity. The process is coupled with the loss of heteroatoms, released as dominantly carbon dioxide (C0 2 ) and carbon dioxide (CO). In addition, the elemental study of wood-derived bio char shows the higher carbon content but with low H/C and 0/C ratio suggested this material was dominated by highly aromatic structures and this were revealed in the Fourier transform infra-red (FTIR). More importantly, insignificant amount of inorganic species is evidenced in the samples. (author)

  18. Mercury adsorption of modified mulberry twig chars in a simulated flue gas.

    Science.gov (United States)

    Shu, Tong; Lu, Ping; He, Nan

    2013-05-01

    Mulberry twig chars were prepared by pyrolysis, steam activation and impregnation with H2O2, ZnCl2 and NaCl. Textural characteristics and surface functional groups were performed using nitrogen adsorption and FTIR, respectively. Mercury adsorption of different modified MT chars was investigated in a quartz fixed-bed absorber. The results indicated that steam activation and H2O2-impregnation can improve pore structure significantly and H2O2-impregnation and chloride-impregnation promote surface functional groups. However, chloride-impregnation has adverse effect on pore structure. Mercury adsorption capacities of impregnated MT chars with 10% or 30% H2O2 are 2.02 and 1.77 times of steam activated MT char, respectively. Mercury adsorption capacity of ZnCl2-impregnated MT char increase with increasing ZnCl2 content and is better than that of NaCl-impregnated MT char at the same chloride content. The modified MT char (MT873-A-Z5) prepared by steam activation following impregnation with 5% ZnCl2 exhibits a higher mercury adsorption capacity (29.55 μg g(-1)) than any other MT chars. Copyright © 2013 Elsevier Ltd. All rights reserved.

  19. Porous Materials - Structure and Properties

    DEFF Research Database (Denmark)

    Nielsen, Anders

    1997-01-01

    The paper presents some viewpoints on the description of the pore structure and the modelling of the properties of the porous building materials. Two examples are given , where it has been possible to connect the pore structure to the properties: Shrinkage of autoclaved aerated concrete...

  20. Effective Diffusion Coefficients in Coal Chars

    DEFF Research Database (Denmark)

    Johnsson, Jan Erik; Jensen, Anker

    2001-01-01

    Knowledge of effective diffusion coefficients in char particles is important when interpreting experimental reactivity measurements and modeling char combustion or NO and N2O reduction. In this work, NO and N2O reaction with a bituminous coal char was studied in a fixed-bed quartz glass reactor....... In the case of strong pore diffusion limitations, the error in the interpretation of experimental results using the mean pore radius could be a factor of 5 on the intrinsic rate constant. For an average coal char reacting with oxygen at 1300 K, this would be the case for particle sizes larger than about 50...

  1. Structural Properties of Ferroelectric Perovskites

    National Research Council Canada - National Science Library

    Vanderbilt, David

    1998-01-01

    Under this research grant, we carried out realistic first-principles computer calculations of the ground-state and finite-temperature structural and dielectric properties of cubic perovskite materials...

  2. The ChemChar process

    International Nuclear Information System (INIS)

    Manahan, S.E.; Kinner, L.L.; Larsen, D.W.

    1992-01-01

    This paper reports on reverse-burn gasification is a thermochemical process that offers a number of advantages over conventional incineration for the treatment of a variety of waste materials. Patented as the ChemChar Process, reverse-burn gasification can treat wastes in the forms of solids, liquids, sludges, and soils. Waste constituents are destroyed by conversion to a combustible gas and to a dry, inert, carbonaceous solid which is either non-hazardous or can be readily mixed with cement to prevent leaching of the radioactive, toxic, or heavy metal constituents that are retained in the char residue or ash. In this way, reverse-burn gasification can be a very effective method for treating organic waste sludges containing heavy metals and mixed wastes consisting of hazardous chemicals contaminated with radioactive substances. As with any gasification waste treatment process, reverse-burn gasification offers inherent advantages in the areas of destruction efficiency and emissions control. This is because, instead of an exhaust gas that must treated to control emissions, gasification produces a combustible gas that is burned. Trace levels of contaminants are destroyed in burning the gas, and a catalyst may be employed, if necessary

  3. Feasibility of mercury removal from simulated flue gas by activated chars made from poultry manures.

    Science.gov (United States)

    Klasson, K Thomas; Lima, Isabel M; Boihem, Larry L; Wartelle, Lynda H

    2010-12-01

    Increased emphasis on reduction of mercury emissions from coal fired electric power plants has resulted in environmental regulations that may in the future require application of activated carbons as mercury sorbents for mercury removal. At the same time, the quantity of poultry manure generated each year is large and technologies that take advantage of the material should be explored. The purpose of the work was to obtain preliminary data to investigate if activated chars made from different poultry manures could adsorb mercury from simulated flue gas. In laboratory experiments, activated chars made from chicken cake and litter removed mercury from the gas as well as a commercial alternative. It was also found that acid-washing these chars after activation may improve pore structure but does not influence the mercury removal efficiency. Activated chars were also made from turkey cake and litter. These raw materials produced activated chars with similar pore structure as those made from chicken manure, but they did not adsorb mercury as well. Acid-washing the turkey manure-based chars improved their performance, but this step would add to the cost of production. Preliminary evaluations suggest that unwashed activated chars may cost as little as $0.95/kg to produce. Published by Elsevier Ltd.

  4. DDGS chars gasification with CO{sub 2}: a kinetic study using TG analysis

    Energy Technology Data Exchange (ETDEWEB)

    Meng, Xiangmei; Jong, Wiebren de; Fu, Ningjie; Verkooijen, Adrian H.M. [Delft University of Technology, Process and Energy Department, Faculty of Mechanical, Maritime and Materials Engineering, Delft (Netherlands)

    2011-12-15

    obtained at lower heating rate had a less porous structure. Generally, the predicted results using both models showed a fairly good agreement with experimental results, and SCM model suited slightly suitable better for char gasification at high temperature. (orig.)

  5. Evaluation of the Compressive Strength of Cement-Spent Resins Matrix Mixed with Bio char

    International Nuclear Information System (INIS)

    Zalina Laili; Muhamad Samudi Yasir; Zalina Laili; Mohd Abdul Wahab; Nur Azna Mahmud; Nurfazlina Zainal Abidin

    2015-01-01

    The evaluation of compressive strength of cement-spent resins matrix mixed with bio char was investigated. In this study, bio char with different percentage (5 %, 8 %, 11 % 14 % and 18 %) was used as alternative admixture material for cement solidification of spent resins. Some properties of the physical and chemical of spent resins and bio char were also investigated. The performance of cemented spent resins with the addition of bio char was evaluated based on their compressive strength and the water resistance test. The compressive strength was evaluated at three different curing periods of 7, 14 and 28 days, while 4 weeks of immersion in distilled water was chosen for water resistance test. The result indicated that the compressive strength at 7, 14 and 28 days of curing periods were above the minimum criterion for example > 3.45 MPa of acceptable level for cemented waste form. Statistical analysis showed that there was no significant relationship between the compressive strength of the specimen and the percentage of bio char content. Result from the water resistance test showed that only one specimen that contained of 5 % of bio char failed the water resistance test due to the high of spent resins/ bio char ratio. The compressive strength of cement solidified spent resins was found increased after the water resistance test indicating further hydration occurred after immersed in water. The results of this study also suggest that the specimen with 8 %, 11 %, 14 % and 18 % of bio char content were resistance in water and suitable for the leaching study of radionuclides from cement-bio char-spent resins matrix. (author)

  6. Reactivity of coal chars prepared in a fluidised bed reactor at different burn-off degrees

    Energy Technology Data Exchange (ETDEWEB)

    Moreno, A.H.; Arenillas, A.; Rubiera, F.; Fuente, E.; Pis, J.J. [Inst. Nacional del Carbon, Oviedo (Spain)

    1997-12-31

    The main goal of this work has been to study the effect of the textural properties of coal chars, obtained from partially burned coal, on their reactivity to oxygen. A low volatile bituminous coal was used to prepare chars, with different levels of burn-off, in a bench-scale fluidised bed reactor. Textural characterisation of the samples was accomplished by measuring true (helium) and apparent (mercury) densities, and mercury porosimetry. An increase in the burn-off degree gave rise to a densification of the chars. Porosity development greatly changed during progressive burning of the samples. DTG burning profiles and isothermal gasification were utilised to estimate the reactivities of the precursor coal and its partially burned chars. Reactivity reached a maximum value at an intermediate burn-off and strongly decreased at higher burn-off degrees. (orig.)

  7. Pyrolysis of flax straw: Characterization of char, liquid, and gas as fuel

    Science.gov (United States)

    Tushar, Mohammad Shahed Hasan Khan

    The demand for energy continues to outstrip its supply and necessitates the development of renewable energy options. Biomass has been recognized as a major renewable energy source to supplement the declining fossil fuel source of energy. It is the most popular form of renewable energy and, currently, biofuel production is becoming more promising. Being carbon neutral, readily available, and low in sulphur content makes biomass a very promising source of renewable energy. In the present research, both the isothermal and non-isothermal pressurized pyrolysis of flax straw is studied for the first time. In case of isothermal pyrolysis, the influence of pyrolysis temperature and reaction time on char yield and morphology was investigated. The applied pyrolysis temperature was varied between 300 and 500°C. The reaction time was varied from 15 to 60 min. The char yield was found to decrease as pyrolysis temperature and reaction time increased. The char structure and surface morphology were thoroughly investigated by means of x-ray diffraction (XRD), temperature-programmed oxidation (TPO), and scanning electron microscopy (SEM). The degree of porosity and graphitization increased as pyrolysis temperature and time increased. In fact, the experiment performed at 500°C for 1h duration did not yield any char; only residual ash could be obtained. The TPO studies on the char samples corroborated the XRD findings and showed the presence of two types of carbon, namely, amorphous filamentous carbon and graphitic carbon. A thermogravimetric analysis (TGA) of the char was performed to gain an understanding of combustion kinetics and reactivity. It implied that the reactivity of the char decreases as temperature increases, and this finding is well supported by the TPO, TGA, SEM, and XRD characterization data. Furthermore, an empirical global model was devised based on the power law to estimate activation energy and other kinetic parameters. For the non-isothermal pressurized

  8. Micro-PIXE studies of char populations in northern Canada

    International Nuclear Information System (INIS)

    Campbell, J.L.; Babaluk, J.A.; Halden, N.M.; Kristofferson, A.H.; Maxwell, J.A.; Mejia, S.R.; Reist, J.D.; Teesdale, W.J.

    1999-01-01

    Micro-PIXE analysis of trace elements in otoliths has been used as the basis for several projects on char, a fish that is important for aboriginal subsistence fisheries in Arctic Canada. Life-history patterns were originally inferred from micro-PIXE line scans of Sr distribution. These were confirmed by superposition of Sr distribution patterns on optical images of otoliths of tag-recaptured fish. Char from various populations showed differentiation in otolith primordial Sr concentration; this enables us to differentiate biological stocks and, it is hoped, eventually to assign individuals from mixed-stock fisheries to their stock of origin. Zn oscillations also correlate with annular structure and provide additional temporally constrained information on fish habitat and behaviour

  9. Co-gasification of coal and biomass: Synergy, characterization and reactivity of the residual char.

    Science.gov (United States)

    Hu, Junhao; Shao, Jingai; Yang, Haiping; Lin, Guiying; Chen, Yingquan; Wang, Xianhua; Zhang, Wennan; Chen, Hanping

    2017-11-01

    The synergy effect between coal and biomass in their co-gasification was studied in a vertical fixed bed reactor, and the physic-chemical structural characteristics and gasification reactivity of the residual char obtained from co-gasification were also investigated. The results shows that, conversion of the residual char and tar into gas is enhanced due to the synergy effect between coal and biomass. The physical structure of residual char shows more pore on coal char when more biomass is added in the co-gasification. The migration of inorganic elements between coal and biomass was found, the formation and competitive role of K 2 SiO 3 , KAlSiO 4 , and Ca 3 Al 2 (SiO 4 ) 3 is a mechanism behind the synergy. The graphization degree is enhanced but size of graphite crystallite in the residual char decreases with biomass blending ratio increasing. TGA results strongly suggest the big difference in the reactivity of chars derived from coal and biomass in spite of influence from co-gasification. Copyright © 2017 Elsevier Ltd. All rights reserved.

  10. Structural properties of matrix metalloproteinases.

    Science.gov (United States)

    Bode, W; Fernandez-Catalan, C; Tschesche, H; Grams, F; Nagase, H; Maskos, K

    1999-04-01

    Matrix metalloproteinases (MMPs) are involved in extracellular matrix degradation. Their proteolytic activity must be precisely regulated by their endogenous protein inhibitors, the tissue inhibitors of metalloproteinases (TIMPs). Disruption of this balance results in serious diseases such as arthritis, tumour growth and metastasis. Knowledge of the tertiary structures of the proteins involved is crucial for understanding their functional properties and interference with associated dysfunctions. Within the last few years, several three-dimensional MMP and MMP-TIMP structures became available, showing the domain organization, polypeptide fold and main specificity determinants. Complexes of the catalytic MMP domains with various synthetic inhibitors enabled the structure-based design and improvement of high-affinity ligands, which might be elaborated into drugs. A multitude of reviews surveying work done on all aspects of MMPs have appeared in recent years, but none of them has focused on the three-dimensional structures. This review was written to close the gap.

  11. The potential applications of using compost chars for removing the hydrophobic herbicide atrazine from solution.

    Science.gov (United States)

    Tsui, Lo; Roy, William R

    2008-09-01

    One commercial compost sample was pyrolyzed to produce chars as a sorbent for removing the herbicide atrazine from solution. The sorption behavior of compost-based char was compared with that of an activated carbon derived from corn stillage. When compost was pyrolyzed, the char yield was greater than 45% when heated under air, and 52% when heated under N(2). In contrast, when the corn stillage was pyrolyzed under N(2), the yield was only 22%. The N(2)-BET surface area of corn stillage activated carbon was 439 m(2)/g, which was much greater than the maximum compost char surface area of 72 m(2)/g. However, the sorption affinity of the compost char for dissolved atrazine was comparable to that of the corn stillage activated carbon. This similarity could have resulted from the initial organic waste being subjected to a relatively long period of thermal processes during composting, and thus, the compost was more thermally stable when compared with the raw materials. In addition, microorganisms transformed the organic wastes into amorphous humic substances, and thus, it was likely that the microporisity was enhanced. Although this micropore structure could not be detected by the N(2)-BET method, it was apparent in the atrazine sorption experiment. Overall, the experimental results suggested that the compost sample in current study was a relatively stable material thermally for producing char, and that it has the potential as a feed stock for making high-quality activated carbon.

  12. Encapsulation of phase change materials using rice-husk-char

    International Nuclear Information System (INIS)

    Gondora, Wayne; Doudin, Khalid; Nowakowski, Daniel J.; Xiao, Bo; Ding, Yulong; Bridgwater, Tony; Yuan, Qingchun

    2016-01-01

    Highlights: • Rice-husk-char particles are successfully used in the encapsulation of phase change materials. • Carbon-based phase change microcapsules aim at using the high thermal conductivity of carbon materials. • Carbon from biomass can be used in low and intermediate heat harvest and storage. • Carbon in biomass is captured and to be used in improving energy efficiency. - Abstract: This paper explored a new approach to prepare phase change microcapsules using carbon-based particles via Pickering emulsions for energy storage applications. Rice-husk-char, a by-product in biofuel production, containing 53.58 wt% of carbon was used as a model carbon-based material to encapsulate hexadecane. As a model phase change material, hexadecane was emulsified in aqueous suspensions of rice-husk-char nanoparticles. Water soluble polymers poly(diallyldimethyl-ammonium chloride) and poly(sodium styrene sulfonate) were used to fix the rice-husk-char nanoparticles on the emulsion droplets through layer-by-layer assembly to enhance the structural stability of the microcapsules. The microcapsules formed are composed of a thin shell encompassing a large core consisting of hexadecane. Thermal gravimetrical and differential scanning calorimeter analyses showed the phase change enthalpy of 80.9 kJ kg"−"1 or 120.0 MJ m"−"3. Design criteria of phase change microcapsules and preparation considerations were discussed in terms of desired applications. This work demonstrated possible utilisations of biomass-originated carbon-based material for thermal energy recovery and storage applications, which can be a new route of carbon capture and utilisation.

  13. Grain boundary structure and properties

    International Nuclear Information System (INIS)

    Balluffi, R.W.

    1979-01-01

    An attempt is made to distinguish those fundamental aspects of grain boundaries which should be relevant to the problem of the time dependent fracture of high temperature structural materials. These include the basic phenomena which are thought to be associated with cavitation and cracking at grain boundaries during service and with the more general microstructural changes which occur during both processing and service. A very brief discussion of the current state of our knowledge of these fundamentals is given. Included are the following: (1) structure of ideal perfect boundaries; (2) defect structure of grain boundaries; (3) diffusion at grain boundaries; (4) grain boundaries as sources/sinks for point defects; (5) grain boundary migration; (6) dislocation phenomena at grain boundaries; (7) atomic bonding and cohesion at grain boundaries; (8) non-equilibrium properties of grain boundaries; and (9) techniques for studying grain boundaries

  14. Coke, char and organic waste behaviour in the blast furnace with high injection rate

    Directory of Open Access Journals (Sweden)

    Gudenau, H. W.

    2003-10-01

    Full Text Available Blast furnace operation with low coke rate, high amount of auxiliary hydrocarbons and use of nut coke causes a change in coke quality requirements. In particular, not burned in the raceway residues of injected substances (char and ash can influence the coke behaviour. Therefore combustion efficiency of various organic wastes with and without pulverized coal injection (PCI and coal char has been investigated under the raceway simulation conditions. Mixing of various substances improves their combustion efficiency. Study on coke gasification by carbon dioxide in the presence of char showed that with the increase of char concentration, coke strength reduction becomes smaller. The reactivity of char with CO2 is higher than that of coke. Therefore char is consumed preferentially. In presence of injected char, total pore volume in coke and its wear resistance were increased. Coke reactivity and microstructure in the presence of various kinds of ash has been studied. Many ash spheres were observed on the surface of coke matrix and its size was dependent on ash properties.

    La operación del horno alto con una tasa baja de coque, una cantidad elevada de hidrocarburos auxiliares y el empleo de coque calibrado, origina un cambio en las necesidades de calidad del coque. En particular, pueden influir en el comportamiento del coque los residuos inquemados en el raceway (cavidad enfrente a las toberas del horno de las sustancias que se inyectan (char y cenizas. El char es el residuo de carbón que se origina después que el carbón libera sus sustancias volátiles. Por tanto, se ha investigado la eficiencia de la combustión de varios residuos orgánicos con y sin inyección de carbón pulverizado (ICP y char, bajo las condiciones de simulación del raceway. La mezcla de varias sustancias mejora la eficiencia a la combustión. El estudio de la gasificación del coque por el dióxido de carbono en la

  15. Quasicrystals Structure and Physical Properties

    CERN Document Server

    Trebin, Hans-Rainer

    2003-01-01

    A comprehensive and up-to-date review, covering the broad range of this outstanding class of materials among intermetallic alloys. Starting with metallurgy and characterization, the authors continue on to structure and mathematical modeling. They use this basis to move on to dealing with electronic, magnetic, thermal, dynamic and mechanical properties, before finally providing an insight into surfaces and thin films. The authors belong to a research program on quasicrystals, sponsored by the German Research Society and managed by Hans-Rainer Trebin, such that most of the latest results are pre

  16. Kinetic Analysis of Char Thermal Deactivation

    DEFF Research Database (Denmark)

    Zolin, Alfredo; Jensen, Anker; Dam-Johansen, Kim

    2001-01-01

    and demineralized Dietz from USA, and two alternative fuels, Danish leached straw and petroleum coke, were used in the experiments. The coal chars from demineralized Dietz, Illinois no. 6, and Cerrejon deactivate readily, whereas petroleum coke and Blair Athol show a relative high resistance to deactivation....... Leached straw deactivates significantly, but maintains at any heat-treatment temperature a higher reactivity than the other chars. The inertinite-rich coal Blair Athol is more resistant to deactivation than two vitrinite-rich coals of the same ASTM rank, Cerrejon and Illinois no. 6. Cerrejon and Illinois...

  17. The Effect of Polymer Char on Nitridation Kinetics of Silicon

    Science.gov (United States)

    Chan, Rickmond C.; Bhatt, Ramakrishna T.

    1994-01-01

    Effects of polymer char on nitridation kinetics of attrition milled silicon powder have been investigated from 1200 to 1350 C. Results indicate that at and above 1250 C, the silicon compacts containing 3.5 wt percent polymer char were fully converted to Si3N4 after 24 hr exposure in nitrogen. In contrast, the silicon compacts without polymer char could not be fully converted to Si3N4 at 1350 C under similar exposure conditions. At 1250 and 1350 C, the silicon compacts with polymer char showed faster nitridation kinetics than those without the polymer char. As the polymer char content is increased, the amount of SiC in the nitrided material is also increased. By adding small amounts (approx. 2.5 wt percent) of NiO, the silicon compacts containing polymer char can be completely nitrided at 1200 C. The probable mechanism for the accelerated nitridation of silicon containing polymer char is discussed.

  18. Lead sorption characteristics of various chicken bone part-derived chars.

    Science.gov (United States)

    Park, Jong-Hwan; Wang, Jim J; Kim, Seong-Heon; Kang, Se-Won; Cho, Ju-Sik; Delaune, Ronald D; Ok, Yong Sik; Seo, Dong-Cheol

    2018-01-18

    Recycling food waste for beneficial use is becoming increasingly important in resource-limited economy. In this study, waste chicken bones of different parts from restaurant industry were pyrolyzed at 600 °C and evaluated for char physicochemical properties and Pb sorption characteristics. Lead adsorption isotherms by different chicken bone chars were carried out with initial Pb concentration range of 1-1000 mg L -1 at pH 5. The Pb adsorption data were better described by the Langmuir model (R 2  = 0.9289-0.9937; ARE = 22.7-29.3%) than the Freundlich model (R 2  = 0.8684-0.9544; ARE = 35.4-72.0%). Among the chars derived from different chicken bone parts, the tibia bone char exhibited the highest maximum Pb adsorption capacity of 263 mg g -1 followed by the pelvis (222 mg g -1 ), ribs (208 mg g -1 ), clavicle (179 mg g -1 ), vertebrae (159 mg g -1 ), and humerus (135 mg g -1 ). The Pb adsorption capacities were significantly and positively correlated with the surface area, phosphate release amount, and total phosphorus content of chicken bone chars (r ≥ 0.9711). On the other hand, approximately 75-88% of the adsorbed Pb on the chicken bone chars was desorbable with 0.1 M HCl, indicating their recyclability for reuse. Results demonstrated that chicken bone char could be used as an effective adsorbent for Pb removal in wastewater.

  19. Adsorption characteristics of SO{sub 2}, NO by steam activated biomass chars

    Energy Technology Data Exchange (ETDEWEB)

    Lu, Fei; Shu, Tong; Wang, Kuan; Lu, Ping [Nanjing Normal Univ. (China). School of Energy and Mechanical Engineering

    2013-07-01

    Wheat straw and rice husk collected from the suburb of Nanjing, China, were prepared to different kinds of steam activated biomass-based chars, and the adsorption characteristics of the biomass-based chars was carried out in a fixed bed reactor. The specific surface area and pore structure of different biomass chars were measured by nitrogen adsorption-desorption analysis instrument at 77K. The effects of biomass type, pyrolysis temperature, heating rate, activation temperature and concentration of SO{sub 2}, NO on the adsorption efficiency of SO{sub 2}, NO were analyzed. The results indicated that the steam activation has significant effects on the specific surface area, total pore volume and micro-morphology of biomass chars by improving the internal structure. The adsorption efficiency of SO{sub 2}, NO increased with the decreasing of SO{sub 2}, NO concentration in the experimental range. The optimal condition of char preparation (873K, fast pyrolysis) and steam activation (1,073K) was proposed based on the adsorption efficiency and adsorption volume of SO{sub 2}, NO. It builds a theoretical basis for industrial applications of biomass.

  20. Abundant and stable char residues in soils: implications for soil fertility and carbon sequestration.

    Science.gov (United States)

    Mao, J-D; Johnson, R L; Lehmann, J; Olk, D C; Neves, E G; Thompson, M L; Schmidt-Rohr, K

    2012-09-04

    Large-scale soil application of biochar may enhance soil fertility, increasing crop production for the growing human population, while also sequestering atmospheric carbon. But reaching these beneficial outcomes requires an understanding of the relationships among biochar's structure, stability, and contribution to soil fertility. Using quantitative (13)C nuclear magnetic resonance (NMR) spectroscopy, we show that Terra Preta soils (fertile anthropogenic dark earths in Amazonia that were enriched with char >800 years ago) consist predominantly of char residues composed of ~6 fused aromatic rings substituted by COO(-) groups that significantly increase the soils' cation-exchange capacity and thus the retention of plant nutrients. We also show that highly productive, grassland-derived soils in the U.S. (Mollisols) contain char (generated by presettlement fires) that is structurally comparable to char in the Terra Preta soils and much more abundant than previously thought (~40-50% of organic C). Our findings indicate that these oxidized char residues represent a particularly stable, abundant, and fertility-enhancing form of soil organic matter.

  1. Phosphorus recovery from sewage sludge char ash

    NARCIS (Netherlands)

    Atienza-Martinez, M.; Gea, G.; Arauzo, J.; Kersten, Sascha R.A.; Kootstra, A.M.J.

    2014-01-01

    Phosphorus was recovered from the ash obtained after combustion at different temperatures (600 °C, 750 °C and 900 °C) and after gasification (at 820 °C using a mixture of air and steam as fluidising agent) of char from sewage sludge fast pyrolysis carried out at 530 °C. Depending on the leaching

  2. Characterisation of coal and chars in fluidised bed gasification

    CSIR Research Space (South Africa)

    Oboirien, BO

    2009-03-01

    Full Text Available impact on the physical structure of the residual char. 4 In summary, the distinct burnout characteristics of coals could be attributed to the differences in the macerals and microlithotypes compositions, and mineral matter distribution....0 2.5 3.0 3.5 4.0 4.5 5.0 5.5 6.0 6.5 7.0 7.5 8.0 8.5 9.0 9.5 10.0 REFLECTANCE % RE LA TIV E FR EQ UE NC Y % Increasing reflectance, decreasing volatiles, expected Increase in ignition temperature and time for burn-out Figure...

  3. Investigation of the Anisotropic Behavior of Wood Char Particles during Gasification

    DEFF Research Database (Denmark)

    Henriksen, Ulrik Birk; Hindsgaul, Claus; Qvale, Einar Bjørn

    2006-01-01

    (R) and tangential (T) directions. Despite this, this property has normally not been included in mathematical model descriptions of gasification of thermally thick particles. The present paper describes a study of the influence of the anisotropy on the reactivity of thermally thick char particles...... of the normal to the greater surface of the slabs L, R, or T (see Figure 8). When the smaller surfaces were coated with alumina silicate, the gasification agent could only enter the interior of the slabs through the greater surfaces. Thermally thick char particles from beech and pine reacted more slowly...

  4. Influence of char texture and volatile matter content on NO emissions

    Energy Technology Data Exchange (ETDEWEB)

    Arenillas, A.; Rubiera, F.; Parra, J.B.; Moreno, A.H.; Pis, J.J. [Inst. National Vacional del Carbon, Oviedo (Spain)

    1997-12-31

    A low volatile bituminous coal was pyrolysed in a quartz reactor under nitrogen at different heating rates (5, 10, 50 and 150 C/min) up to a final temperature of 850 C. Textural characterisation (mercury porosimetry, adsorption isotherms of N{sub 2} and CO{sub 2}, ASA) of the chars was carried out in order to study the influence of textural properties on char reactivity and NO emissions. The role of volatile matter content in the emission of nitrogen compounds was also investigated. A thermogravimetric analyser linked to a quadrupole mass spectrometer (TG-MS) was used to study the compounds evolved during pyrolysis and combustion. (orig.)

  5. Sulfur retention by ash during coal combustion. Part I. A model of char particle combustion

    Directory of Open Access Journals (Sweden)

    BORISLAV GRUBOR

    2003-02-01

    Full Text Available A model for the combustion of porous char particles as a basis for modeling the process of sulfur retention by ash during coal combustion is developed in this paper. The model belongs to the microscopic intrinsic models and describes the dynamic behavior of a porous char particle during comustion, taking into account temporal and spatial changes of all important physical properties of the char particle and various combustion parameters. The parametric analysis of the enhanced model shows that the model represents a good basis for the development of a model for the process of sulfur retention by ash during coal combustion. The model enables the prediction of the values of all parameters necessary for the introduction of reactions between sulfur compounds and mineral components in ash, primarily calcium oxide.

  6. Cellulose nanomaterials review: structure, properties and nanocomposites

    Science.gov (United States)

    Robert J. Moon; Ashlie Martini; John Nairn; John Simonsen; Jeff Youngblood

    2011-01-01

    This critical review provides a processing-structure-property perspective on recent advances in cellulose nanoparticles and composites produced from them. It summarizes cellulose nanoparticles in terms of particle morphology, crystal structure, and properties. Also described are the self-assembly and rheological properties of cellulose nanoparticle suspensions. The...

  7. Temperature influence on the fast pyrolysis of manure samples: char, bio-oil and gases production

    Science.gov (United States)

    Fernandez-Lopez, Maria; Anastasakis, Kostas; De Jong, Wiebren; Valverde, Jose Luis; Sanchez-Silva, Luz

    2017-11-01

    Fast pyrolysis characterization of three dry manure samples was studied using a pyrolyzer. A heating rate of 600°C/s and a holding time of 10 s were selected to reproduce industrial conditions. The effect of the peak pyrolysis temperature (600, 800 and 1000°C) on the pyrolysis product yield and composition was evaluated. Char and bio-oil were gravimetrically quantified. Scanning electron microscopy (SEM) was used to analyse the char structure. H2, CH4, CO and CO2 were measured by means of gas chromatography (GC). A decrease in the char yield and an increase of the gas yield were observed when temperature increased. From 800°C on, it was observed that the char yield of samples Dig R and SW were constant, which indicated that the primary devolatilization reactions stopped. This fact was also corroborated by GC analysis. The bio-oil yield slightly increased with temperature, showing a maximum of 20.7 and 27.8 wt.% for samples Pre and SW, respectively, whereas sample Dig R showed a maximum yield of 16.5 wt.% at 800°C. CO2 and CO were the main released gases whereas H2 and CH4 production increased with temperature. Finally, an increase of char porosity was observed with temperature.

  8. Temperature influence on the fast pyrolysis of manure samples: char, bio-oil and gases production

    Directory of Open Access Journals (Sweden)

    Fernandez-Lopez Maria

    2017-01-01

    Full Text Available Fast pyrolysis characterization of three dry manure samples was studied using a pyrolyzer. A heating rate of 600°C/s and a holding time of 10 s were selected to reproduce industrial conditions. The effect of the peak pyrolysis temperature (600, 800 and 1000°C on the pyrolysis product yield and composition was evaluated. Char and bio-oil were gravimetrically quantified. Scanning electron microscopy (SEM was used to analyse the char structure. H2, CH4, CO and CO2 were measured by means of gas chromatography (GC. A decrease in the char yield and an increase of the gas yield were observed when temperature increased. From 800°C on, it was observed that the char yield of samples Dig R and SW were constant, which indicated that the primary devolatilization reactions stopped. This fact was also corroborated by GC analysis. The bio-oil yield slightly increased with temperature, showing a maximum of 20.7 and 27.8 wt.% for samples Pre and SW, respectively, whereas sample Dig R showed a maximum yield of 16.5 wt.% at 800°C. CO2 and CO were the main released gases whereas H2 and CH4 production increased with temperature. Finally, an increase of char porosity was observed with temperature.

  9. Mechanism and Thermochemistry of Coal Char Oxidation and Desorption of Surface Oxides

    DEFF Research Database (Denmark)

    Levi, Gianluca; Causà, Mauro; Lacovig, Paolo

    2017-01-01

    The present study investigates the coal char combustion by a combination of thermochemical and X-ray photoemission spectroscopy (XPS) analyses. Thermoanalytical methods (differential thermogravimetry, differential scanning calorimetry, and temperature-programmed desorption) are used to identify...... the key reactive steps that occur upon oxidation and heating of coal char (chemisorption, structural rearrangement and switchover of surface oxides, and desorption) and their energetics. XPS is used to reveal the chemical nature of the surface oxides that populate the char surface and to monitor...... functionalities prevail. The rearrangement of epoxy during preoxidation goes together with activation of the more stable and less reactive carbon sites. Results are in good agreement with semi-lumped kinetic models of carbon oxidation, which include (1) formation of "metastable" surface oxides, (2) complex...

  10. Effect of formation conditions on biochars: Compositional and structural properties of cellulose, lignin, and pine biochars

    International Nuclear Information System (INIS)

    Rutherford, David W.; Wershaw, Robert L.; Rostad, Colleen E.; Kelly, Charlene N.

    2012-01-01

    The application of biochar to soil has been proposed as a long-term sink for atmospheric carbon dioxide in terrestrial ecosystems while providing improved soil fertility and increased crop production. Because biochar differs from the widely documented activated carbon, initial characterization information on effects of formation conditions on physical and chemical properties of biochar is important prior to its large-scale incorporation into soils. Plant biomass is composed primarily of cellulose and lignin. As a means of predicting biochar characteristics, samples of cellulose, lignin, and pine were charred under a nitrogen atmosphere at temperatures ranging from 250 °C to 500 °C for times ranging from 1 h to 168 h. Mass loss, elemental composition (carbon, hydrogen, and oxygen), Fourier transform infrared and 13 C Nuclear Magnetic Resonance (NMR) spectra of the biochars produced were compared. Mass loss combined with NMR spectrometry showed that the initial rapid loss of material is attributed to aliphatic components, which are either lost or converted to aromatic carbon early in the charring process, and oxygen was lost more rapidly than carbon. The biomass contains a labile oxygen fraction that is quickly removed or lost upon initial heating, and a recalcitrant oxygen fraction which remains fixed in the char. If biochar is to be incorporated into agricultural soils, formation conditions should be tailored to optimize desirable characteristics, such as recalcitrance to degradation, soil fertility and pollutant sequestration, and minimize less desirable characteristics of degradability or low yield (mass loss). -- Highlights: ► Effects of formation conditions on physical and chemical properties of biochar. ► Cellulose, lignin, pine charred under inert atmosphere at various times and temperatures. ► Mass loss, elemental composition (C, H, and O), FTIR, NMR spectra compared. ► Aliphatic components either lost or converted to aromatic carbon early in

  11. Structural property of platinum mononitride

    International Nuclear Information System (INIS)

    Yu, L.H.; Yao, K.L.; Liu, Z.L.; Zhang, Y.S.

    2007-01-01

    The structural stability and pressure-induced structural phase transition of platinum mononitride (PtN), as well as its electronic structure, were studied using the full potential augmented plane wave plus local orbitals method with the generalized gradient approximation (GGA) exchange-correlation functional. The total energy calculations show that the optimized wurtzite structure is most stable energetically among four structures: zinc blende, rocksalt, CsCl and wurtzite, which reveals the platinum mononitride PtN perhaps crystallizes in the wurtzite structure; the pressure of phase transition from wurtzite to rocksalt is predicted to be 41.4 GPa.The calculated bulk modulus of the wurtzite structure is 99.41 GPa, which is smaller than that of the other three structures and face-centered cubic Pt. The band structure calculations show wurtzite PtN is metallic

  12. Thermal Conversion of Pine Wood Char to Carbon Nanomaterials in the Presence of Iron Nanoparticles

    Science.gov (United States)

    Sung Phil Mun; Zhiyong Cai; Fumiya Watanabe; Umesh P. Agarwal; Jilei. Zhang

    2012-01-01

    Southern yellow pine (Pinus taeda) wood char powder was thermally treated at 1,000:C in the presence of a 25-nm-size Fe nanoparticle catalyst. The thermally treated carbon materials were analyzed by Raman spectroscopy and high-resolution transmission electron microscopy. Well-aligned graphitic carbon structures with 15 to 17 layers on...

  13. Mineral-char interaction during gasification of high-ash coals in fluidized-bed gasification

    CSIR Research Space (South Africa)

    Oboirien, BO

    2011-09-01

    Full Text Available -enriched conditions, while X-ray spectroscopy [and energy-dispersive spectrometry (EDS)] mapping was used to determine the distribution of elements, such as Si, Al, Mg, Ca, and K, in the same chars. The higher ordered structure of the carbon around the melted minerals...

  14. Structural and dynamical properties of Yukawa balls

    International Nuclear Information System (INIS)

    Block, D; Kroll, M; Arp, O; Piel, A; Kaeding, S; Ivanov, Y; Melzer, A; Henning, C; Baumgartner, H; Ludwig, P; Bonitz, M

    2007-01-01

    To study the structural and dynamical properties of finite 3D dust clouds (Yukawa balls) new diagnostic tools have been developed. This contribution describes the progress towards 3D diagnostics for measuring the particle positions. It is shown that these diagnostics are capable of investigating the structural and dynamical properties of Yukawa balls and gaining insight into their basic construction principles

  15. Structural relaxation: low temperature properties

    International Nuclear Information System (INIS)

    Cruz, F. de la

    1984-01-01

    We discuss the changes in transport and superconducting properties of amorphous Zr 70 Cu 30 , induced by thermal relaxation. The experimental results are used to investigate the relation between the microscopic parameters and the observed physical properties. It is shown that the density of eletronic states determines the shift Tc as well as the variation of the electrical resistivity. It is necessary to assume strong hybridization between s and d bands to understand the eletrodynamic response of the superconductor. (Author) [pt

  16. Ultrasonic Characterisation of Epoxy Resin/Polyethylene Terephthalate (PET Char Powder Composites

    Directory of Open Access Journals (Sweden)

    Imran ORAL

    2016-11-01

    Full Text Available This study is carried out in order to determine the elastic properties of the Epoxy Resin (ER / Polyethylene terephthalate (PET Char Powder Composites by ultrasonic wave velocity measurement method. Plastic waste was recycled as raw material for the preparation of epoxy composite materials. The supplied chars were mixed with epoxy resin matrix at weight percentages of 10 %, 20 % and 30 % for preparing ER/PET Char Powder (PCP composites. The effect of PET char powder on the elastic properties of ER/PCP composites were investigated by ultrasonic pulse-echo method. According to the obtained results, the composition ratio of 80:20 is the most appropriate composition ratio, which gave the highest elastic constants values for ER/PCP composites. On the other hand, the best electrical conductivity value was obtained for 70:30 composition ratio. It was observed that ultrasonic shear wave velocity correlated more perfectly than any other parameters with hardness.DOI: http://dx.doi.org/10.5755/j01.ms.22.4.12190

  17. Structure, processing, and properties of potatoes

    Science.gov (United States)

    Lloyd, Isabel K.; Kolos, Kimberly R.; Menegaux, Edmond C.; Luo, Huy; McCuen, Richard H.; Regan, Thomas M.

    1992-06-01

    The objective of this experiment and lesson intended for high school students in an engineering or materials science course or college freshmen is to demonstrate the relation between processing, structure, and thermodynamic and physical properties. The specific objectives are to show the effect of structure and structural changes on thermodynamic properties (specific heat) and physical properties (compressive strength); to illustrate the first law of thermodynamics; to compare boiling a potato in water with cooking it in a microwave in terms of the rate of structural change and the energy consumed to 'process' the potato; and to demonstrate compression testing.

  18. Structure, processing, and properties of potatoes

    Science.gov (United States)

    Lloyd, Isabel K.; Kolos, Kimberly R.; Menegaux, Edmond C.; Luo, Huy; Mccuen, Richard H.; Regan, Thomas M.

    1992-01-01

    The objective of this experiment and lesson intended for high school students in an engineering or materials science course or college freshmen is to demonstrate the relation between processing, structure, and thermodynamic and physical properties. The specific objectives are to show the effect of structure and structural changes on thermodynamic properties (specific heat) and physical properties (compressive strength); to illustrate the first law of thermodynamics; to compare boiling a potato in water with cooking it in a microwave in terms of the rate of structural change and the energy consumed to 'process' the potato; and to demonstrate compression testing.

  19. Intermetallics structures, properties, and statistics

    CERN Document Server

    Steurer, Walter

    2016-01-01

    The focus of this book is clearly on the statistics, topology, and geometry of crystal structures and crystal structure types. This allows one to uncover important structural relationships and to illustrate the relative simplicity of most of the general structural building principles. It also allows one to show that a large variety of actual structures can be related to a rather small number of aristotypes. It is important that this book is readable and beneficial in the one way or another for everyone interested in intermetallic phases, from graduate students to experts in solid-state chemistry/physics/materials science. For that purpose it avoids using an enigmatic abstract terminology for the classification of structures. The focus on the statistical analysis of structures and structure types should be seen as an attempt to draw the background of the big picture of intermetallics, and to point to the white spots in it, which could be worthwhile exploring. This book was not planned as a textbook; rather, it...

  20. Structures and properties of spatially distorted porphyrins

    International Nuclear Information System (INIS)

    Golubchikov, Oleg A; Kuvshinova, Elizaveta M; Pukhovskaya, Svetlana G

    2005-01-01

    The published data on the structures and properties of porphyrins with distorted aromatic macrocycles are generalised and analysed. Data on the crystal structures, spectra and kinetics of formation and dissociation of their coordination derivatives are summarised. It is demonstrated that the distortion of the planar structure of the tetrapyrrole core is one of the most efficient means of controlling spectral, physicochemical and coordination properties of these compounds.

  1. Silicon nanowires: structure and properties

    International Nuclear Information System (INIS)

    Nezhdanov, A.V.; Mashin, A.I.; Razuvaev, A.G.; Ershov, A.V.; Ignatov, S.K.

    2006-01-01

    An attempt to grow silicon nanowires has been made by electron beam evaporation on highly oriented pyrolytic substrate. Needle-like objects are located along the normal to a substrate (density 2 x 10 11 cm -2 ). For modeling quasi-one-dimensional objects calculations of nuclear structure and energy spectra have been accomplished. A fullerene-like structure Si 24 is proposed as a basic atomic configuration of silicon nanowires [ru

  2. Structure and Properties of Compressed Borate Glasses

    DEFF Research Database (Denmark)

    Smedskjær, Morten Mattrup; Bauer, U.; Behrens, H.

    While the influence of thermal history on the structure and properties of glasses has been thoroughly studied in the past century, the influence of pressure history has received considerably less attention. In this study, we investigate the pressure-induced changes in structure and properties in ......, hardness and crack formation from nanoindentation experiments, and overshoot in isobaric heat capacity from DSC experiments at ambient pressure. The influence of the initial boron speciation on the degree of changes in structure and properties will also be discussed....

  3. Microanalysis of vitrous char and associated polymers: reference and ancient assemblages

    Science.gov (United States)

    Allue, E.; Bonnamy, S.; Courty, M. M.; Gispert I Guirado, F.

    2012-12-01

    Formation of vitrous char that occur in ancient charcoal assemblages have remained unsolved. Laboratory experiments refuted vitrification to resulting from high temperature charring of green or resinous wood. This puzzling problem has been refreshed by showing the association to the charcoal and vitrous char of plastics that were originally supposed to only be produced by petroleum industry. Extraction of similar polymers within geological glassy products from cosmic airbursts has suggested impact processes to possibly forming the carbonaceous polymorphs. The pulverisation at the ground in the Angles village (French Eastern Pyrenees) following the 2011 August 2nd high altitude meteor explosion of exotic debris with vitrous char and polymers, just alike the puzzling ones of the geological and archaeological records, has provided potential reference materials. We present here their microanalysis by Environmental SEM with EDS, Raman micro-spectrometry and FTIR, XRD, TEM, ICP-MS and isotope analyses. The characterization helps elucidating how the carbonaceous polymorphs formed by transient heating and transient high pressure of atmospheric aerosols. Under TEM the vesicular, dense, vitrous char show high structural organization with a dense pattern of nano-sized graphitized domains, metals and mineral inclusions. The coupled Raman-ESEM has allowed identifying a complex pattern at micro scales of ordered "D" peak at 1320-1350 cm-1 and the graphitic, ordered peak at 1576-1590 cm-1, in association to amorphous and poorly graphitic ordered carbon. The later occurs within plant cells that have been extracted from the dense vitrous char by performing controlled combustion under nitrogen up to 1000°C. In contrast, the brittle, vesicular vitrous char and the polymers encountered at the rear of the pulverised airburst debris reveal to be formed of agglutinated micro spherules of amorphous carbon with rare crystallized carbon nano-domains and scattered mineral inclusions. They

  4. Structural Properties of Barium Stannate.

    Energy Technology Data Exchange (ETDEWEB)

    Phelan, D.; Han, F.; Lopez-Bezanilla, A.; Krogstad, M. J.; Gim, Y.; Rong, Y.; Zhang, J.; Parshall, D.; Zheng, H.; Cooper, S. L.; Feygenson, M.; Yang, Wenge; Chen, Yu-Sheng

    2018-06-01

    BaSnO3 has attracted attention as a transparent conducting oxide with high room temperature carrier mobility. We report a series of measurements that were carried out to assess the structure of BaSnO3 over a variety of length scales. Measurements included single crystal neutron and x-ray diffraction, Rietveld and pair distribution analysis of neutron powder diffraction, Raman scattering, and high-pressure x-ray diffraction. Results from the various diffraction probes indicate that both the long-range and local structures are consistent with the cubic symmetry. The diffraction data under pressure was consistent with a robustly cubic phase up to 48.9 GPa, which is supported by density functional calculations. Additionally, transverse phonon velocities were determined from measured dispersion of the transverse acoustic phonon branches, the results of which are in good agreement with previous theoretical estimates and ultrasound measurements.

  5. Grain boundary structure and properties

    International Nuclear Information System (INIS)

    Balluffi, R.W.

    1979-05-01

    An attempt is made to distinguish those fundamental aspects of grain boundaries which should be relevant to the problem of the time dependent fracture of high temperature structural materials. These include the basic phenomena which are thought to be associated with cavitation and cracking at grain boundaries during service and with the more general microstructural changes which occur during both processing and service. A very brief discussion of the current state of knowledge of these fundamentals is given

  6. Structure and properties of metals

    CERN Document Server

    Kurzydlowski, K J

    1999-01-01

    Metals are one of the most widely used types of engineering materials. Some of their properties, e.g. elastic constants, can be directly related to the nature of the metallic bonds between the atoms. On the other hand, macro- and $9 microstructural features of metals, such as point defects, dislocations, grain boundaries, and second phase particles, control their yield, flow, and fracture stress. Images of microstructural elements can be obtained by modern $9 imaging techniques. Modern computer aided methods can be further used to obtain a quantitative description of these microstructures. These methods take advantage of the progress made in recent years in the field of image processing, $9 mathematical morphology and quantitative stereology. Quantitative description of the microstructures are used for modeling processes taking place under the action of applied load at a given temperature and test (service) environment. $9 These model considerations can be illustrated on the example of an austenitic stainless...

  7. Synthesis and characterization of resorcinol–formaldehyde resin chars doped by zinc oxide

    International Nuclear Information System (INIS)

    Gun’ko, Vladimir M.; Bogatyrov, Viktor M.; Oranska, Olena I.; Urubkov, Iliya V.; Leboda, Roman; Charmas, Barbara; Skubiszewska-Zięba, Jadwiga

    2014-01-01

    Polycondensation polymerization of resorcinol–formaldehyde (RF) mixtures in water with addition of different amounts of zinc acetate and then carbonization of dried gels are studied to prepare ZnO doped chars. Zinc acetate as a catalyst of resorcinol–formaldehyde polycondensation affects structural features of the RF resin (RFR) and, therefore, the texture of chars prepared from Zn-doped RFR. The ZnO doped chars are characterized using thermogravimetry, low temperature nitrogen adsorption/desorption, Raman spectroscopy, X-ray diffraction (XRD), scanning electron microscopy (SEM), and high resolution transmission electron microscopy (HRTEM). At a relatively high content of zinc acetate (1 mol per 10–40 mol of resorcinol) in the reaction mixture, the formation of crystallites of ZnO (zincite) occurs in a shape of straight nanorods of 20–130 nm in diameter and 1–3 μm in length. At a small content of zinc acetate (1 mol per 100–500 mol of resorcinol), ZnO in composites is XRD amorphous and does not form individual particles. The ZnO doped chars are pure nanoporous at a minimal ZnO content and nano-mesoporous or nano-meso-macroporous at a higher ZnO content.

  8. Endotoxin Removal from Water Using Heterogenus Catalytic Ozonation by Bone Char

    Directory of Open Access Journals (Sweden)

    Abas Rezaee

    2011-10-01

    Full Text Available The endotoxin is one of pollutants with lipopolysaccharide structure which release from gram negative bacteria and cyanobacters. The aim of this study was removal of endotoxin from water using catalytic ozonation by bone char. The endotoxin for experiments have extracted from Escherichia coli bacterium cell wall by Stefan and Jan method. Chromogenic limulus ambusite lysate method in 405-410 nm wave length was used for analysing of endotoxin. The ozone have analysed by potassium iodine method. Results: Results of the research shown endotoxin removal rates using heterogenous catalytic ozonation were 6.0 Eu/ml.min and 0.5 Eu/ml.min for grey bone char and white bone char, respectively. The efficency of the process was found eighty percent. Primary concentration of basic compounds had no effect on endotoxin removal rate. Therefore, endotoxin removal kinetic of reaction is a zero order reaction. This study revealed that ozonation process using bone char is more efficient than other proposed methods such as ozonation or chlorination and can be used successfully for endotoxin removal from water as a efficient method.

  9. Intumescent coatings with improved properties for high-rise construction

    Science.gov (United States)

    Ustinov, Andrey; Zybina, Olga; Tanklevsky, Leonid; Lebedev, Vasily; Andreev, Andrey

    2018-03-01

    The paper overviews the way of creating intumescent fire-protective compositions with improved properties by adding nano-and micro-sized supplements into them. Intumescent paints are inert at low temperatures, and at higher temperatures they expand and degrade to provide a charred layer of low conductivity materials. The modified intumescent paints are able to form a more stable charred layer than the classical paints. The stability of a charred layer is crucial if the fire safety in high-rise construction must be secured, because a weak charred layer will not provide a required fire endurance for steel bearing structures and they will break down in case of fire. The fire-protective properties of modified intumescent paints were estimated using an electrical furnace. Also the way of thermal decomposition of the paints was studied with thermogravimetric analysis. Results show that modified intumescent paints form a charred layer with improved fire-protective properties; it can serve as a thermal barrier for a longer period of time. Thermogravimetric analysis confirms this fact showing that the temperatures of full thermal decay in case of modified paints are higher than those of non-modified paints.

  10. Active carbons from low temperature conversion chars

    International Nuclear Information System (INIS)

    Adebowale, K.O.; Bayer, E.

    2002-05-01

    Hulls obtained from the fruits of five tropical biomass have been subjected to low temperature conversion process and their chars activated by partial physical gasification to produce active carbons. The biomass are T. catappa, B. nitida, L leucophylla, D. regia and O. martiana. The bulk densities of the samples ranged from 0.32 g.cm 3 to 0.52 g.cm 3 . Out of the samples T. catappa recorded the highest cellulose content (41.9 g.100g -1 ), while O. martiana contained the highest lignin content (40.7 g.100g -1 ). The ash of the samples were low (0.5 - 4.4%). The percentage of char obtained after conversion were high (33.7% - 38.6%). Active carbons obtained from T. catappa, D. regia and O. martiana, recorded high methylene blue numbers and iodine values. They also displayed good micro- and mesostructural characteristics. Micropore volume (V micro ) was between 0.33cm 3 .g -1 - 0.40cm 3 .g -1 , while the mesopore volume(V meso ) was between 0.05 cm 3 .g -1 - 0.07 cm 3 .g -1 . The BET specific surface exceeds 1000 m 2 .g -1 . All these values compared favourably with high grade commercial active carbons. (author)

  11. Active carbons from low temperature conversion chars

    Energy Technology Data Exchange (ETDEWEB)

    Adebowale, K O [Department of Chemistry, University of lbadan, lbadan (Nigeria); Abdus Salam International Centre for Theoretical Physics, Trieste (Italy); Bayer, E [Universitaet Tuebingen, Institut fuer Organische Chemie, Forschungstelle Nukleinsaeure- und Peptidchemie, Tuebingen (Germany)

    2002-05-01

    Hulls obtained from the fruits of five tropical biomass have been subjected to low temperature conversion process and their chars activated by partial physical gasification to produce active carbons. The biomass are T. catappa, B. nitida, L leucophylla, D. regia and O. martiana. The bulk densities of the samples ranged from 0.32 g.cm{sup 3} to 0.52 g.cm{sup 3}. Out of the samples T. catappa recorded the highest cellulose content (41.9 g.100g{sup -1}), while O. martiana contained the highest lignin content (40.7 g.100g{sup -1}). The ash of the samples were low (0.5 - 4.4%). The percentage of char obtained after conversion were high (33.7% - 38.6%). Active carbons obtained from T. catappa, D. regia and O. martiana, recorded high methylene blue numbers and iodine values. They also displayed good micro- and mesostructural characteristics. Micropore volume (V{sub micro}) was between 0.33cm{sup 3}.g{sup -1} - 0.40cm{sup 3}.g{sup -1}, while the mesopore volume(V{sub meso}) was between 0.05 cm{sup 3}.g{sup -1} - 0.07 cm{sup 3}.g{sup -1}. The BET specific surface exceeds 1000 m{sup 2}.g{sup -1}. All these values compared favourably with high grade commercial active carbons. (author)

  12. CHARCOAL PACKED FURNACE FOR LOW-TECH CHARRING OF BONE

    DEFF Research Database (Denmark)

    Jacobsen, P.; Dahi, Elian

    1997-01-01

    A low-tech furnace for charring of raw bone using char coal is developed and tested. The furnace consists of a standard oil drum, fitted with simple materials as available in every market in small towns in developing counties. 80 kg of raw bone and 6 kg of charcoal are used for production of 50 kg...

  13. Gas cleaning with hot char beds studied by stable isotopes

    DEFF Research Database (Denmark)

    Egsgaard, Helge; Ahrenfeldt, Jesper; Ambus, Per

    2014-01-01

    The chemistry taking place in a high temperature char bed used for binding aromatic tar compounds has been studied in detail. 13C labelled tar compounds were used to trace the incorporation into the char bed using isotope ratio mass spectrometry (IRMS) and GC-MS. Furthermore, compounds labelled...

  14. NO Reduction over Biomass and Coal Char during Simultaneous Combustion

    DEFF Research Database (Denmark)

    Zhao, Ke; Glarborg, Peter; Jensen, Anker Degn

    2013-01-01

    This paper reports an experimental study of NO reduction over chars of straw, bark, bituminous coal, and lignite. The experiments were performed in a fixed bed reactor in the temperature range 850–1150 °C. The chars were generated by in situ pyrolysis at the reaction temperature to minimize further...

  15. STRUCTURAL AND THERMOPHYSICAL PROPERTIES OF HARDENING CONCRETE

    Directory of Open Access Journals (Sweden)

    L. Krasulina

    2012-01-01

    Full Text Available Structural and thermophysical properties of thermally treated concrete have been studied in the paper. The paper demonstrates regularities of changes in structural and thermophysical properties of concrete during heat treatment process. It is established that stabilization of coefficient values for heat- and temperature conductivity of concrete corresponds to completion of the process pertaining to intensive formation of the material pore structure and indicates the possibility of transition from the stage of isothermal extraction to the stage of temperature decrease. The obtained results are confirmed by studies of strength growth kinetics of concrete samples.

  16. Synergistic Effect of Co-utilization of Coal and Biomass Char: An Overview

    Science.gov (United States)

    Paiman, M. E. S.; Hamzah, N. S.; Idris, S. S.; Rahman, N. A.; Ismail, K.

    2018-05-01

    Global concerns on impact of greenhouse gases emission, mostly released from coal-fired power plant, and the depletion of fossil fuel particularly coal, has led the production of electricity from alternatives resources such as co-utilization technologies. Previous studies proved that the co-utilization of coal and biomass/biomass chars has significantly reduced the emission of greenhouse gases either during the pyrolysis, combustion or gasification process in laboratories, pilots as well as in the industrial scales. Interestingly, most of the studies reported the presence of synergistic effect during the co-utilization processes particularly between coal and biomass char while some are not. Biomass chars were found to have porous and highly disorder carbon structure and belong to the class of most reactive carbon material, resulting to be more reactive than those hard coal and lignite. Up to date, microwave assisted pyrolysis is one of the best and latest techniques employed to produce better quality of biomass chars and it is also reduce the processing cost. Lot of works has been done regarding on the existence of synergistic effects during its co-utilization. However, the knowledge is limited to thermal and product characteristics so far. Even so, the specific reasons behind its existence are yet to understand well. Therefore, in this paper, the emphasis will be given on the synergistic effects on emission characteristics of co-utilization of coal and biomass chars so that it can be apply in energy-based industries to help in reduction of the greenhouse gases emission.

  17. CHAR CRYSTALLINE TRANSFORMATIONS DURING COAL COMBUSTION AND THEIR IMPLICATIONS FOR CARBON BURNOUT

    Energy Technology Data Exchange (ETDEWEB)

    ROBERT H. HURT

    1998-09-08

    Recent work at Sandia National Laboratories, Imperial College, and the U.K. utility PowerGen, has identified an important mechanism believed to have a large influence on unburned carbon levels from pulverized coal-fired boilers. That mechanism is char carbon crystalline rearrangements on subsecond times scales at temperatures of 1800 - 2500 K, which lead to char deactivation in the flame zones of furnaces. The so-called thermal annealing of carbons is a well known phenomenon, but its key role in carbon burnout has only recently been appreciated, and there is a lack of quantitative data in this time/temperature range. In addition, a new fundamental tool has recently become available to study crystalline transformations, namely high resolution transmission electron microscopy (HRTEM) fringe imaging, which provides a wealth of information on the nature and degree of crystallinity in carbon materials such as coal chars. Motivated by these new developments, this University Coal Research project has been initiated with the following two goals:  to determine transient, high-temperature, thermal deactivation kinetics as a function of parent coal and temperature history.  to characterize the effect of this thermal treatment on carbon crystalline structure through high-resolution transmission electron microscopy and specialized, quantitative image analysis. Work is currently underway on the following three tasks: Task 1 Experimental technique development. The goal of this task is to develop and demonstrate an apparatus and procedure for measuring transient, high-temperature, thermal deactivation of coal chars. While peak gas temperatures in boilers are often in the range 1800 - 2000 K, peak particle temperatures can be much higher due to high rates of heat release at the particle surface due to exothermic carbon oxidation. The prototype transient heat treatment apparatus is based on an inert-gas purged graphite-rod sample holder that is subjected to rapid Joule heating to

  18. Data base on structural materials aging properties

    International Nuclear Information System (INIS)

    Oland, C.B.

    1992-01-01

    The US Nuclear Regulatory Commission has initiated a Structural Aging Program at the Oak Ridge National Laboratory to identify potential structural safety issues related to continued service of nuclear power plants and to establish criteria for evaluating and resolving these issues. One of the tasks in this program focuses on the establishment of a Structural Materials Information Center where long-term and environment-dependent properties of concretes and other structural materials are being collected and assembled into a data base. These properties will be used to evaluate the current condition of critical structural components in nuclear power plants and to estimate the future performance of these materials during the continued service period

  19. Structural properties of the Hugoniot curve

    International Nuclear Information System (INIS)

    Chaisse, F.

    2002-01-01

    This report is devoted to the structural properties analysis of the HUGONIOT curve, independently of the equation of state (E 0 S) display. The general properties so coming out are applied to the shock waves interacting studies. When phase transitions are present we investigate the splitting of shock waves and also the rarefaction waves. To end with, we present the shock instabilities and the non-uniqueness of solutions when specific E 0 S are present. (author)

  20. Dwarf char, a new form of chars (the genus Salvelinus) in Lake Kronotskoe

    Science.gov (United States)

    Pavlov, S.D.; Pivovarov, E.A.; Ostberg, C.O.

    2012-01-01

    Lake Kronotskoe is situated in the Kronotskii State Nature Reserve and is a unique natural heritage of Kamchatka. The lake–river system of the reserve includes numerous springs and small streams and three large inflowing rivers, Listvennichnaya, Unana, and Uzon, which form the main bays of Lake Kronotskoe; one river (Kronotskaya) flows from the lake. This river is characterized by several rapids, which are assumed to be unsurmountable barriers for fish migration. The ichthyofauna of the lake has been isolated for a long time, and some endemic fishes appeared, including char of the genus Salvelinus and the residential form of red salmon Oncorhynchus nerka (the local name is kokanee). These species are perfect model objects to study microevolution processes. Char of Lake Kronotskoe are characterized by significant polymorphism and plasticity [1–3]; therefore, they are extremely valuable for studying the processes of speciation and form development. That is why the populations of char in Lake Kronotskoe are unique and attract special attention of researchers. 

  1. Optical properties of the semiconductor quantum structure

    International Nuclear Information System (INIS)

    Haratizadeh, H.; Holtz, P.O.; Monemar, B.; Karlsoon, K.F.; Moskalenko, E.S.; Amano, H.; Akasaki, I.; Schoenfeld, W.V.; Garcia, J.M.; Petroff, P.M.

    2004-01-01

    Optical properties of the quantum structures have been discussed with emphasize of the AlGaN/GaN multiple quantum wells and InAs/GaAs quantum dot structures. We report on a detailed study of low temperature photoluminescence in Al 0 .07Ga 0 .93 N/GaN multiple quantum wells. The structures were nominally undoped multiple quantum well grown on sapphire substrate. The structure from discrete well width variations is here resolved in photoluminescence spectra. The results demonstrate that the theoretically estimated fields in this work are consistent with the experimental spectra

  2. Sulfate reduction and carbon removal during kraft char burning

    Energy Technology Data Exchange (ETDEWEB)

    Waag, K.J.; Frederick, W.J.; Sricharoenchaikul, V [Oregon State Univ., Corvallis, OR (United States). Dept. of Chemical Engineering; Grace, T.M. [T.M. Grace Company, Appleton, WI (United States); Kymalainen, M. [Tampella Power, Tampere (Finland)

    1995-12-31

    An improved mathematical model of char burning during black liquor combustion was described. Enhancements include a proper treatment of CO{sub 2} and H{sub 2}O gasification, reactions between oxygen and combustibles in the boundary layer, and integration of sulfate reduction and sulfide reoxidation into the char burning process. Gasification of char carbon by reaction with H{sub 2}O and CO{sub 2} proved to be the most important means of carbon release under typical recovery furnace conditions. Sulfate reduction was shown to be responsible for only a minor part of the carbon release. Simulations showed that for typical recovery boiler conditions, char burning behavior is independent of oxygen concentration up to the point of carbon depletion. After carbon depletion, sulfide reoxidation occurs at a rate determined by oxygen mass transfer. Process variables that had the biggest effect on char burning behavior were initial black liquor drop diameter and temperature; also there was a direct link between char burnout times and the amount of sulfate reduction. At a given temperature, any variable that shortened the char burnout time resulted in proportionately less reduction. 22 refs., 10 figs., 2 tabs.

  3. A burnout prediction model based around char morphology

    Energy Technology Data Exchange (ETDEWEB)

    T. Wu; E. Lester; M. Cloke [University of Nottingham, Nottingham (United Kingdom). Nottingham Energy and Fuel Centre

    2005-07-01

    Poor burnout in a coal-fired power plant has marked penalties in the form of reduced energy efficiency and elevated waste material that can not be utilized. The prediction of coal combustion behaviour in a furnace is of great significance in providing valuable information not only for process optimization but also for coal buyers in the international market. Coal combustion models have been developed that can make predictions about burnout behaviour and burnout potential. Most of these kinetic models require standard parameters such as volatile content, particle size and assumed char porosity in order to make a burnout prediction. This paper presents a new model called the Char Burnout Model (ChB) that also uses detailed information about char morphology in its prediction. The model can use data input from one of two sources. Both sources are derived from image analysis techniques. The first from individual analysis and characterization of real char types using an automated program. The second from predicted char types based on data collected during the automated image analysis of coal particles. Modelling results were compared with a different carbon burnout kinetic model and burnout data from re-firing the chars in a drop tube furnace operating at 1300{sup o}C, 5% oxygen across several residence times. An improved agreement between ChB model and DTF experimental data proved that the inclusion of char morphology in combustion models can improve model predictions. 27 refs., 4 figs., 4 tabs.

  4. A burnout prediction model based around char morphology

    Energy Technology Data Exchange (ETDEWEB)

    Tao Wu; Edward Lester; Michael Cloke [University of Nottingham, Nottingham (United Kingdom). School of Chemical, Environmental and Mining Engineering

    2006-05-15

    Several combustion models have been developed that can make predictions about coal burnout and burnout potential. Most of these kinetic models require standard parameters such as volatile content and particle size to make a burnout prediction. This article presents a new model called the char burnout (ChB) model, which also uses detailed information about char morphology in its prediction. The input data to the model is based on information derived from two different image analysis techniques. One technique generates characterization data from real char samples, and the other predicts char types based on characterization data from image analysis of coal particles. The pyrolyzed chars in this study were created in a drop tube furnace operating at 1300{sup o}C, 200 ms, and 1% oxygen. Modeling results were compared with a different carbon burnout kinetic model as well as the actual burnout data from refiring the same chars in a drop tube furnace operating at 1300{sup o}C, 5% oxygen, and residence times of 200, 400, and 600 ms. A good agreement between ChB model and experimental data indicates that the inclusion of char morphology in combustion models could well improve model predictions. 38 refs., 5 figs., 6 tabs.

  5. Multiphase composite coatings: structure and properties

    International Nuclear Information System (INIS)

    Yurov, V M; Guchenko, S A; Platonova, E S; Syzdykova, A Sh; Lysenko, E N

    2015-01-01

    The paper discusses the results of the research into the formation of ion-plasma multiphase coatings. The types of the formed structures are found to be not so diverse, as those formed, for example, in alloy crystallization. The structures observed are basically of globular type and, more rarely, of unclosed dissipative and cellular structures. It is shown that the properties of the coating formed in deposition are largely determined by its surface energy or surface tension. Since the magnitude of the surface tension (surface energy) in most cases is an additive quantity, each of the elements of the coating composition contributes to the total surface energy. In case of simultaneous sputtering of multiphase cathodes, high entropy coatings with an ordered cellular structure and improved mechanical properties are formed. (paper)

  6. Investigation on the fast co-pyrolysis of sewage sludge with biomass and the combustion reactivity of residual char.

    Science.gov (United States)

    Deng, Shuanghui; Tan, Houzhang; Wang, Xuebin; Yang, Fuxin; Cao, Ruijie; Wang, Zhao; Ruan, Renhui

    2017-09-01

    Gaining the valuable fuels from sewage sludge is a promising method. In this work, the fast pyrolysis characteristics of sewage sludge (SS), wheat straw (WS) and their mixtures in different proportions were carried out in a drop-tube reactor. The combustion reactivity of the residual char obtained was investigated in a thermogravimetric analyzer (TGA). Results indicate that SS and WS at different pyrolysis temperatures yielded different characteristic gas compositions and product distributions. The co-pyrolysis of SS with WS showed that there existed a synergistic effect in terms of higher gas and bio-oil yields and lower char yield, especially at the WS adding percentage of 80wt%. The addition of WS to SS increased the carbon content in the SS char and improved char porous structures, resulting in an improvement in the combustion reactivity of the SS char. The research results can be used to promote co-utilization of sewage sludge and biomass. Copyright © 2017. Published by Elsevier Ltd.

  7. Effect of geometry structure on critical properties

    Science.gov (United States)

    Jiang, Qing; Jiang, Xue-fan

    1997-02-01

    The effective-field renormalization group (EFRG) scheme is utilized to compute critical properties of the transverse Ising model (TIM) in a quantum-spin system. We distinguish differences between lattices of the same coordination number but of different structures and take effects of the first fluctuation correction into account. The improved results for the critical transverse field are obtained for several lattice structures even by considering the smallest possible cluster, which is in good agreement with series results.

  8. Structure and properties of interfaces in ceramics

    International Nuclear Information System (INIS)

    Bonnell, D.; Ruehle, M.; Chowdhry, U.

    1995-01-01

    The motivation for the symposium was the observation that interfaces in crystallographically and compositionally complex systems often dictate the performance and reliability of devices that utilize functional ceramics. The current level of understanding of interface-property relations in silicon-based devices required over 30 years of intensive research. Similar issues influence the relationship between atomic bonding at interfaces and properties in functional ceramic systems. The current understanding of these complex interfaces does not allow correlation between atomic structure and interface properties, in spite of their importance to a number of emerging technologies (wireless communications, radar-based positioning systems, sensors, etc.). The objective of this symposium was to focus attention on these fundamental issues by featuring recent theoretical and experimental work from various disciplines that impact the understanding of interface chemistry, structure, and properties. The emphasis was on relating properties of surfaces and interfaces to structure through an understanding of atomic level phenomena. Interfaces of interest include metal/ceramic, ceramic/ceramic, ceramic/vapor, etc., in electronic, magnetic, optical, ferroelectric, piezoelectric, and dielectric applications. Sixty one papers have been processed separately for inclusion on the data base

  9. Synthesis and Application of a Novel Polyamide Charring Agent for Halogen-Free Flame Retardant Polypropylene

    Directory of Open Access Journals (Sweden)

    Jie Liu

    2013-01-01

    Full Text Available A novel charring agent, poly(p-ethylene terephthalamide (PETA, for halogen-free flame retardant polypropylene was synthesized by using p-phthaloyl chloride (TPC and ethylenediamine through solution polycondensation at low temperature, and the effects of PETA on flame retardance of polypropylene (PP/IFR systems were studied. The experimental results showed that PETA could considerably enhance the fire retardant performance as proved by evidence of the increase of limiting oxygen index (LOI values, the results of UL-94 tests, and cone calorimeter tests (CCT. Fourier transform infrared spectroscopy (FTIR and scanning electron microscope (SEM demonstrated that an appropriate amount of PETA could react with PP/IFR system to form cross-link network; a more compact char layer could be formed which was responsible for the improved thermal and flame retardant properties of PP/IFR systems. However, the superfluous amount of PETA would play the negative role.

  10. Structural properties of Cd–Co ferrites

    Indian Academy of Sciences (India)

    36, No. 5, October 2013, pp. 919–922. c Indian Academy of Sciences. Structural properties of Cd–Co ferrites. S P DALAWAIa,∗. , T J SHINDEb, A B GADKARIc and P N VASAMBEKARa. aDepartment of Electronics, Shivaji University, Kolhapur 416 004, India. bDepartment of Physics, KRP Kanya Mahavidyalaya, Islampur ...

  11. Structural stability properties of Friedman cosmology

    International Nuclear Information System (INIS)

    Szydlowski, M.; Heller, M.; Pontificial Academy of Cracow, Krakow; Golda, Z.

    1984-01-01

    A dynamical system with Robertson-Walker symmetries and the equation of the state p = γepsilon, O <= γ <= 1, considered both as a conservative and nonconservative system, is studied with respect to its structural properties. Different cases are shown and analyzed on the phase space (x = Rsup(D), γ = (dx/dt)). (author)

  12. Diamond nanowires: fabrication, structure, properties, and applications.

    Science.gov (United States)

    Yu, Yuan; Wu, Liangzhuan; Zhi, Jinfang

    2014-12-22

    C(sp(3) )C-bonded diamond nanowires are wide band gap semiconductors that exhibit a combination of superior properties such as negative electron affinity, chemical inertness, high Young's modulus, the highest hardness, and room-temperature thermal conductivity. The creation of 1D diamond nanowires with their giant surface-to-volume ratio enhancements makes it possible to control and enhance the fundamental properties of diamond. Although theoretical comparisons with carbon nanotubes have shown that diamond nanowires are energetically and mechanically viable structures, reproducibly synthesizing the crystalline diamond nanowires has remained challenging. We present a comprehensive, up-to-date review of diamond nanowires, including a discussion of their synthesis along with their structures, properties, and applications. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  13. Characterization and Activation Study of Black Chars Derived from Cellulosic Biomass Pyrolyzed at Very High Temperature

    Energy Technology Data Exchange (ETDEWEB)

    Contescu, Cristian I. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States); Gallego, Nidia C. [Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States)

    2017-03-01

    The State of Tennessee, in partnership with the University of Tennessee (UT) and the Oak Ridge National Laboratory (ORNL), has created the RevV! Manufacturing voucher program to help Tennessee manufacturers gain access to the world-class resources at ORNL. As a part of this program, ORNL was working with Proton Power, Inc. (PPI), a rapidly growing company located in Lenoir City, Tennessee. PPI has developed a patented renewable energy system that uses biomass and waste sources to produce inexpensive hydrogen gas or synthetic fuels which are economically competitive with fossil fuels. The pyrolysis process used by PPI in their manufacturing chain generates significant amounts of black carbon char as by-product. The scope of ORNL collaboration with PPI was assessing the black carbon char as a potential feedstock for activated carbon production, as this could be a potentially new revenue stream. During 2015-2016 ORNL received eight char samples from PPI and characterized their initial properties, simulated their physical activation by carbon dioxide, prepared gram-size samples of physically activated carbons, and characterized their surface and porosity properties. This report presents a summary of the work methods employed and the results obtained in the collaborative project between ORNL and PPI.

  14. Surface modification of bone char for removal of formaldehyde from air

    Energy Technology Data Exchange (ETDEWEB)

    Rezaee, Abbas, E-mail: rezaee@modares.ac.ir [Environmental Health Department, Faculty of Medical Sciences, Tarbiat Modares University, Tehran (Iran, Islamic Republic of); Rangkooy, Hosseinali [Environmental Health Department, Faculty of Medical Sciences, Tarbiat Modares University, Tehran (Iran, Islamic Republic of); Occupational Health Department, Faculty of Health, Jondishapor Medical Sciences University, Ahvaz (Iran, Islamic Republic of); Jonidi-Jafari, Ahmad; Khavanin, Ali [Environmental Health Department, Faculty of Medical Sciences, Tarbiat Modares University, Tehran (Iran, Islamic Republic of)

    2013-12-01

    The aim of this study was to evaluate the adsorption performance of bone char (BC) modified with acetic acid for formaldehyde removal from polluted air. The porous structure, surface characteristics and functional groups involved in formaldehyde adsorption were determined using the Brunauer–Emmett–Teller (BET) method, scanning electron microscope (SEM) equipped with energy dispersive X-ray (EDX) and Fourier transform infrared spectroscopy (FTIR), respectively. It was found that the modified BC has a higher specific surface area than the original BC. The maximum surface area of the modified BC was 118.58 m{sup 2}/g. The FTIR spectrum of modified BC indicated that the hydroxyl and carboxyl groups on the BC surface played a significant role in the adsorption of formaldehyde by modified BC. The breakthrough, equilibrium time and adsorption capacity of modified BC were greater than the original BC. Moreover, the results showed that at initial concentrations of 20, 50, 100 and 200 mg/L, the equilibrium times for BC and modified BC were 85, 75, 65 and 45 min and 95, 85, 70 and 50 min, respectively. It seems that the formaldehyde adsorption capacity of modified BC depends on both physical and chemical properties. These results showed that modified BC can be used as an efficient adsorbent for formaldehyde removal.

  15. Silver Matrix Composites - Structure and Properties

    Directory of Open Access Journals (Sweden)

    Wieczorek J.

    2016-03-01

    Full Text Available Phase compositions of composite materials determine their performance as well as physical and mechanical properties. Depending on the type of applied matrix and the kind, amount and morphology of the matrix reinforcement, it is possible to shape the material properties so that they meet specific operational requirements. In the paper, results of investigations on silver alloy matrix composites reinforced with ceramic particles are presented. The investigations enabled evaluation of hardness, tribological and mechanical properties as well as the structure of produced materials. The matrix of composite material was an alloy of silver and aluminium, magnesium and silicon. As the reinforcing phase, 20-60 μm ceramic particles (SiC, SiO2, Al2O3 and Cs were applied. The volume fraction of the reinforcing phase in the composites was 10%. The composites were produced using the liquid phase (casting technology, followed by plastic work (the KOBO method. The mechanical and tribological properties were analysed for plastic work-subjected composites. The mechanical properties were assessed based on a static tensile and hardness tests. The tribological properties were investigated under dry sliding conditions. The analysis of results led to determination of effects of the composite production technology on their performance. Moreover, a relationship between the type of reinforcing phase and the mechanical and tribological properties was established.

  16. Study on coal char ignition by radiant heat flux.

    Science.gov (United States)

    Korotkikh, A. G.; Slyusarskiy, K. V.

    2017-11-01

    The study on coal char ignition by CO2-continuous laser was carried out. The coal char samples of T-grade bituminous coal and 2B-grade lignite were studied via CO2-laser ignition setup. Ignition delay times were determined at ambient condition in heat flux density range 90-200 W/cm2. The average ignition delay time value for lignite samples were 2 times lower while this difference is larger in high heat flux region and lower in low heat flux region. The kinetic constants for overall oxidation reaction were determined using analytic solution of simplified one-dimensional heat transfer equation with radiant heat transfer boundary condition. The activation energy for lignite char was found to be less than it is for bituminous coal char by approximately 20 %.

  17. Combustion reactivity of chars from copyrolysis of coal with coke-oven gas

    Energy Technology Data Exchange (ETDEWEB)

    Liao Hongqiang; Sun Chenggong; Li Baoqing [Chinese Academy of Sciences, Taiyuan (China). State Key Lab. of Coal Conversion

    1997-12-31

    The combustion reactivity of char from pyrolysis of Xianfeng lignite with coke-oven gas (COG) is related to the pyrolysis pressure and heating rate. Decreasing pressure and increasing heating rate enhance the char yields and combustion reactivity. The combustion reactivities of char from coal pyrolysis with COG nearly reach to that of char from hydropyrolysis, but lower than those of char from coal pyrolysis under N{sub 2}. (orig.)

  18. Structural properties of small rhodium clusters

    Energy Technology Data Exchange (ETDEWEB)

    Soon, Yee Yeen; Yoon, Tiem Leong [School of Physics, Universiti Sains Malaysia, 11800 USM, Penang (Malaysia); Lim, Thong Leng [Faculty of Engineering and Technology, Multimedia University, Melaka Campus, 75450 Melaka (Malaysia)

    2015-04-24

    We report a systematic study of the structural properties of rhodium clusters at the atomistic level. A novel global-minimum search algorithm, known as parallel tempering multicanonical basin hopping plus genetic algorithm (PTMBHGA), is used to obtain the geometrical structures with lowest minima at the semi-empirical level where Gupta potential is used to describe the atomic interaction among the rhodium atoms. These structures are then re-optimized at the density functional theory (DFT) level with exchange-correlation energy approximated by Perdew-Burke-Ernzerhof (PBE) generalized gradient approximation (GGA). The structures are optimized for different spin multiplicities. The ones with lowest energies will be taken as ground-state structures. In most cases, we observe only minor changes in the geometry and bond length of the clusters as a result of DFT-level re-optimization. Only in some limited cases, the initial geometries obtained from the PTMBHGA are modified by the re-optimization. The variation of structural properties, such as ground-state geometry, symmetry and binding energy, with respect to the cluster size is studied and agreed well with other results available in the literature.

  19. Nucleon structure and properties of dense matter

    International Nuclear Information System (INIS)

    Kutschera, M.; Pethick, C.J.; Illinois Univ., Urbana, IL

    1988-01-01

    We consider the properties of dense matter in a framework of the Skyrme soliton model and the chiral bag model. The influence of the nucleon structure on the equation of state of dense matter is emphasized. We find that in both models the energy per unit volume is proportional to n 4/3 , n being the baryon number density. We discuss the properties of neutron stars with a derived equation of state. The role of many-body effects is investigated. The effect of including higher order terms in the chiral lagrangian is examined. The phase transition to quark matter is studied. 29 refs., 6 figs. (author)

  20. Definition and properties of ideal amorphous structures

    International Nuclear Information System (INIS)

    Stachurski, Z.H.

    2002-01-01

    Full text: Amorphous structure is usually defined by what it is not (ie, no crystalline peaks in XRS, no bond correlation in NMR), rather than by what it is. The interest in defining the structure of non-crystalline materials is long standing; packing geometry of spheres, molecular structure of glassy SiO 2 , or the structure of atactic polymers are prime examples. The earliest definitions of amorphous structure were in terms of a microcrystallite model of Valenkov, or continuous random network by Zachariasen. The random close packing of spheres of equal size, and an amorphous structure, composed of freely jointed linear chains of hard spheres, has been described mathematically in terms of a linear homogeneous Poisson process. This paper aims to describe some geometrical, kinematic, and topological properties of these two ideal amorphous structures, which belong to the same amorphous class. The geometry of packing is elucidated, and the use of Voronoi tessellation method for measuring the structures is described. The ideal amorphous solid has no symmetry elements; its volume can not be divided into identical unit cells. However, there is a volume element small enough to allow the distinction of its nanoscopic inhomogeneities, and sufficiently large enough to represent, accurately the overall behaviour. We define this volume element, the representative volume element. Suitable boundary conditions must be prescribed for a choice of RVE, and satisfy certain requirements. Topologically, a catchment region on the Born-Oppenheimer potential energy surface over nuclear configuration space, is defined by Mezey and Bader as an energetically stable geometry of the open region of R 3 traversed by all the trajectories which terminate at a local maximum. Two topological properties will be described: (i) the boundaries of the catchment region as a direct geometrical correspondence to the Voronoi polyhedron for a given atom in a given structure, and (ii) the constriction points

  1. Ultrasonically assisted extraction of calcium and ash from char

    Science.gov (United States)

    Mathumba, E. E.; Mbaya, R. K. K.; Kolesnikov, A.

    2018-03-01

    This study characterized and removed calcium and ash content from char to improve the chemical quality of char as reductant for titanium smelting application. Calcium in char can be classified in two parts: mineral matter and cationic metals associated with organic matrix. Virgin and chemically treated char was characterized by using ISO 1171, wet chemistry methods, ISO 19579, XRF, and B.E.T. methods. In this present work, demineralization of char with mild chemical leachants such as acetic acid, citric acid, gluconic acid and Ethylene Diamine Tetra Acetic acid with three different ultrasonic power input (150 W, 270 W and 300 W) and semi-dual frequency of 40 kHz tank was investigated. Actual power dissipated into the system was calculated from the calorimetric measurement. An optimum set of process parameters are identified and validated. The ultrasound technology was compared with soaking technology to determine the efficiency of ultrasound system for the removal of calcium. The removal of calcium was exponentially higher with ultrasonic treatment than without it. Results revealed that mild chemical reagents do not harm the carbon content of char. It is evident from the results that amongst the leachants used; acetic and citric acid has caused significant removal of mineral phases.

  2. Thermal Properties, Structure and Morphology of Graphene Reinforced Polyethylene Terephthalate/ Polypropylene Nano composites

    International Nuclear Information System (INIS)

    Inuwa, I.M.; Hassan, A.; Shamsudin, S.A.

    2014-01-01

    In this work the thermal properties, structure and morphology of a blend of polyethylene terephthalate (PET) and polypropylene (PP) reinforced with graphene nano platelets (GNP) were investigated. A blend of PET/ PP (70/ 30 weight percent) compatibilized with styrene-ethylene-butylene-styrene grafted maleic anhydride triblock copolymer (10 phr) were fabricated by melt extrusion process in a twin screw extruder. The effective thermal conductivity of the nano composites increased as a function of the GNP concentration. More than 80 % increase in effective thermal conductivity was observed for the 7 phr reinforced sample compared to the neat blend. This observation was attributed to the development interconnected GNP sheets which formed heat conductive bridges that are suitable for maximum heat transfer. However, in the case of thermal stability which is a function of dispersibility of GNP in polymer matrix, the maximum increase was observed at 3 phr GNP loading which could be attributed to the uniform dispersion of GNPs in the matrix. It is explained that the GNP nano fillers migrated to the surface of matrix forming an effective oxygen barrier due to char formation. Morphological studies revealed uniform dispersion graphene in the polymer matrix at 3 phr GNP loading along with isolated instances of exfoliation of the graphene layers. (author)

  3. Fundamental study of the pulverized coal char combustion in oxyfuel mode with drop tube furnace

    Energy Technology Data Exchange (ETDEWEB)

    Ito, Takamasa; Takafuji, Makoto; Suda, Toshiyuki; Fujimori, Toshiro [Heat and Fluid Dynamics Department, Yokohama (Japan)

    2013-07-01

    The combustion characteristics of coal char particles in either O{sub 2}/N{sub 2} or O{sub 2}/CO{sub 2} conditions were experimentally investigated. Especially, the char burnout, the char particle temperature and the shrinkage of the char particles were discussed. A Drop Tube Furnace (DTF: whose wall temperature was set at 873, 923 and 973 K) was used as the experimental apparatus. The experimental results revealed that, in equivalent oxygen concentration, the char burnout and the char particle temperature were higher in O{sub 2}/N{sub 2} conditions than those in O{sub 2}/CO{sub 2} conditions. The shrinkage of the char particle did not show the large difference in either O{sub 2}/N{sub 2} or O{sub 2}/CO{sub 2} conditions. Up to 15% of char burnout, the char particle diameters were reduced gradually. Up to 80% of char burnout, the char particle diameters were not changed. This is supposed that the chemical reaction is mainly occurred not on the external surface but on the internal surface of the char particle. Over 80% of char burnout, sudden shrinkage could be seen. Finally, an empirical equation for the prediction of the char particle shrinkage was introduced. Further investigation is required in high operating temperature, where CO{sub 2} gasification may have a large influence on the char burnout.

  4. Numerical simulation of effective mechanical properties of stochastic composites with consideration for structural evolution under intensive dynamic loading

    Energy Technology Data Exchange (ETDEWEB)

    Karakulov, Valerii V., E-mail: valery@ftf.tsu.ru [National Research Tomsk State University, Tomsk, 634050 (Russian Federation); Smolin, Igor Yu., E-mail: smolin@ispms.ru, E-mail: skrp@ftf.tsu.ru; Skripnyak, Vladimir A., E-mail: smolin@ispms.ru, E-mail: skrp@ftf.tsu.ru [National Research Tomsk State University, Tomsk, 634050, Russia and Institute of Strength Physics and Materials Science SB RAS, Tomsk, 634055 (Russian Federation)

    2014-11-14

    Mechanical behavior of stochastic metal-ceramic composites with the aluminum matrix under high-rate deformation at shock-wave loading is numerically simulated with consideration for structural evolution. Effective values of mechanical parameters of metal-ceramic composites Alchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>B{sub 4}C, Alchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>SiC, and Alchar description='Single-Bond' name='Single-Bond' value='Single-Bond'/>Al{sub 2}O{sub 3} are evaluated depending on different concentration of ceramic inclusions.

  5. Structure Analysis and Properties of Unleaded Brasses

    Directory of Open Access Journals (Sweden)

    Rzadkosz S.

    2015-04-01

    Full Text Available The analysis of brasses regarding their microstructure, mechanical properties and ecological characteristics has been presented. The influence of characteristic alloying elements contained in the brasses and the possibilities of replacing them with other elements have been assessed. The paper contains the results of studies on the influence of chosen additional elements shaping the structure and properties of unleaded alloys based on Cu-Zn system as the matrix. The research aimed at determining the mechanism and the intensity of influence of such additives as tellurium and bismuth. The microstructures were investigated with the help of light microscopy and scanning electron microscopy with X-ray microanalysis (SEM-EDS for determining significant changes of the properties.

  6. Structural and tunneling properties of Si nanowires

    KAUST Repository

    Montes Muñoz, Enrique

    2013-12-06

    We investigate the electronic structure and electron transport properties of Si nanowires attached to Au electrodes from first principles using density functional theory and the nonequilibrium Green\\'s function method. We systematically study the dependence of the transport properties on the diameter of the nanowires, on the growth direction, and on the length. At the equilibrium Au-nanowire distance we find strong electronic coupling between the electrodes and nanowires, which results in a low contact resistance. With increasing nanowire length we study the transition from metallic to tunneling conductance for small applied bias. For the tunneling regime we investigate the decay of the conductance with the nanowire length and rationalize the results using the complex band structure of the pristine nanowires. The conductance is found to depend strongly on the growth direction, with nanowires grown along the ⟨110⟩ direction showing the smallest decay with length and the largest conductance and current.

  7. Structural and tunneling properties of Si nanowires

    KAUST Repository

    Montes Muñ oz, Enrique; Gkionis, Konstantinos; Rungger, Ivan; Sanvito, Stefano; Schwingenschlö gl, Udo

    2013-01-01

    We investigate the electronic structure and electron transport properties of Si nanowires attached to Au electrodes from first principles using density functional theory and the nonequilibrium Green's function method. We systematically study the dependence of the transport properties on the diameter of the nanowires, on the growth direction, and on the length. At the equilibrium Au-nanowire distance we find strong electronic coupling between the electrodes and nanowires, which results in a low contact resistance. With increasing nanowire length we study the transition from metallic to tunneling conductance for small applied bias. For the tunneling regime we investigate the decay of the conductance with the nanowire length and rationalize the results using the complex band structure of the pristine nanowires. The conductance is found to depend strongly on the growth direction, with nanowires grown along the ⟨110⟩ direction showing the smallest decay with length and the largest conductance and current.

  8. Microstructure mechanical properties relationship in bainitic structures

    International Nuclear Information System (INIS)

    Altuna, M. A.; Gutierrez, I.

    2005-01-01

    In the present work, the microstructures and their mechanical properties have been studies in different bainitic structures. therefore, different bainitic morphologies have been produced by isothermal treatments carried out at different temperatures. For these steels, 400-450 degree centigree is the optimum range of temperatures in order to obtain bainitic structures. If the Temperature is higher, perlite is also formed and if it is lower, martensite is obtained during quenching. SEM and EBSD/OIM techniques were applied in order to study the microstructure. Tensile tests were carried out for mechanical characterization. (Author) 20 refs

  9. Structural and electronic properties of thallium compounds

    International Nuclear Information System (INIS)

    Paliwal, Neetu; Srivastava, Vipul

    2016-01-01

    The tight binding linear muffin-tin-orbital (TB-LMTO) method within the local density approximation (LDA has been used to calculate structural and electronic properties of thallium pnictides TlX (X=Sb, Bi) at high pressure. As a function of volume, the total energy is evaluated. Apart from this, the lattice parameter (a_0), bulk modulus (B_0), band structure (BS) and density of states (DOS) are calculated. From energy band diagram we observed metallic behaviour in TlSb and TlBi compounds. The values of equilibrium lattice constants and bulk modulus are agreed well with the available data.

  10. Structural and electronic properties of thallium compounds

    Energy Technology Data Exchange (ETDEWEB)

    Paliwal, Neetu, E-mail: neetumanish@gmail.com [Department of Physics, AISECT University Bhopal, 464993 (India); Srivastava, Vipul [Department of Engineering Physics, NRI Institute of Research & Technology, Raisen Road, Bhopal, 462021 (India)

    2016-05-06

    The tight binding linear muffin-tin-orbital (TB-LMTO) method within the local density approximation (LDA has been used to calculate structural and electronic properties of thallium pnictides TlX (X=Sb, Bi) at high pressure. As a function of volume, the total energy is evaluated. Apart from this, the lattice parameter (a{sub 0}), bulk modulus (B{sub 0}), band structure (BS) and density of states (DOS) are calculated. From energy band diagram we observed metallic behaviour in TlSb and TlBi compounds. The values of equilibrium lattice constants and bulk modulus are agreed well with the available data.

  11. The structural properties of sustainable, continuous change

    DEFF Research Database (Denmark)

    Håkonsson, Dorthe Døjbak; Klaas, Johann Peter; Carroll, Timothy

    2013-01-01

    this relationship by exploring what structural properties enable continuous change in inertia-generating organizations and what their performance consequences are in dynamic environments. The article has three main findings: First, employing managers who anticipate change is not enough to generate continuous change......; it is also necessary to raise both the rate of responsiveness and desired performance. Second, continuous change increases average organizational performance and reduces its variation. Third, organizations’ capacity for continuous change is counterintuitively limited by the organizations’ capacity to build...

  12. Biochemical stability of sewage sludge chars and their impact on soil organic matter of a Mediterranean Cambisol

    Science.gov (United States)

    Paneque, Marina; María De la Rosa, José; Aragón, Carlos; Kern, Jürgen; Knicker, Heike

    2016-04-01

    Transformation of sewage sludge (SS) into char achieves sludge hygienisation, which is necessary prior its application into agricultural soils. The pyrolysis of SS increases its stability in a degree which depends on the thermal treatment used. Thus, chars produced by using hydrothermal carbonization are typically more stable than normal soil organic matter (SOM), but less stable than chars from dry pyrolysis (Libra et al., 2011). Addition of highly-recalcitrant SS-chars to soil will likely increase its carbon sequestration potential; however the fertilizing properties of SS may be compromised due to its alteration during the pyrolysis. The main goal of this work was to investigate the biochemical recalcitrance of two 13C-enriched SS-chars once applied in a Mediterranean Cambisol as well as to evaluate their impact on the SOM quality and carbon stability. Thus, we studied the distribution of 13C between plants and soil after the addition of the 13C-enriched chars (2 atm%) to the soil. Therefore, we performed a greenhouse incubation experiment, using a Mediterranean Cambisol as matrix and tested the following treatments: control (soil alone), raw SS, SS-hydrochar, SS-pyrochar. The SS was produced in a pilot-scale waste-water plant and enriched with 13C by the addition of 13C-glucose during the treatment. The amendment was only applied to the upper 2 cm of the soil matrix where it accounted for 5% of its dry weight. Per pot, 25 seeds of Lolium perenne were sowed and incubated under controlled conditions. The biomass production as well as the concentration of 13C in leaves and roots was determined after 1, 2 and 5 months. The partitioning of the 13C between soil and plant and its transformation into bioavailable forms were monitored by stable isotopic mass spectrometry. The 13C-enrichment of the chars allowed the use of solid-state 13C NMR spectroscopy as a means for the detection of chemical alterations of the chars during their aging. Libra J., Ro K., Kammann C

  13. Improvement in char formability of phenolic resin for development of Carbon/Carbon composites

    International Nuclear Information System (INIS)

    Hajhosseini, M.; Payami, A.; Ghaffarian, S. R.; Rezadoust, A. M.

    2008-01-01

    In the processing of carbon/carbon composites using polymer resin as the matrix precursor, it is inevitable that a porous structure was formed after carbonization. As a result, densification by liquid phase impregnation followed by recarbonization is required to obtain a densified composite. Consequently, the char formability of resin is an important factor in reducing the number of densification cycles and hence the processing cost. In this study, a novel approach is adopted to improve the densification of carbon/carbon composites by using a new phenolic resin modified by pitch. For this purpose, soluble part of pitch was extracted and dispersed in resol type phenolic resin. The polymerization reaction was performed in presence of para-formaldehyde and a resol-pitch compound was obtained. The second compound was prepared by mixing novolac-furfural in 55:45 weight ratio containing 9% by weight hexamethylene tetramine. This compound was added to resol-pitch compound in 10,20,50 and 80 w %. The microstructure of carbonized resin was investigated by X-ray diffraction and char yield, and the linear and volumetric shrinkage were obtained. Results show that in 80:20 ratio of resol-pitch to novolac-furfural , the char yield would be maximized by 71% and volumetric shrinkage would be minimized at 16.4%. At the same time, XRD results indicate that the resin has a strong ability to graphitize carbon/carbon composites matrix as a necessary step for its processing

  14. Structural material properties for fusion application

    Energy Technology Data Exchange (ETDEWEB)

    Tavassoli, A-A. F.

    2008-10-15

    Materials properties requirements for structural applications in the forthcoming and future fusion machines are analyzed with emphasis on safety requirements. It is shown that type 316L(N) used in the main structural components of ITER is code qualified and together with limits imposed on its service conditions and neutron radiation levels, can adequately satisfy ITER vacuum vessel licensing requirements. For the in-vessel components, where nonconventional fabrication methods, such as HIPing, are used, design through materials properties, data is combined with tests on representative mockups to meet the requirements. For divertor parts, where the operating conditions are too severe for components to last throughout the reactor life, replacement of most exposed parts is envisaged. DEMO operating conditions require extension of ITER design criteria to high temperature and high neutron dose rules, as well as to compatibility with cooling and tritium breeding media, depending on the blanket concept retained. The structural material favoured in EU is Eurofer steel, low activation martensitic steel with good ductility and excellent resistance to radiation swelling. However, this material, like other ferritic / martensitic steels, requires post-weld annealing and is sensitive to low temperature irradiation embrittlement. Furthermore, it shows cyclic softening during fatigue, complicating design against fatigue and creep-fatigue. (au)

  15. Structure and properties of microcrystalline chitosan

    International Nuclear Information System (INIS)

    Pighinelli, Luciano; Guimaraes, Fernando Machado; Paz, Luan Rios; Zanin, Gabrielle Brehm; Kmiec, Marzena; Tedesco, Felipe Melleu; Reis, Victoria Oliva dos; Silva, Matheus Machado; Becker, Cristiane Miotto; Zehetmeyer, Gislene; Rasia, Gisele

    2016-01-01

    Full text: The microcrystalline chitosan is a modified form of chitosan; it has been elaborated from obtaining method of chitosan salts. It is characterized by special properties of the initial chitosan such as biocompatibility, bioactivity, non-toxic, biodegradability [1]. The objective of this study is to develop a different method to obtain the microcrystalline chitosan and the following characterization of the initial chitosan and MCCh. The material was characterized by FTIR, scanning of electron microscopy, SEM, nuclear magnetic resonance, NMR, and x-ray diffraction. The results indicate that the process to obtain MCCh, did not change the structure of the initial chitosan. The MCCh shows the same functional groups of the initial chitosan. The NMR results shows the acetylated and deacetylated groups. The morphology shows a homogeneous structure of surface. The X-ray diffraction shows the reduction of the crystallinity in the MCCh, indicating a bigger amorphous structure of the MCCh. The chitosan and its derivatives are polymers with excellent properties to be used in regenerative medicine because of ensure efficiency in healing process. This polysaccharide has a great potential to develop a new generation of biomaterials that can be used in regenerative medicine and tissue engineering [2]. References: [1]. LI, Q. et al. Applications and properties of chitosan. In: GOOSEN, M. F. A. (Ed.). Applications of chitin and chitosan. Basel: Technomic, 1997. p. 3-29; [2]. Luciano Pighinelli, Magdalena Kucharska, Dariuz Wawro. Preparation of Microcrystalline chitosan: (MCCh0/tricalcium phosphate complex with Hydroxyapatite in sponge and fibre from for hard tissue regeneration. (author)

  16. Structure and properties of microcrystalline chitosan

    Energy Technology Data Exchange (ETDEWEB)

    Pighinelli, Luciano; Guimaraes, Fernando Machado; Paz, Luan Rios; Zanin, Gabrielle Brehm; Kmiec, Marzena; Tedesco, Felipe Melleu; Reis, Victoria Oliva dos; Silva, Matheus Machado, E-mail: lpighinelli@hotmail.com [Universidade Luterana, Sao Paulo, SP (Brazil); Becker, Cristiane Miotto; Zehetmeyer, Gislene; Rasia, Gisele [Centro Universitario SENAI CIMATEC, Salvador, BA (Brazil). Instituto de Engenharia de Materiais Polimericos

    2016-07-01

    Full text: The microcrystalline chitosan is a modified form of chitosan; it has been elaborated from obtaining method of chitosan salts. It is characterized by special properties of the initial chitosan such as biocompatibility, bioactivity, non-toxic, biodegradability [1]. The objective of this study is to develop a different method to obtain the microcrystalline chitosan and the following characterization of the initial chitosan and MCCh. The material was characterized by FTIR, scanning of electron microscopy, SEM, nuclear magnetic resonance, NMR, and x-ray diffraction. The results indicate that the process to obtain MCCh, did not change the structure of the initial chitosan. The MCCh shows the same functional groups of the initial chitosan. The NMR results shows the acetylated and deacetylated groups. The morphology shows a homogeneous structure of surface. The X-ray diffraction shows the reduction of the crystallinity in the MCCh, indicating a bigger amorphous structure of the MCCh. The chitosan and its derivatives are polymers with excellent properties to be used in regenerative medicine because of ensure efficiency in healing process. This polysaccharide has a great potential to develop a new generation of biomaterials that can be used in regenerative medicine and tissue engineering [2]. References: [1]. LI, Q. et al. Applications and properties of chitosan. In: GOOSEN, M. F. A. (Ed.). Applications of chitin and chitosan. Basel: Technomic, 1997. p. 3-29; [2]. Luciano Pighinelli, Magdalena Kucharska, Dariuz Wawro. Preparation of Microcrystalline chitosan: (MCCh0/tricalcium phosphate complex with Hydroxyapatite in sponge and fibre from for hard tissue regeneration. (author)

  17. Synthesis, structure, and properties of azatriangulenium salts

    DEFF Research Database (Denmark)

    Laursen, B.W.; Krebs, Frederik C

    2001-01-01

    amines and, by virtue of its stepwise and irreversible nature, provides a powerful tool for the preparation of a wide variety of new heterocyclic carbenium salts. Several derivatives of the three new oxygen- and/or nitrogen-bridged triangulenium salts, azadioxa- (6), diazaoxa- (7......), and triazatriangulenium (4), have been synthesized and their physicochemical properties have been investigated. Crystal structures for compounds 2 b-PF6: 2d-PF6, 4b-BF4, 4c-BF4, 6e-BF4, and 8 are reported. The different packing modes found for the triazatriagulenium salts are discussed in relation to the electrostatic...

  18. Technological properties and structure of titanate melts

    International Nuclear Information System (INIS)

    Morozov, A.A.

    2002-01-01

    Power substantiation of existence of tough stream of complex anion ([TiO 6 ] 8- ) as a prevalent unit in titanate melts is given on the base of up-to-date knowledge about structure of metallurgical slags and results of investigations of thermophysical properties of these melts. It is shown that high crystallization ability of titanate melts at technological temperatures is determined by heterogeneity of liquid state - by presence up to 30 % of dispersed particles of solid phase solutions in matrix liquid [ru

  19. Fabrication and Properties of Multilayer Structures

    Science.gov (United States)

    1983-09-01

    according to both the high x-ray count and a Read camera pattern which showed only the 111 8 SiC reflection in a tight ± 30 distribution about the substrate...structural rearrangement. X-ray analysis of the deposited films at the composition of Pd2 Si using a Read camera indicated strong texturing. The...Phys. 35, 547 (1964). 11. C.A. Neubauer and J.R. Randen, Proc. IEEE 52, 1234 (1964). 12. W.A. Tiller, "Fabrication and Properties of Multilayer

  20. Chars from gasification of coal and pine activated with K2CO3: acetaminophen and caffeine adsorption from aqueous solutions.

    Science.gov (United States)

    Galhetas, Margarida; Mestre, Ana S; Pinto, Moisés L; Gulyurtlu, Ibrahim; Lopes, Helena; Carvalho, Ana P

    2014-11-01

    The high carbon contents and low toxicity levels of chars from coal and pine gasification provide an incentive to consider their use as precursors of porous carbons obtained by chemical activation with K2CO3. Given the chars characteristics, previous demineralization and thermal treatments were made, but no improvement on the solids properties was observed. The highest porosity development was obtained with the biomass derived char (Pi). This char sample produced porous materials with preparation yields near 50% along with high porosity development (ABET≈1500m(2)g(-1)). For calcinations at 800°C, the control of the experimental conditions allowed the preparation of samples with a micropore system formed almost exclusively by larger micropores. A mesopore network was developed only for samples calcined at 900°C. Kinetic and equilibrium acetaminophen and caffeine adsorption data, showed that the processes obey to a pseudo-second order kinetic equation and to the Langmuir model, respectively. The results of sample Pi/1:3/800/2 outperformed those of the commercial carbons. Acetaminophen adsorption process was ruled by the micropore size distribution of the carbons. The caffeine monolayer capacities suggest a very efficient packing of this molecule in samples presenting monomodal micropore size distribution. The surface chemistry seems to be the determinant factor that controls the affinity of caffeine towards the carbons. Copyright © 2014 Elsevier Inc. All rights reserved.

  1. Planetary ring systems properties, structures, and evolution

    CERN Document Server

    Murray, Carl D

    2018-01-01

    Planetary rings are among the most intriguing structures of our solar system and have fascinated generations of astronomers. Collating emerging knowledge in the field, this volume reviews our current understanding of ring systems with reference to the rings of Saturn, Uranus, Neptune, and more. Written by leading experts, the history of ring research and the basics of ring–particle orbits is followed by a review of the known planetary ring systems. All aspects of ring system science are described in detail, including specific dynamical processes, types of structures, thermal properties and their origins, and investigations using computer simulations and laboratory experiments. The concluding chapters discuss the prospects of future missions to planetary rings, the ways in which ring science informs and is informed by the study of other astrophysical disks, and a perspective on the field's future. Researchers of all levels will benefit from this thorough and engaging presentation.

  2. Properties of multilayer nonuniform holographic structures

    International Nuclear Information System (INIS)

    Pen, E F; Rodionov, Mikhail Yu

    2010-01-01

    Experimental results and analysis of properties of multilayer nonuniform holographic structures formed in photopolymer materials are presented. The theoretical hypotheses is proved that the characteristics of angular selectivity for the considered structures have a set of local maxima, whose number and width are determined by the thicknesses of intermediate layers and deep holograms and that the envelope of the maxima coincides with the selectivity contour of a single holographic array. It is also experimentally shown that hologram nonuniformities substantially distort shapes of selectivity characteristics: they become asymmetric, the local maxima differ in size and the depths of local minima reduce. The modelling results are made similar to experimental data by appropriately choosing the nonuniformity parameters. (imaging and image processing. holography)

  3. Extraordinary electronic properties in uncommon structure types

    Science.gov (United States)

    Ali, Mazhar Nawaz

    In this thesis I present the results of explorations into several uncommon structure types. In Chapter 1 I go through the underlying idea of how we search for new compounds with exotic properties in solid state chemistry. The ideas of exploring uncommon structure types, building up from the simple to the complex, using chemical intuition and thinking by analogy are discussed. Also, the history and basic concepts of superconductivity, Dirac semimetals, and magnetoresistance are briefly reviewed. In chapter 2, the 1s-InTaS2 structural family is introduced along with the discovery of a new member of the family, Ag0:79VS2; the synthesis, structure, and physical properties of two different polymorphs of the material are detailed. Also in this chapter, we report the observation of superconductivity in another 1s structure, PbTaSe2. This material is especially interesting due to it being very heavy (resulting in very strong spin orbit coulping (SOC)), layered, and noncentrosymmetric. Electronic structure calculations reveal the presence of a bulk 3D Dirac cone (very similar to graphene) that is gapped by SOC originating from the hexagonal Pb layer. In Chapter 3 we show the re-investigation of the crystal structure of the 3D Dirac semimetal, Cd3As2. It is found to be centrosymmetric, rather than noncentrosymmetric, and as such all bands are spin degenerate and there is a 4-fold degenerate bulk Dirac point at the Fermi level, making Cd3As2 a 3D electronic analog to graphene. Also, for the first time, scanning tunneling microscopy experiments identify a 2x2 surface reconstruction in what we identify as the (112) cleavage plane of single crystals; needle crystals grow with a [110] long axis direction. Lastly, in chapter 4 we report the discovery of "titanic" (sadly dubbed ⪉rge, nonsaturating" by Nature editors and given the acronym XMR) magnetoresistance (MR) in the non-magnetic, noncentrosymmetric, layered transition metal dichalcogenide WTe2; over 13 million% at 0.53 K in

  4. Structure and Properties of LENRA/ Silica Composite

    International Nuclear Information System (INIS)

    Mahathir Mohamed; Dahlan Mohd

    2010-01-01

    The sol-gel reaction using tetra ethoxysilane (TEOS) was conducted for modified natural rubber (NR) matrix to obtain in situ generated NR/ silica composite. The present of acrylate group in the modified NR chain turns the composite into radiation-curable. The maximum amount of silica generated in the matrix was 50 p hr by weight. During the sol-gel process the inorganic mineral was deposited in the rubber matrix forming hydrogen bonding between organic and inorganic phases. The composites obtained were characterized by various techniques including thermogravimetric analysis and infrared spectrometry to study their molecular structure. The increase in mechanical properties was observed for low silica contents ( 30 p hr) where more silica were generated, agglomerations were observed at the expense of the mechanical properties. From the DMTA data, it shows an increase of the interaction between the rubber and silica phases up to 30 p hr TEOS. Structure and morphology of the heterogeneous system were analyzed by transmission electron microscopy. The average particle sizes of between 150 nm to 300 nm were achieved for the composites that contain less than 20 p hr of TEOS. (author)

  5. Heat Transfer in a Fixed Bed of Straw Char

    DEFF Research Database (Denmark)

    Fjellerup, Jan Søren; Henriksen, Ulrik Birk; Jensen, Anker

    2003-01-01

    A model for the thermal conductivity of a straw char bed has been developed. The model extends the work of Yagi and Kunii to describe heat transfer in a bed of cylinders, using a relationship between the interparticle distance and the external porosity. To verify the model, thermal conductivity...... the experimental uncertainty over the range of conditions investigated. The heat transfer model was used in a parametric study to evaluate the effect of gas flow rate, particle diameter, porosity, and temperature on the thermal conductivity in a straw char bed....... experiments were performed on shredded and un-shredded straw char samples, varying particle size, bed packing (loose or dense), and temperature. Predictions with the model, using the measured external porosity and particle diameter as input parameters, are in agreement with measurements within...

  6. Demineralisation of a semianthracite char with molten salts/HCl

    International Nuclear Information System (INIS)

    Alfaro-Dominguez, M.; Sanchez Bajo, F.

    2006-01-01

    The effects of chemical heat treatments of a semianthracite char (AC) on the composition of the mineral fraction of the material are investigated. The starting char was first treated with a mixture of LiCl/KCl or LiCl/KCl/CaO at 743, 873 or 1173 K and the products obtained were then washed thoroughly with distilled water. A small fraction of these samples were treated with 10 -3 M HCl solution. The composition changes were studied by X-ray diffraction. The predominant mineral components initially present in the starting char are quartz, mullite, muscovite and/or kaolinite and oldhamite. The treatments of AC resulted in significant changes in the mineral fraction of the material, in particular when LiCl/KCl/CaO was used. In this case, spurrite, γ-calcium orthosilicate and gehlenite were formed, which were eliminated by treatment with 10 -3 M HCl solution

  7. Demineralisation of a semianthracite char with molten salts/HCl

    Energy Technology Data Exchange (ETDEWEB)

    Alfaro-Dominguez, M. [Departamento de Electronica e Ingenieria Electromecanica, Escuela de Ingenierias Industriales, Universidad de Extremadura, Avda de Elvas s/n, 06071 Badajoz (Spain)]. E-mail: malfaro@unex.es; Sanchez Bajo, F. [Departamento de Electronica e Ingenieria Electromecanica, Escuela de Ingenierias Industriales, Universidad de Extremadura, Avda de Elvas s/n, 06071 Badajoz (Spain)

    2006-06-30

    The effects of chemical heat treatments of a semianthracite char (AC) on the composition of the mineral fraction of the material are investigated. The starting char was first treated with a mixture of LiCl/KCl or LiCl/KCl/CaO at 743, 873 or 1173 K and the products obtained were then washed thoroughly with distilled water. A small fraction of these samples were treated with 10{sup -3} M HCl solution. The composition changes were studied by X-ray diffraction. The predominant mineral components initially present in the starting char are quartz, mullite, muscovite and/or kaolinite and oldhamite. The treatments of AC resulted in significant changes in the mineral fraction of the material, in particular when LiCl/KCl/CaO was used. In this case, spurrite, {gamma}-calcium orthosilicate and gehlenite were formed, which were eliminated by treatment with 10{sup -3} M HCl solution.

  8. Pyrolysis of waste animal fats in a fixed-bed reactor: Production and characterization of bio-oil and bio-char

    Energy Technology Data Exchange (ETDEWEB)

    Ben Hassen-Trabelsi, A., E-mail: aidabenhassen@yahoo.fr [Centre de Recherche et de Technologies de l’Energie (CRTEn), Technopôle Borj-Cédria, B.P 95, 2050, Hammam Lif (Tunisia); Kraiem, T. [Centre de Recherche et de Technologies de l’Energie (CRTEn), Technopôle Borj-Cédria, B.P 95, 2050, Hammam Lif (Tunisia); Département de Géologie, Université de Tunis, 2092, Tunis (Tunisia); Naoui, S. [Centre de Recherche et de Technologies de l’Energie (CRTEn), Technopôle Borj-Cédria, B.P 95, 2050, Hammam Lif (Tunisia); Belayouni, H. [Département de Géologie, Université de Tunis, 2092, Tunis (Tunisia)

    2014-01-15

    Highlights: • Produced bio-fuels (bio-oil and bio-char) from some animal fatty wastes. • Investigated the effects of main parameters on pyrolysis products distribution. • Determined the suitable conditions for the production of the maximum of bio-oil. • Characterized bio-oils and bio-chars obtained from several animal fatty wastes. - Abstract: Several animal (lamb, poultry and swine) fatty wastes were pyrolyzed under nitrogen, in a laboratory scale fixed-bed reactor and the main products (liquid bio-oil, solid bio-char and syngas) were obtained. The purpose of this study is to produce and characterize bio-oil and bio-char obtained from pyrolysis of animal fatty wastes. The maximum production of bio-oil was achieved at a pyrolysis temperature of 500 °C and a heating rate of 5 °C/min. The chemical (GC–MS analyses) and spectroscopic analyses (FTIR analyses) of bio-oil showed that it is a complex mixture consisting of different classes of organic compounds, i.e., hydrocarbons (alkanes, alkenes, cyclic compounds…etc.), carboxylic acids, aldehydes, ketones, esters,…etc. According to fuel properties, produced bio-oils showed good properties, suitable for its use as an engine fuel or as a potential source for synthetic fuels and chemical feedstock. Obtained bio-chars had low carbon content and high ash content which make them unattractive for as renewable source energy.

  9. Pyrolysis of waste animal fats in a fixed-bed reactor: Production and characterization of bio-oil and bio-char

    International Nuclear Information System (INIS)

    Ben Hassen-Trabelsi, A.; Kraiem, T.; Naoui, S.; Belayouni, H.

    2014-01-01

    Highlights: • Produced bio-fuels (bio-oil and bio-char) from some animal fatty wastes. • Investigated the effects of main parameters on pyrolysis products distribution. • Determined the suitable conditions for the production of the maximum of bio-oil. • Characterized bio-oils and bio-chars obtained from several animal fatty wastes. - Abstract: Several animal (lamb, poultry and swine) fatty wastes were pyrolyzed under nitrogen, in a laboratory scale fixed-bed reactor and the main products (liquid bio-oil, solid bio-char and syngas) were obtained. The purpose of this study is to produce and characterize bio-oil and bio-char obtained from pyrolysis of animal fatty wastes. The maximum production of bio-oil was achieved at a pyrolysis temperature of 500 °C and a heating rate of 5 °C/min. The chemical (GC–MS analyses) and spectroscopic analyses (FTIR analyses) of bio-oil showed that it is a complex mixture consisting of different classes of organic compounds, i.e., hydrocarbons (alkanes, alkenes, cyclic compounds…etc.), carboxylic acids, aldehydes, ketones, esters,…etc. According to fuel properties, produced bio-oils showed good properties, suitable for its use as an engine fuel or as a potential source for synthetic fuels and chemical feedstock. Obtained bio-chars had low carbon content and high ash content which make them unattractive for as renewable source energy

  10. Strategy for Passivating Char Efficiently at the Pilot Scale

    Energy Technology Data Exchange (ETDEWEB)

    Dunning, Timothy C [National Renewable Energy Laboratory (NREL), Golden, CO (United States)

    2018-01-18

    Fast pyrolysis is a promising pathway for the commercialization of liquid transportation fuels from biomass. Fast pyrolysis is performed at moderate heat (450-600 degrees Celcius) in an oxygen-deficient environment. One of the products of fast pyrolysis is biochar, which is often used as a heat source or as a soil amendment. Biochar is a partially reacted solid that is created in the production of bio-oil during fast pyrolysis. Biochar produced at these conditions contains significant quantities of carbon that adsorb oxygen when exposed to air. Biochar adsorption of oxygen is an exothermic process that may generate sufficient heat for combustion in ambient air. Biochar is also a self-insulating material which compounds the effects of heat generated internally. These factors lead to safety concerns and material handling difficulties. The Thermochemical Process Development Unit at the National Renewable Energy Laboratory operates a pilot plant that may be configured for fast pyrolysis, gasification, and will be introducing catalytic fast pyrolysis capabilities in 2018. The TCPDU designed and installed a system to introduce oxygen to collected biochar systematically for a controlled passivation. Biochar is collected and cooled in an oxygen deficient environment during fast pyrolysis. Oxygen is then introduced to the biochar on a mass flow basis. A sparger imbedded within the biochar sample near the bottom of the bed flows air diluted with nitrogen into the char bed, and excess gasses are removed from the top of the collection drum, above the char bed. Pressure within the collection drum is measured indicating adequate flow through filters. Sample weight is recorded before and after passivation. During passivation, temperature is measured at 18 points within the char bed. Oxygen content and temperature are measured leaving the char bed. Maximum temperature parameters were established to ensure operator safety during biochar passivation. Extensive passivation data was

  11. OPTIMIZATION OF CHAR FOR NOx REMOVAL; FINAL

    International Nuclear Information System (INIS)

    J. Phillips; L.R. Radovic; B. Xia; J.A. Menendez

    1999-01-01

    Work performed for this study demonstrates that the temperature of treatment and the identity of the treatment gas both strongly impact the surface chemistry of activated carbon. Two commercial activated carbons were treated in either N(sub 2) or H(sub 2) at different temperatures up to 2600 C. Several techniques-including microcalorimetry, point of zero charge measurements, thermal desorption-were used to provide insight into important aspects of the chemical surface properties. The results show that activated carbons treated at high temperatures (ca. 950 C) in hydrogen will not react with oxygen and water at ambient temperatures; moreover, surfaces created in this fashion have stable properties in ambient conditions for many months. In contrast, the same carbons treated in an inert gas (e.g., N(sub 2)) will react strongly with oxygen and water at ambient temperatures. In the presence of platinum (or any other noble metal), stable basic carbons, which will not adsorb oxygen in ambient laboratory conditions, can be created via a relatively low-temperature process. Treatment at higher temperatures ( and gt;1500 C) produced increasingly stable surfaces in either N(sub 2) or H(sub 2). A structural model is proposed. To wit: Treatment at high temperatures in any gas will lead to the desorption of oxygen surface functionalities in the form of CO and/or CO(sub 2). Absent any atom rearrangement, the desorption of these species will leave highly unsaturated carbon atoms (''dangling carbons'') on the surface, which can easily adsorb O(sub 2) and H(sub 2)O. In an inert gas these ''dangling carbons'' will remain, but hydrogen treatments will remove these species and leave the surface with less energetic sites, which can only adsorb O(sub 2) at elevated temperatures. Specifically, hydrogen reacts with any highly unsaturated carbons in the surface to form methane. At temperatures greater than 1500 C (e.g., 1800 C, 2600 C), structural annealing takes place and the consequent

  12. Characterization of a Neochlamydia-like Bacterium Associated with Epitheliocystis in Cultured Artic Char Salvelinus alpinus

    Science.gov (United States)

    Infections of branchial epithelium by intracellular gram-negative bacteria, termed epitheliocystis, have limited culture of Arctic char (Salvelinus alpinus). To characterize a bacterium associated with epitheliocystis in cultured char, gills were sampled for histopathologic examination, conventional...

  13. Adsorption of heavy metals by bio-chars produced from pyrolysis of paper mulberry from simulated industrial wastewater

    International Nuclear Information System (INIS)

    Adil, S.; Asma, M.

    2014-01-01

    Paper mulberry bio-char (by-product of pyrolysis) was evaluated for the removal of heavy metals (Cd, Cr, Cu, Zn and Pb) from simulated industrial waste water. The surface properties and surface area of the bio-char was found suitable for metal adsorption. Batch sorption studies for adsorption potential of paper mulberry bio-char for Cd, Cr, Cu, Pb and Zn were investigated under different experimental conditions of pH, temperature and contact time. Maximum removal efficiency of Cd, Cu, Pb and Zn was 97.8, 76.8, 85.6, and 82.2 % respectively at pH 12 while maximum removal of Cr was recorded (98%) at pH 2. The removal efficiency showed different behaviour at different contact times. Maximum removal efficiency of Cd, Cr, Zn was 81, 86, 61.4% at contact time of 3 hr. The maximum removal of Cu was 64.2% observed at a contact time of 4 hours while the maximum removal of Pb and Zn was 85% at contact time of 2 hr. The values of the thermodynamic parameters, enthalpy delta H, Gibbs free energy delta G of sorption and entropy delta So were calculated to define endothermic or exothermic behavior of the sorbent used. Negative value of delta G for Cd, Cu, Cr and Pb indicated paper mulberry bio-char as a feasible sorbent for the efficient removal of Cd, Cu, Cr and Pb. Negative value of delta H was observed for Cd and Pb indicating that the adsorption process is exothermic while positive value of delta H was calculated for Cu, Cr and Zn showed that the adsorption is endothermic. The results obtained showed that plant residue bio-char can act as an effective sorbent for the removal of heavy metals from aqueous solutions. (author)

  14. Utilization of oil palm tree residues to produce bio-oil and bio-char via pyrolysis

    International Nuclear Information System (INIS)

    Abnisa, Faisal; Arami-Niya, Arash; Wan Daud, W.M.A.; Sahu, J.N.; Noor, I.M.

    2013-01-01

    Highlights: • About 14.72% of the total landmass in Malaysia was used for oil palm plantations. • Oil palm tree residues were pyrolyzed to produce bio-oil and bio-char. • The process was performed at a temperature of 500 °C and reaction time of 60 min. • Characterization of the products was performed. - Abstract: Oil palm tree residues are a rich biomass resource in Malaysia, and it is therefore very important that they be utilized for more beneficial purposes, particularly in the context of the development of biofuels. This paper described the possibility of utilizing oil palm tree residues as biofuels by producing bio-oil and bio-char via pyrolysis. The process was performed in a fixed-bed reactor at a temperature of 500 °C, a nitrogen flow rate of 2 L/min and a reaction time of 60 min. The physical and chemical properties of the products, which are important for biofuel testing, were then characterized. The results showed that the yields of the bio-oil and bio-char obtained from different residues varied within the ranges of 16.58–43.50 wt% and 28.63–36.75 wt%, respectively. The variations in the yields resulted from differences in the relative amounts of cellulose, hemicellulose, lignin, volatiles, fixed carbon, and ash in the samples. The energy density of the bio-char was found to be higher than that of the bio-oil. The highest energy density of the bio-char was obtained from a palm leaf sample (23.32 MJ/kg), while that of the bio-oil was obtained from a frond sample (15.41 MJ/kg)

  15. Structure Property Studies for Additively Manufactured Parts

    Energy Technology Data Exchange (ETDEWEB)

    Milenski, Helen M [Univ. of Mexico, Los Alamos, NM (United States); Schmalzer, Andrew Michael [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Kelly, Daniel [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

    2015-08-17

    Since the invention of modern Additive Manufacturing (AM) processes engineers and designers have worked hard to capitalize on the unique building capabilities that AM allows. By being able to customize the interior fill of parts it is now possible to design components with a controlled density and customized internal structure. The creation of new polymers and polymer composites allow for even greater control over the mechanical properties of AM parts. One of the key reasons to explore AM, is to bring about a new paradigm in part design, where materials can be strategically optimized in a way that conventional subtractive methods cannot achieve. The two processes investigated in my research were the Fused Deposition Modeling (FDM) process and the Direct Ink Write (DIW) process. The objectives of the research were to determine the impact of in-fill density and morphology on the mechanical properties of FDM parts, and to determine if DIW printed samples could be produced where the filament diameter was varied while the overall density remained constant.

  16. Redox properties of structural Fe in clay minerals: 3. Relationships between smectite redox and structural properties.

    Science.gov (United States)

    Gorski, Christopher A; Klüpfel, Laura E; Voegelin, Andreas; Sander, Michael; Hofstetter, Thomas B

    2013-01-01

    Structural Fe in clay minerals is an important redox-active species in many pristine and contaminated environments as well as in engineered systems. Understanding the extent and kinetics of redox reactions involving Fe-bearing clay minerals has been challenging due to the inability to relate structural Fe(2+)/Fe(total) fractions to fundamental redox properties, such as reduction potentials (EH). Here, we overcame this challenge by using mediated electrochemical reduction (MER) and oxidation (MEO) to characterize the fraction of redox-active structural Fe (Fe(2+)/Fe(total)) in smectites over a wide range of applied EH-values (-0.6 V to +0.6 V). We examined Fe(2+)/Fe(total )- EH relationships of four natural Fe-bearing smectites (SWy-2, SWa-1, NAu-1, NAu-2) in their native, reduced, and reoxidized states and compared our measurements with spectroscopic observations and a suite of mineralogical properties. All smectites exhibited unique Fe(2+)/Fe(total) - EH relationships, were redox active over wide EH ranges, and underwent irreversible electron transfer induced structural changes that were observable with X-ray absorption spectroscopy. Variations among the smectite Fe(2+)/Fe(total) - EH relationships correlated well with both bulk and molecular-scale properties, including Fe(total) content, layer charge, and quadrupole splitting values, suggesting that multiple structural parameters determined the redox properties of smectites. The Fe(2+)/Fe(total) - EH relationships developed for these four commonly studied clay minerals may be applied to future studies interested in relating the extent of structural Fe reduction or oxidation to EH-values.

  17. Experimental comparison of biomass chars with other catalysts for tar reduction

    NARCIS (Netherlands)

    Abu El-Rub, Ziad; Bramer, Eduard A.; Brem, Gerrit

    2008-01-01

    In this paper the potential of using biomass char as a catalyst for tar reduction is discussed. Biomass char is compared with other known catalysts used for tar conversion. Model tar compounds, phenol and naphthalene, were used to test char and other catalysts. Tests were carried out in a fixed bed

  18. [Relationships between microscope structure and thermodynamic properties

    International Nuclear Information System (INIS)

    Wu, R.S.; Lee, L.L.; Cochran, D.

    1990-01-01

    This paper exhibits on the molecular level, the relationships between the microscopic structure and thermodynamic properties of dilute supercritical solutions by application of the integral equation theories for molecular distribution functions. To solve the integral equations, the authors use Baxter's Wiener-Hopf factorization of the Ornstein-Zernike equations and then apply this method to binary Lennard-Jones mixtures. A number of closure relations have been used: such as the Percus-Yevick (PY), the reference hypernetted chain (RHNC), the hybrid mean spherical approximation (HMSA), and the reference interaction-site (RISM) methods. The authors examine the microstructures of several important classes of supercritical mixtures, including the usual attractive-type and the less known repulsive-type solutions. The clustering of solvent molecules for solvent-solute structures in the attractive mixtures and, correspondingly, the solvent cavitation in the repulsive mixtures are clearly demonstrated. These are shown to be responsible for the large negative growth of the solute partial molar volumes in the attractive case and the positive growth in the repulsive case

  19. Towards User-Friendly Spelling with an Auditory Brain-Computer Interface: The CharStreamer Paradigm

    Science.gov (United States)

    Höhne, Johannes; Tangermann, Michael

    2014-01-01

    Realizing the decoding of brain signals into control commands, brain-computer interfaces (BCI) aim to establish an alternative communication pathway for locked-in patients. In contrast to most visual BCI approaches which use event-related potentials (ERP) of the electroencephalogram, auditory BCI systems are challenged with ERP responses, which are less class-discriminant between attended and unattended stimuli. Furthermore, these auditory approaches have more complex interfaces which imposes a substantial workload on their users. Aiming for a maximally user-friendly spelling interface, this study introduces a novel auditory paradigm: “CharStreamer”. The speller can be used with an instruction as simple as “please attend to what you want to spell”. The stimuli of CharStreamer comprise 30 spoken sounds of letters and actions. As each of them is represented by the sound of itself and not by an artificial substitute, it can be selected in a one-step procedure. The mental mapping effort (sound stimuli to actions) is thus minimized. Usability is further accounted for by an alphabetical stimulus presentation: contrary to random presentation orders, the user can foresee the presentation time of the target letter sound. Healthy, normal hearing users (n = 10) of the CharStreamer paradigm displayed ERP responses that systematically differed between target and non-target sounds. Class-discriminant features, however, varied individually from the typical N1-P2 complex and P3 ERP components found in control conditions with random sequences. To fully exploit the sequential presentation structure of CharStreamer, novel data analysis approaches and classification methods were introduced. The results of online spelling tests showed that a competitive spelling speed can be achieved with CharStreamer. With respect to user rating, it clearly outperforms a control setup with random presentation sequences. PMID:24886978

  20. The ChemChar process for hazardous-waste treatment

    International Nuclear Information System (INIS)

    McGowin, A.E.

    1991-01-01

    The ChemChar Reverse-Burn Gasification Process has been studied for application to the thermal destruction of radioactive waste organic ion exchange resins. The resulting char was mixed with cement to form a dry, leach-resistant final disposal product. Successful regeneration of spent granular activated carbons was achieved with reverse-burn gasification. Regeneration parameters such as moisture content and supplemental fuel addition were investigated. The performance of regenerated carbon was evaluated by batch equilibrium and breakthrough assay and was comparable to that of the original. Surface areas were determined by the BET method. The fate of mercury during reverse-burn gasification was investigated. TRB Char adsorbent was used to remove mercury vapor emission from the process. The use of petroleum coke as a substrate for gasification of wastes was studied. Petroleum coke was activated by reverse-burn gasification to produce a highly porous, low surface area solid. Destruction efficiency for hexachlorobenzene on activated coke was considerably lower than on coal char, however, the addition of iron appeared to catalyze hexachlorobenzene gasification

  1. Heat Transfer in a Fixed Biomass Char Bed

    DEFF Research Database (Denmark)

    Fjellerup, Jan Søren; Henriksen, Ulrik Birk; Glarborg, P.

    2002-01-01

    A thermal conductivity model based on the Yagi and Kunii model together with a bed model was developed to describe the thermal conductivity of a straw char bed. The bed model describes the relationship between the distance between particles and the external porosity. To verify the model, thermal ...

  2. Heterogeneous reduction of nitric oxide on synthetic coal chars

    Energy Technology Data Exchange (ETDEWEB)

    C. Pevida; A. Arenillas; F. Rubiera; J.J. Pis [Instituto Nacional del Carbon (CSIC), Oviedo (Spain)

    2005-12-01

    Model compounds, with a controlled heteroatoms content and well-defined functionalities, were used to study the release of nitrogen compounds from char combustion. In the present work, the mechanisms involved in NO-char heterogeneous reduction were studied with a synthetic coal (SC) char as carbon source. Another synthetic char (SN) without any nitrogen in its composition was also employed in these studies. Temperature programmed reduction (TPR) tests with a gas mixture of 400 ppm NO in argon and with isotopically labelled nitric oxide, {sup 15}NO (500 ppm {sup 15}NO in argon), were carried out. The gases produced were quantitatively determined by means of MS and FTIR analysers. Under the conditions of this work the main products of the NO-C reaction were found to be N{sub 2} and CO{sub 2}. The main path of reaction involves the formation of surface nitrogen compounds that afterwards react with nitrogen from the reactive gas to form N{sub 2}. It was observed that fuel-N also participates in the overall heterogeneous reduction reaction, although to a lesser extent.

  3. Coal-char combustion in a fluidised bed reactor

    Energy Technology Data Exchange (ETDEWEB)

    Mehrotra, S.P.; Pande, M. [Indian Institute of Technolgy, Kanpur (India)

    2001-12-01

    Combustion of bituminous coal chars ranging from 0.8 mm to 1.8 mm has been studied in a fluidised bed reactor at temperatures ranging from 500 to 850{sup o}C. The fluidised bed consists of inert sand particles of average size of 0.5 mm and reactive coal char particles. A heat balance has been worked out to calculate the rate of combustion of char from measured incremental changes in the bed temperature during combustion. Investigations on partially burnt particles suggest that the ash layer which builds up around the burning core of char particles is non-flaking and the particles burn in a shrinking core manner. Analysis of rate data indicates that the rate of combustion is controlled by chemical reaction kinetics, though diffusion of oxygen through the bundary layer begins to influence the overall reaction kinetics at higher temperatures. The burnt out time varies linearly with particle size. Activation energy for the chemical reaction control regime is found to be around 68 kJ/mole.

  4. Adsorption of Escherichia coli Using Bone Char | Rezaee | Journal ...

    African Journals Online (AJOL)

    The aim of study was providing a novel adsorbent for the removal of Escherichia coli (E.coli) as a microbial model from contaminated air especially in hospital units using bone char (BC). The BC was prepared from cattle animal bone by pyrolysis in a furnace at 450°C for 2 h. The characteristics of BC have been determined ...

  5. AUS burnup module CHAR and the associated data pool

    International Nuclear Information System (INIS)

    Robinson, G.S.

    1975-12-01

    The CHAR module of the AUS reactor neutronics scheme solves the multiregion nuclide depletion equations using an analytic method. The module obtains cross section, flux and geometry data from AUS data pools, and uses the STATUS data pool which has been designed for the storage of nuclide compositions, spatial smearing factors and other miscellaneous information. (author)

  6. The mechanism of char ignition in fluidized bed combustors

    NARCIS (Netherlands)

    Siemons, R.V.

    1987-01-01

    Knowledge about ignition processes of coal in fluidized beds is of importance for the start-up and dynamic control of these combustors. Initial experiments in a transparent fluidized bed scale model showed the existence of a considerable induction period for the ignition of char, especially at low

  7. Modifying Char Dustcake Pressure Drop Using Particulate Additives

    Energy Technology Data Exchange (ETDEWEB)

    Landham, C.; Dahlin, R.S.; Martin, R.A.; Guan, X.

    2002-09-19

    Coal gasification produces residual particles of coal char, coal ash, and sorbent that are suspended in the fuel gas stream exiting the gasifier. In most cases, these particles (referred to, hereafter, simply as char) must be removed from the stream prior to sending the gas to a turbine, fuel cell, or other downstream device. Currently, the most common approach to cleaning the gas stream at high temperature and pressure is by filtering the particulate with a porous ceramic or metal filter. However, because these dusts frequently have small size distributions, irregular morphology, and high specific surface areas, they can have very high gas flow resistance resulting in hot-gas filter system operating problems. Typical of gasification chars, the hot-gas filter dustcakes produced at the Power Systems Development Facility (PSDF) during recent coal gasification tests have had very high flow resistance (Martin et al, 2002). The filter system has been able to successfully operate, but pressure drops have been high and filter cleaning must occur very frequently. In anticipation of this problem, a study was conducted to investigate ways of reducing dustcake pressure drop. This paper will discuss the efficacy of adding low-flow-resistance particulate matter to the high-flow-resistance char dustcake to reduce dustcake pressure drop. The study had two parts: a laboratory screening study and confirming field measurements at the PSDF.

  8. Charring does not affect wood infestation by subterranean termites

    Science.gov (United States)

    C.J. Peterson; P.D. Gerard; T.L. Wagner

    2007-01-01

    Fire is an important part of forest ecosystems, as is the insect fauna. Changes in wood brought aboutby fire may alter the ability of termites to use the wood, interrupting the decay cycle of woody debris.The ability of termites to find, infest, and feed upon wood after it had been charred was evaluated in

  9. Structure and properties of carbon black particles

    Science.gov (United States)

    Xu, Wei

    Structure and properties of carbon black particles were investigated using atomic force microscopy, gas adsorption, Raman spectroscopy, and X-ray diffraction. Supplementary information was obtained using TEM and neutron scattering. The AFM imaging of carbon black aggregates provided qualitative visual information on their morphology, complementary to that obtained by 3-D modeling based on TEM images. Our studies showed that carbon black aggregates were relatively flat. The surface of all untreated carbon black particles was found to be rough and its fractal dimension was 2.2. Heating reduced the roughness and fractal dimension for all samples heat treated at above 1300 K to 2.0. Once the samples were heat treated rapid cooling did not affect the surface roughness. However, rapid cooling reduced crystallite sizes, and different Raman spectra were obtained for carbon blacks of various history of heat treatment. By analyzing the Raman spectra we determined the crystallite sizes and identified amorphous carbon. The concentration of amorphous carbon depends on hydrogen content. Once hydrogen was liberated at increased temperature, the concentration of amorphous carbon was reduced and crystallites started to grow. Properties of carbon blacks at high pressure were also studied. Hydrostatic pressure did not affect the size of the crystallites in carbon black particles. The pressure induced shift in Raman frequency of the graphitic component was a result of increased intermolecular forces and not smaller crystallites. Two methods of determining the fractal dimension, the FHH model and the yardstick technique based on the BET theory were used in the literature. Our study proved that the FHH model is sensitive to numerous assumptions and leads to wrong conclusions. On the other hand the yardstick method gave correct results, which agreed with the AFM results.

  10. Structure and hydrodynamic properties of plectin molecules.

    Science.gov (United States)

    Foisner, R; Wiche, G

    1987-12-05

    Plectin is a cytoskeletal, high molecular weight protein of widespread and abundant occurrence in cultured cells and tissues. To study its molecular structure, the protein was purified from rat glioma C6 cells and subjected to chemical and biophysical analyses. Plectin's polypeptide chains have an apparent molecular weight of 300,000, as shown by one-dimensional sodium dodecyl sulfate/polyacrylamide electrophoresis. Cross-linking of non-denatured plectin in solution with dimethyl suberimidate and electrophoretic analyses on sodium dodecyl sulfate/agarose gels revealed that the predominant soluble plectin species was a molecule of 1200 X 10(3) Mr consisting of four 300 X 10(3) Mr polypeptide chains. Hydrodynamic properties of plectin in solution were obtained by sedimentation velocity centrifugation and high-pressure liquid chromatography analysis yielding a sedimentation coefficient of 10 S and a Stokes radius of 27 nm. The high f/fmin ratio of 4.0 indicated a very elongated shape of plectin molecules and an axial ratio of about 50. Shadowing and negative staining electron microscopy of plectin molecules revealed multiple domains: a rigid rod of 184 nm in length and 2 nm in diameter, and two globular heads of 9 nm diameter at each end of the rod. Circular dichroism spectra suggested a composition of 30% alpha-helix, 9% beta-structure and 61% random coil or aperiodic structure. The rod-like shape, the alpha-helix content as well as the thermal transition within a midpoint of 45 degrees C and the transition enthalpy (168 kJ/mol) of secondary structure suggested a double-stranded, alpha-helical coiled coil rod domain. Based on the available data, we favor a model of native plectin as a dumb-bell-like association of four 300 X 10(3) Mr polypeptide chains. Electron microscopy and turbidity measurements showed that plectin molecules self-associate into various oligomeric states in solutions of nearly physiological ionic strength. These interactions apparently involved

  11. Porous carbon from local coconut shell char by CO2 and H2O activation in the presence of K2CO3

    Science.gov (United States)

    Vi, Nguyen Ngoc Thuy; Truyen, Dang Hai; Trung, Bien Cong; An, Ngo Thanh; Van Dung, Nguyen; Long, Nguyen Quang

    2017-09-01

    Vietnamese coconut shell char was activated by steam and carbon dioxide at low temperatures with the presence of K2CO3 as a catalyst. The effects of process parameters on adsorption capability of the product including different ratio of impregnation of activation agents, activation temperature, activation time were investigated in this study. Iodine number, methylene blue adsorption capacity, specific surface area and pore size distribution were measured to assess the properties of the activated carbon. Accordingly, the porous carbon was applied for toluene removal by adsorption technology. Significant increases in specific surface area and the toluene adsorption capacity were observed when the coconut shell char was activated in CO2 flow at 720 °C for 150 minutes and the K2CO3/char weight ratio of 0.5.

  12. Synthesis route and structural properties of nanoferrites

    Energy Technology Data Exchange (ETDEWEB)

    Zaharieva, Katerina; Cherkezova-Zheleva, Zara; Kunev, Boris; Shopska, Maya; Mitov, Ivan [Institute of Catalysis, Bulgarian Academy of Sciences, Sofia (Bulgaria)

    2013-07-01

    The nano dimensional magnesium ferrite materials Mg{sub 0.25}Fe{sub 2.75}O{sub 4} , Mg{sub 0.5}Fe{sub 2.5}O{sub 4} and MgFe{sub 2}O{sub 4} with different stoichiometry were prepared by co-precipitation procedure using MgCl{sub 2} •6H{sub 2}O, FeCl{sub 2} •4H{sub 2}O and FeCl{sub 3} •6H{sub 2}O and NaOH as precipitant. The physicochemical methods - X-ray diffraction analysis, Moessbauer spectroscopy and FTIR spectroscopy were performed to investigate the structural properties of obtained nano size magnesium ferrite type samples. The registered experimental data were determined the presence of spinel ferrites and additional precursor phases as iron oxihydroxides and double layered hydroxides in ferrite materials MgxFe{sub 3-x}O{sub 4} (x=0.5;1). In the case of magnesium ferrite sample Mg{sub x}Fe{sub 3-x}O{sub 4} (x=0.25) the existence of non-stoichiometric spinel ferrite and intermediate phase - iron oxihydroxides were observed only. Key words: magnesium ferrites, co-precipitation, physicochemical methods.

  13. Structure and properties of hybrid coatings

    International Nuclear Information System (INIS)

    Pogrebnjak, A.D.; Vasilyuk, V.V.; Kravchenko, Yu.A.; Tyurin, Yu.N.; Alontseva, D.L.; Ponaryadov, V.V.; Ruzimov, Sh.M.

    2004-01-01

    Full text: This review report presents both the results obtained by the authors and those of other authors concerning investigations of structure and properties of hybrid coatings. Examples of such coatings as Al 2 O 3 /Cr/TiN/steel, TiC; TiN/Ti-V-Al; NiCr/steel; CrNiBSi/steel and others before and after electron beam irradiation had been considered. In these coatings the thickest layer was deposited using the high-velocity pulsed plasma jet, all others being deposited in vacuum by the vacuum-arc source or implanter. Advantages of the high-velocity pulsed plasma jet in comparison with other technologies had been demonstrated. A wide spectrum of analyzing methods had been applied for analyses: TEM, SEM with EDS, RBS, NRA, SIMS, XRD, tests for corrosion, wear, adhesion and hardness. The works had been funded by the Project 2M/03 54-2003 of the Ministry of Science and Education of Ukraine and STCU Project N3078

  14. Synthesis route and structural properties of nanoferrites

    International Nuclear Information System (INIS)

    Zaharieva, Katerina; Cherkezova-Zheleva, Zara; Kunev, Boris; Shopska, Maya; Mitov, Ivan

    2013-01-01

    The nano dimensional magnesium ferrite materials Mg 0.25 Fe 2.75 O 4 , Mg 0.5 Fe 2.5 O 4 and MgFe 2 O 4 with different stoichiometry were prepared by co-precipitation procedure using MgCl 2 •6H 2 O, FeCl 2 •4H 2 O and FeCl 3 •6H 2 O and NaOH as precipitant. The physicochemical methods - X-ray diffraction analysis, Moessbauer spectroscopy and FTIR spectroscopy were performed to investigate the structural properties of obtained nano size magnesium ferrite type samples. The registered experimental data were determined the presence of spinel ferrites and additional precursor phases as iron oxihydroxides and double layered hydroxides in ferrite materials MgxFe 3-x O 4 (x=0.5;1). In the case of magnesium ferrite sample Mg x Fe 3-x O 4 (x=0.25) the existence of non-stoichiometric spinel ferrite and intermediate phase - iron oxihydroxides were observed only. Key words: magnesium ferrites, co-precipitation, physicochemical methods

  15. The influence of included minerals on the intrinsic reactivity of chars prepared under N{sub 2} and CO{sub 2} environment

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, Hong; Li, Huan; Chen, Jiabao; Zhao, Bo; Hu, Guangzhou [China Univ. of Mining and Technology, Jiangsu (China). School of Chemical Engineering

    2013-07-01

    Oxy-fuel technology could be successfully used to retrofit existing coal-fired power plants or alternatively be used to design and build new coal-fired power plants with almost zero emissions. Char reactivity under oxy-fuel conditions will have a significant impact on the coal burnout. In this paper, two fractions, representing organic-rich particles and organic particles with included minerals, were separated from each of three Chinese coals of different rank. They were then devolatilized at 1,450 C in a drop tube furnace (DTF) under N{sub 2} and CO{sub 2} environment, respectively. The chars were subjected to nitrogen adsorption study, thermogravimetric analysis and XRD analysis. It was found that char reactivity of all three pairs of chars were increased under CO{sub 2} environment as compared with that under N{sub 2} environment, but with differing trend. For the organic-rich samples the reactivity difference is increased with decreasing rank. On the contrary, for the samples of organic particles with included minerals, the reactivity difference is decreased with decreasing rank. Mechanism analysis showed that they are resulted not from gasification, but from a combination of changes in surface area and in the orderness of carbon structure in the chars, both of which, in turn, are resulted from the higher heat capacity of CO{sub 2} and the interaction between metastable liquid phase and the included minerals.

  16. Phase relations, crystal structures and physical properties of nuclear fuels

    International Nuclear Information System (INIS)

    Tagawa, Hiroaki; Fujino, Takeo; Tateno, Jun

    1975-07-01

    Phase relations, crystal structures and physical properties of the compounds for nuclear fuels are presented, including melting point, thermal expansion, diffusion and magnetic and electric properties. Emphasis is on oxides, carbides and nitrides of thorium, uranium and plutonium. (auth.)

  17. Surface morphology, structural and electrical properties of RF ...

    Indian Academy of Sciences (India)

    2018-05-19

    May 19, 2018 ... ITO thin films; sputtering; structure; electrical properties; AFM; Hall effect. 1. Introduction ... ness range (61–768 nm) and to see if this system present properties that .... using the Bragg equation, and the relation linking the inter-.

  18. Suspension Combustion of Wood: Influence of Pyrolysis Conditions on Char Yield, Morphology, and Reactivity

    DEFF Research Database (Denmark)

    Dall'Ora, Michelangelo; Jensen, Peter Arendt; Jensen, Anker Degn

    2008-01-01

    Chars from pine and beech wood were produced by fast pyrolysis in an entrained flow reactor and by slow pyrolysis in a thermogravimetric analyzer. The influence of pyrolysis temperature, heating rate and particle size on char yield and morphology was investigated. The applied pyrolysis temperature...... varied in the range 673−1673 K for slow pyrolysis and between 873 and 1573 K for fast pyrolysis. The chars were oxidized in a thermogravimetric analyzer and the mass loss data were used to determine char oxidation reactivity. Char yield from fast pyrolysis (104−105 K/s) was as low as 1 to 6% on a dry ash......, char oxidation reactivity decreased as pyrolysis temperature increased. The amount and composition of the ash forming matter of the wood fuels seems to play an important role in determining the differences in char yield, morphology and reactivity....

  19. A study on the char burnout characteristics of coal and biomass blends

    Energy Technology Data Exchange (ETDEWEB)

    Behdad Moghtaderi [University of Newcastle, Callaghan, NSW (Australia). Discipline of Chemical Engineering, School of Engineering, Faculty of Engineering and Built Environment

    2007-10-15

    The char burnout characteristics of coal/biomass blends under conditions pertinent to pulverised fuel combustors were investigated by a combined modelling and experimental approach. Results indicate that blending of coal with biomass increases the likelihood of char extinction (i.e. extinction potential of the char particle in the blend), in turn, decreasing the char burnout level. Our modelling results attribute this to a reduction in the char particle size to levels below a critical dimension which appears to be a strong function of the fuel blending ratio (the weight percentage of biomass in the blend), fuel reactivity, char cloud shape and particle density number. It is demonstrated here that the drop in the char burnout level during co-firing can be effectively resolved when a more reactive secondary coal is added to the blend to minimise its extinction potential. 22 refs., 8 figs., 2 tabs.

  20. The carbon dioxide gasification characteristics of biomass char samples and their effect on coal gasification reactivity during co-gasification.

    Science.gov (United States)

    Mafu, Lihle D; Neomagus, Hein W J P; Everson, Raymond C; Okolo, Gregory N; Strydom, Christien A; Bunt, John R

    2018-06-01

    The carbon dioxide gasification characteristics of three biomass char samples and bituminous coal char were investigated in a thermogravimetric analyser in the temperature range of 850-950 °C. Char SB exhibited higher reactivities (R i , R s , R f ) than chars SW and HW. Coal char gasification reactivities were observed to be lower than those of the three biomass chars. Correlations between the char reactivities and char characteristics were highlighted. The addition of 10% biomass had no significant impact on the coal char gasification reactivity. However, 20 and 30% biomass additions resulted in increased coal char gasification rate. During co-gasification, chars HW and SW caused increased coal char gasification reactivity at lower conversions, while char SB resulted in increased gasification rates throughout the entire conversion range. Experimental data from biomass char gasification and biomass-coal char co-gasification were well described by the MRPM, while coal char gasification was better described by the RPM. Copyright © 2018 Elsevier Ltd. All rights reserved.

  1. Flat-flame burner studies of pulverized-coal combustion. Experimental results on char reactivity

    Energy Technology Data Exchange (ETDEWEB)

    Peck, R.E.; Shi, L.

    1996-12-01

    Structure of laminar, premixed pulverized-coal flames in a 1-D reactor has been studied with emphasis on char reactivity. A 1.1-meter-long tube furnace accommodated high-temperature environments and long residence times for the laminar flames produced by a flat-flame, coal-dust burner. Experiments were conducted at different operating conditions (fuel type/size, fuel-air ratio). Measurements included solid sample composition, major gas species and hydrocarbon species concentrations, and gas- and particle-phase line-of-sight temperatures at different axial locations in flames. Degree of char burnout increased with coal volatiles content and decreased with coal particle size. Combustion in furnace was in oxidizer-deficient environment and higher burnout was achieved as the fuel-air ratio neared stoichiometric. For 0-45 {mu}m particles most of the fixed carbon mass loss occurred within 5 cm of the furnace inlet, and char reaction was slow downstream due to low oxidizer concentrations. Fixed carbon consumption of the 45-90 {mu}m particles generally was slower than for the small particles. About 40%-80% of the fixed carbon was oxidized in the furnace. Primary volatiles mass loss occurred within the first 4.5 cm, and more than 90% of the volatiles were consumed in the flames. The flames stabilized in the furnace produced less CH{sub 4} and H{sub 2} in the burnt gas than similar unconfined flames. NO concentrations were found to decrease along the furnace and to increase with decreasing fuel/air ratio. Temperature measurement results showed that gas-phase temperatures were higher than solid-phase temperatures. Temperatures generally decreased with decreasing volatiles content and increased as the equivalence ratio approached one. The results can be used to interpret thermochemical processes occurring in pulverized-coal combustion. (au) 15 refs.

  2. Structure and magnetic properties of Alnico ribbons

    Science.gov (United States)

    Zhang, Ce; Li, Ying; Han, Xu-Hao; Du, Shuai-long; Sun, Ji-bing; Zhang, Ying

    2018-04-01

    Al-Ni-Co alloy has been widely applied in various industrial fields due to its excellent thermal and magnetic stability. In this paper, new Al-Ni-Co ribbons are prepared by simple processes combining melt-spinning with annealing, and their phase transition, microstructure and magnetic properties are studied. The results show that after as-spun ribbons are annealed, the grain size of ribbons increases from 1.1 ± 0.3 μm to 4.8 ± 0.8 μm, but still much smaller than that of the bulk Al-Ni-Co alloy manufactured by traditional technologies. In addition, some rod-like Al70Co20Ni10-type, Al9Co2-type and Fe2Nb-type phases are precipitated at grain boundaries; simultaneously, the distinct spinodal decomposition microstructure with periodic ingredient variation is thoroughly formed in all grains by the reaction of α → α1 + α2. Furthermore, the α1 and α2 distribute alternately like a maze, the Fe-Co-rich α1 phase holds 35.9-47.3 vol%, while the Al-Ni-rich α2 phase occupies the rest. Finally, the coercivity of annealed ribbons can reach to 485.3 ± 76.6 Oe. If the annealed ribbons are further aged at 560 °C, their Hc even increases to 738.1 ± 81.0 Oe. The coercivity mechanism is discussed by the combination of microstructure and domain structure.

  3. Determination of reactivity parameters of model carbons, cokes and flame-chars

    DEFF Research Database (Denmark)

    Sørensen, Lasse Holst; Gjernes, Erik; Jessen, Thomas

    1996-01-01

    Reactivity profiles are defined and measured with thermogravimetry for a dense metallurgical Longyear coke, a polymer-derived porous active carbon, Carboxen 1000, and three flame-chars, Illinois #6, Pittsburgh #8 and New Mexico Blue #1. For each sample it is found that the reactivity profile can...... and activation energy in oxygen are estimated for each sample over a 100 K temperature range (cases vary from 573 to 885 K) and a maximum oxygen partial pressure range of 0.01-1 bar. For the different fuel samples reaction orders range fromn =0.65 to 0.78, and global activation energies are found in the narrow...... range of 130-133 kJ/mol. For Carboxen n=0.91 and E=146 kJ/mol. The reactivity differences between the coal chars are proposed mainly due to variations in the physical structure. Over the pressure-temperature domain examined reactivity varies considerably, but the structural profile is approximately...

  4. Char crystalline transformations during coal combustion and their implications for carbon burnout

    Energy Technology Data Exchange (ETDEWEB)

    Hurt, R.H.

    1999-03-11

    Residual, or unburned carbon in fly ash affects many aspects of power plant performance and economy including boiler efficiency, electrostatic precipitator operation, and ash as a salable byproduct. There is a large concern in industry on the unburned carbon problem due to a variety of factors, including low-NOx combustion system and internationalization of the coal market. In recent work, it has been found that residual carbon extracted from fly ash is much less reactive than the laboratory chars on which the current kinetics are based. It has been suggested that thermal deactivation at the peak temperature in combustion is a likely phenomenon and that the structural ordering is one key mechanism. The general phenomenon of carbon thermal annealing is well known, but there is a critical need for more data on the temperature and time scale of interest to combustion. In addition, high resolution transmission electron microscopy (HRTEM) fringe imaging, which provides a wealth of information on the nature and degree of crystallinity in carbon materials such as coal chars, has become available. Motivated by these new developments, this University Coal Research project has been initiated with the following goals: to determine transient, high-temperature, thermal deactivation kinetics as a function of parent coal and temperature history; and to characterize the effect of this thermal treatment on carbon crystalline structure through high-resolution transmission electron microscopy and specialized, quantitative image analysis.

  5. Char crystalline transformations during coal combustion and their implications for carbon burnout

    Energy Technology Data Exchange (ETDEWEB)

    Hurt, R.H.

    1999-07-07

    Residual, or unburned carbon in fly ash affects many aspects of power plant performance and economy including boiler efficiency, electrostatic precipitator operation, and ash as a salable byproduct. There is a large concern in industry on the unburned carbon problem due to a variety of factors, including low-NOx combustion system and internationalization of the coal market. In recent work, it has been found that residual carbon extracted from fly ash is much less reactive than the laboratory chars on which the current kinetics are based. It has been suggested that thermal deactivation at the peak temperature in combustion is a likely phenomenon and that the structural ordering is one key mechanism. The general phenomenon of carbon thermal annealing is well known, but there is a critical need for more data on the temperature and time scale of interest to combustion. In addition, high resolution transmission electron microscopy (HRTEM) fringe imaging, which provides a wealth of information on the nature and degree of crystallinity in carbon materials such as coal chars, has become available. Motivated by these new developments, this University Coal Research project has been initiated with the following goals: (1) To determine transient, high-temperature, thermal deactivation kinetics as a function of parent coal and temperature history. (2) To characterize the effect of the thermal treatment on carbon crystalline structure through high-resolution transmission electron microscopy and specialized, quantitative image analysis.

  6. Structural, dielectric and electrical properties of ...

    Indian Academy of Sciences (India)

    Administrator

    Detailed studies of dielectric properties of the compound as a function of temperature at ... Microscope (Jeol, JSM-840), operated at 20 kV. The sin- tered pellet was .... grain boundaries, and provides the true picture of the electrical properties of ...

  7. Degradation of p-Nitrophenol by Lignin and Cellulose Chars: H2O2-Mediated Reaction and Direct Reaction with the Char.

    Science.gov (United States)

    Yang, Jing; Pignatello, Joseph J; Pan, Bo; Xing, Baoshan

    2017-08-15

    Chars and other black carbons are reactive toward certain compounds. Such reactivity has been attributed to reduction of O 2 by persistent free radicals in the solid to H 2 O 2 , which then back-reacts with the solid to generate reactive oxygen species (ROS; especially HO • ). We studied the decomposition of p-nitrophenol (PNP) by pure lignin and cellulose chars aged in moist air or a vacuum at room temperature for up to a month. In air, the chars chemisorbed oxygen, a portion of which was liberated as H 2 O 2 when the char was submerged in water. The evolved H 2 O 2 was simultaneously decomposed by the char. PNP reacted predominantly in the sorbed state and only reduction products (phenol, catechol) were identified. Aging the char in air sharply (within hours) reduced H 2 O 2 -producing capacity and free radical concentration, but more gradually reduced PNP decay rate over the month-long period. PNP decay was only modestly suppressed (12-30%) by H 2 O 2 removal (catalase), and had little effect on the free radical signal (reactive sites. Lignin char was generally more reactive than cellulose char. The Fe impurity in lignin played no role. The results are relevant to the fate of pollutants in black carbon-rich environments and the use of carbons in remediation.

  8. Tools to Understand Structural Property Relationships for Wood Cell Walls

    Science.gov (United States)

    Joseph E. Jakes; Daniel J. Yelle; Charles R. Frihart

    2011-01-01

    Understanding structure-property relationships for wood cell walls has been hindered by the complex polymeric structures comprising these cell walls and the difficulty in assessing meaningful mechanical property measurements of individual cell walls. To help overcome these hindrances, we have developed two experimental methods: 1) two-dimensional solution state nuclear...

  9. Flexible Nanocellulose - Nanoparticle Composites: Structures and Properties

    OpenAIRE

    UTHPALA MANAVI GARUSINGHE

    2018-01-01

    Nanocellulose is biodegradable and renewable and has many attractive properties of technological interest. Therefore, nanocellulose can be converted into thin films, which is used in wide range of applications. However, the property range achievable with nanocellulose by itself still has limitations. This thesis focuses on the production of nanocellulose-inorganic nanoparticle composites to combine the advantage associated with both individual components together to extend the range of proper...

  10. Organic bulk heterojunction photovoltaic structures: design, morphology and properties

    International Nuclear Information System (INIS)

    Bulavko, G V; Ishchenko, A A

    2014-01-01

    Main approaches to the design of organic bulk heterojunction photovoltaic structures are generalized and systematized. Novel photovoltaic materials based on fullerenes, organic dyes and related compounds, graphene, conjugated polymers and dendrimers are considered. The emphasis is placed on correlations between the chemical structure and properties of materials. The effect of morphology of the photoactive layer on the photovoltaic properties of devices is analyzed. Main methods of optimization of the photovoltaic properties are outlined. The bibliography includes 338 references

  11. Electronic structure and properties of rare earth and actinide intermetallics

    International Nuclear Information System (INIS)

    Kirchmayr, H.R.

    1984-01-01

    There are 188 contributions, experimental and theoretical, a few on rare earth and actinide elements but mostly on rare earth and actinide intermetallic compounds and alloys. The properties dealt with include 1) crystal structure, 2) magnetic properties and magnetic structure, 3) magnetic phase transformations and valence fluctuations, 4) electrical properties and superconductivity and their temperature, pressure and magnetic field dependence. A few papers deal with crystal growth and novel measuring methods. (G.Q.)

  12. Foundations of compositional models: structural properties

    Czech Academy of Sciences Publication Activity Database

    Jiroušek, Radim; Kratochvíl, Václav

    2015-01-01

    Roč. 44, č. 1 (2015), s. 2-25 ISSN 0308-1079 R&D Projects: GA ČR GA13-20012S Grant - others:GA ČR(CZ) GAP403/12/2175 Program:GA Institutional support: RVO:67985556 Keywords : multidimensional distribution * conditional independence * composition * semigraphoid properties * running intersection property Subject RIV: BA - General Mathematics Impact factor: 1.677, year: 2015 http://library.utia.cas.cz/separaty/2015/MTR/jirousek-0442412.pdf

  13. Structure, reactivity, and biological properties of hidantoines

    International Nuclear Information System (INIS)

    Oliveira, Silvania Maria de; Silva, Joao Bosco Paraiso da; Hernandes, Marcelo Zaldini; Lima, Maria do Carmo Alves de; Galdino, Suely Lins; Pitta, Ivan da Rocha

    2008-01-01

    Hydantoin (imidazolidine-2,4-dione) is a 2,4-diketotetrahydroimidazole discovered by Baeyer in 1861. Thiohydantoins and derivatives were prepared, having chemical properties similar to the corresponding carbonyl compounds. Some biological activities (antimicrobial, anticonvulsant, schistosomicidal) are attributed to the chemical reactivity and consequent affinity of hydantoinic rings towards biomacromolecules. Therefore, knowledge about the chemistry of hydantoins has increased enormously. In this review, we present important aspects such as reactivity of hydantoins, acidity of hydantoins, spectroscopy and crystallographic properties, and biological activities of hydantoin and its derivatives. (author)

  14. Structural Characteristics and Physical Properties of Tectonically Deformed Coals

    OpenAIRE

    Yiwen Ju; Zhifeng Yan; Xiaoshi Li; Quanlin Hou; Wenjing Zhang; Lizhi Fang; Liye Yu; Mingming Wei

    2012-01-01

    Different mechanisms of deformation could make different influence on inner structure and physical properties of tectonically deformed coal (TDC) reservoirs. This paper discusses the relationship between macromolecular structure and physical properties of the Huaibei-Huainan coal mine areas in southern North China. The macromolecular structure and pore characteristics are systematically investigated by using techniques such as X-ray diffraction (XRD), high-resolution transmission electron mic...

  15. Structural and elastic properties of porous silicon

    Energy Technology Data Exchange (ETDEWEB)

    Matthai, C C [Department of Physics and Astronomy, University of Wales College of Cardiff, Cardiff CF2 3YB (United Kingdom); Gavartin, J L [Department of Physics and Astronomy, University of Wales College of Cardiff, Cardiff CF2 3YB (United Kingdom); Cafolla, A A [Department of Physics, Dublin City University, Dublin (Ireland)

    1995-01-15

    We have implemented a modified diffusion-limited aggregation model to simulate the porous silicon structure obtained by electrochemical dissolution. The resulting fractal structures were fully equilibrated using the molecular dynamics method. An analysis of the relaxed structure shows it to be quite stable with the presence of one-, two- and three-coordinated atoms as well as the four-coordinated atoms found in bulk silicon. It is suggested that the different substructures or nanocrystals might be responsible for the observed photoluminescence. ((orig.))

  16. Hydrothermal synthesis, crystal structure and luminescence property ...

    Indian Academy of Sciences (India)

    The design and construction of ... dination polymers. It is difficult to design coordination .... The first endotherm at about 180 ... graphic data for coordination polymer 1. ... Sheldrick G M 1997 SHELXS-97: Program for solution of crystal structures ...

  17. Electronic structure and optical properties of AIN under high pressure

    International Nuclear Information System (INIS)

    Li Zetao; Dang Suihu; Li Chunxia

    2011-01-01

    We have calculated the electronic structure and optical properties of Wurtzite structure AIN under different high pressure with generalized gradient approximation (GGA) in this paper. The total energy, density of state, energy band structure and optical absorption and reflection properties under high pressure are calculated. By comparing the changes of the energy band structure, we obtained AIN phase transition pressure for 16.7 GPa, which is a direct band structure transforming to an indirect band structure. Meanwhile, according to the density of states distribution and energy band structure, we analyzed the optical properties of AIN under high-pressure, the results showed that the absorption spectra moved from low-energy to high-energy. (authors)

  18. Flame retardancy and thermal behavior of intumescent flame-retardant EVA composites with an efficient triazine-based charring agent

    Science.gov (United States)

    Xu, Bo; Ma, Wen; Wu, Xiao; Qian, Lijun; Jiang, Shan

    2018-04-01

    Intumescent flame retardant (IFR) EVA composites were prepared based on a hyperbranched triazine charring-foaming agent (HTCFA) and ammonium polyphosphate (APP). The synergistic effect of HTCFA and APP on the flame retardancy and thermal behavior of the composites were investigated through flammability tests, cone calorimeter measurements, thermogravimetric analysis (TGA) including evolved gas analysis (TG-IR) and residue analysis (Fourier transform infrared (FTIR), laser Raman spectroscopy (LRS), x-ray Photoelectron Spectroscopy (XPS) and scanning electron microscopy (SEM)). The flammability test results showed HTCFA/APP (1/3) system presented the best synergistic effect in flame-retardant EVA composites with the highest LOI value and UL-94 V-0 rating. As for cone calorimeter results, IFR changed the combustion behavior of EVA and resulted in remarkable decrease of flammability and smoke product. TGA results showed the synergistic effect between APP and HTCFA could strengthen the char-forming ability of composites. TG-IR results indicated the melt viscosities and gas release with increasing temperature were well-correlated for EVA/IFR composite. The residue analysis results from SEM, LRS, FT-IR and XPS revealed IFR promoted forming more compact graphitic char layer, connected by rich P–O–C and P–N structures.

  19. Measurement and modeling the coefficient of restitution of char particles under simulated entrained flow gasifier conditions

    Science.gov (United States)

    Gibson, LaTosha M.

    Inefficiencies in plant operations due to carbon loss in flyash, necessitate control of ash deposition and the handling of the slag disposal. Excessive char/ash deposition in convective coolers causes reduction in the heat transfer, both in the radiative (slagging) section and in the low-temperature convective (fouling) heating section. This can lead to unplanned shutdowns and result in an increased cost of electricity generation. CFD models for entrained flow gasification have used the average bulk coal composition to simulate slagging and ash deposition with a narrow particle size distribution (PSD). However, the variations in mineral (inorganic) and macerals (organic) components in coal have led to particles with a variation in their inorganic and organic composition after grinding as governed by their Particle Size Distribution (PSD) and mineral liberation kinetics. As a result, each particle in a PSD of coal exhibits differences in its conversion, particle trajectory within the gasifier, fragmentation, swelling, and slagging probability depending on the gasifier conditions (such as the temperature, coal to oxygen ratio, and swirling capacity of the coal injector). Given the heterogeneous behavior of char particles within a gasifier, the main objective of this work was to determine boundary conditions of char particle adhering and/or rebounding from the refractory wall or a layer of previously adhered particles. In the past, viscosity models based on the influence of ash composition have been used as the method to characterize sticking. It is well documented that carbon contributes to the non-wettability of particles. Therefore, it has been hypothesized that viscosity models would not be adequate to accurately predict the adhesion behavior of char. Certain particle wall impact models have incorporated surface tension which can account the contributions of the carbon content to the adhesive properties of a char particle. These particle wall impact models also

  20. On some fundamental properties of structural topology optimization problems

    DEFF Research Database (Denmark)

    Stolpe, Mathias

    2010-01-01

    We study some fundamental mathematical properties of discretized structural topology optimization problems. Either compliance is minimized with an upper bound on the volume of the structure, or volume is minimized with an upper bound on the compliance. The design variables are either continuous o....... The presented examples can be used as teaching material in graduate and undergraduate courses on structural topology optimization....

  1. Structure-function-property-design interplay in biopolymers: spider silk.

    Science.gov (United States)

    Tokareva, Olena; Jacobsen, Matthew; Buehler, Markus; Wong, Joyce; Kaplan, David L

    2014-04-01

    Spider silks have been a focus of research for almost two decades due to their outstanding mechanical and biophysical properties. Recent advances in genetic engineering have led to the synthesis of recombinant spider silks, thus helping to unravel a fundamental understanding of structure-function-property relationships. The relationships between molecular composition, secondary structures and mechanical properties found in different types of spider silks are described, along with a discussion of artificial spinning of these proteins and their bioapplications, including the role of silks in biomineralization and fabrication of biomaterials with controlled properties. Copyright © 2013 Acta Materialia Inc. Published by Elsevier Ltd. All rights reserved.

  2. New membrane structures with proton conducting properties

    DEFF Research Database (Denmark)

    Nørgaard, Casper Frydendal

    if higher operating temperature is enabled. One approach to obtain improved membranes in the aspects of applicable operating temperature and methanol permeability, which has attracted considerable attention, is the formation of composites by distributing inorganic fillers into Nafion or alternative polymers...... temperature and high relative humidity can cause excessive swelling of the membranes, yielding insufficient mechanical properties and breakdown of membrane function. Moreover, in the case of the Direct Methanol Fuel Cell (DMFC), their significant methanol permeability causes loss of efficiency. Higher...

  3. Meteorite Unit Models for Structural Properties

    Science.gov (United States)

    Agrawal, Parul; Carlozzi, Alexander A.; Karajeh, Zaid S.; Bryson, Kathryn L.

    2017-10-01

    To assess the threat posed by an asteroid entering Earth’s atmosphere, one must predict if, when, and how it fragments during entry. A comprehensive understanding of the asteroid material properties is needed to achieve this objective. At present, the meteorite material found on earth are the only objects from an entering asteroid that can be used as representative material and be tested inside a laboratory. Due to complex composition, it is challenging and expensive to obtain reliable material properties by means of laboratory test for a family of meteorites. In order to circumvent this challenge, meteorite unit models are developed to determine the effective material properties including Young’s modulus, compressive and tensile strengths and Poisson’s ratio, that in turn would help deduce the properties of asteroids. The meteorite unit model is a representative volume that accounts for diverse minerals, porosity, cracks and matrix composition.The Young’s Modulus and Poisson’s Ratio in the meteorite units are calculated by performing several hundreds of Monte Carlo simulations by randomly distributing the various phases inside these units. Once these values are obtained, cracks are introduced in these units. The size, orientation and distribution of cracks are derived by CT-scans and visual scans of various meteorites. Subsequently, simulations are performed to attain stress-strain relations, strength and effective modulus values in the presence of these cracks. The meteorite unit models are presented for H, L and LL ordinary chondrites, as well as for terrestrial basalt. In the case of the latter, data from the simulations is compared with experimental data to validate the methodology. These meteorite unit models will be subsequently used in fragmentation modeling of full scale asteroids.

  4. Nanoemulsions: formation, structure, and physical properties

    International Nuclear Information System (INIS)

    Mason, T G; Wilking, J N; Meleson, K; Chang, C B; Graves, S M

    2006-01-01

    We summarize procedures for producing 'nanoemulsions' comprised of nanoscale droplets, or 'nanoemulsions', methods for controlling the droplet size distribution and composition, and interesting physical properties of nanoemulsions. In contrast to more common microscale emulsions, nanoemulsions exhibit optical transparency at high droplet volume fractions, φ, surprisingly strong elasticity at low φ, and enhanced diffusive transport and shelf stability. For these reasons, nanoemulsions have great potential in a wide range of industries including pharmaceuticals, foods, and personal care products. (topical review)

  5. Environmental effects on properties of structural alloys

    International Nuclear Information System (INIS)

    Chopra, O.K.; Smith, D.L.

    1984-01-01

    Corrosion data are presented for several austenitic and ferritic steels exposed at temperatures between 700 and 755 K in flowing lithium and Pb-17Li environments. The results indicate that dissolution rates for both steels are an order of magnitude greater in Pb-Li than in lithium. Tensile data for cold-worked type 316 stainless steel show that a flowing environment has no effect on the tensile properties of type 316 stainless steel at temperatures between 473 and 773 K

  6. Structure Property Relationships in Organic Conjugated Systems

    OpenAIRE

    O'Neill, Luke; Lynch, Patrick; McNamara, Mary

    2005-01-01

    A series of π conjugated oligomers were studied by absorption and photoluminescence spectroscopy. A linear relationship between the positioning of the absorption and photoluminescence maxima plotted against inverse conjugation length is observed. The relationships are in good agreement with the simple particle in a box method, one of the earliest descriptions of the properties of one-dimensional organic molecules. In addition to the electronic transition energies, it was observed that the Sto...

  7. Structure Property Relationships in Organic Conjugated Systems

    OpenAIRE

    O'Neill, Luke

    2008-01-01

    A series of pi(п) conjugated oligomers containing 1 to 6 monomer units were studied by absorption and photoluminescence spectroscopies. The results are discussed and examined with regard to the variation of the optical properties with the increase of effective conjugation length. It was found that there was a linear relationship between the positioning of the absorption and photoluminescence maxima plotted against inverse conjugation length. The relationships are in good agreement with the si...

  8. Electron beam crosslinked PVC : structure property relationships

    International Nuclear Information System (INIS)

    Gupta, Neeraj K.; Sabharwal, Sunil

    2001-01-01

    PVC is used extensively for its insulating properties for the manufacture of wires and cables and for other applications. Its gradual degradation, oxidation and even dehydro chlorination restricts use for long lasting period in installations such as high temperature zones, underground cables, communication systems, electro-nuclear facilities, etc. The technological properties and performance characteristics of PVC based insulation can be improved via crosslinking by high-energy electrons. PVC is however a polymer, which on irradiation predominantly undergoes degradation. To avoid degradation, it needs to be compounded with sensitizing agents or multifunctional monomers so that crosslinking is the predominant reaction. Radiation cross linkable formulations are complex mixtures of resin and various additives incorporated for achieving desired technological and performance characteristics, ease of processing and improving quality. The proper choice of additives and sensitizing agents enable low dose requirements for efficient crosslinking and improvements in various technological properties. The purposes of this work was to investigate the effect of using a binary sensitizer blend of a trifunctional monomer and a rubber in PVC, and develop suitable electron beam cross linkable formulations for wire insulation. This paper presents some aspects of the investigations and development of insulation demonstrated at industrial scale

  9. Pyrolysis of rice husk and corn stalk in auger reactor:Part 1. Characterization of char and gas at various temperatures

    OpenAIRE

    Yu, Yang; Yang, Yang; Cheng, Zhicai; Blanco, Paula H.; Liu, Ronghou; Bridgwater, A.V.; Cai, Junmeng

    2016-01-01

    In this study, rice husk and corn stalk have been pyrolyzed in an auger pyrolysis reactor at pyrolysis temperatures of 350, 400, 450, 500, 550, and 600 °C in order to investigate the effect of the pyrolysis temperature on the pyrolysis performance of the reactor and physicochemical properties of pyrolysis products (this paper focuses on char and gas). The results have shown that the pyrolysis temperature significantly affects the mass yields and properties of the pyrolysis products. The mass ...

  10. Production of activated char from Illinois coal for flue gas cleanup

    Science.gov (United States)

    Lizzio, A.A.; DeBarr, J.A.; Kruse, C.W.

    1997-01-01

    Activated chars were produced from Illinois coal and tested in several flue gas cleanup applications. High-activity chars that showed excellent potential for both SO2 and NOx removal were prepared from an Illinois No. 2 bituminous coal. The SO2 (120 ??C) and NOx (25 ??C) removal performance of one char compared favorably with that of a commercial activated carbon (Calgon Centaur). The NOx removal performance of the same char at 120 ??C exceeded that of the Centaur carbon by more than 1 order of magnitude. Novel char preparation methods were developed including oxidation/thermal desorption and hydrogen treatments, which increased and preserved, respectively, the active sites for SO2 and NOx adsorption. The results of combined SO2/NOx removal tests, however, suggest that SO2 and NOx compete for similar adsorption sites and SO2 seems to be more strongly adsorbed than NO. A low-activity, low-cost char was also developed for cleanup of incinerator flue gas. A three-step method involving coal preoxidation, pyrolysis, and CO2 activation was used to produce the char from Illinois coal. Five hundred pounds of the char was tested on a slipstream of flue gas from a commercial incinerator in Germany. The char was effective in removing >97% of the dioxins and furans present in the flue gas; mercury levels were below detectable limits.

  11. Study of the reaction of uranium and plutonium with bone char

    International Nuclear Information System (INIS)

    Silver, G.L.; Koenst, J.W.

    1977-01-01

    A study of the reaction of plutonium with a commercial bone char indicates that this bone char has a high capacity for removing plutonium from aqueous wastes. The adsorption of plutonium by bone char is pH dependent, and for plutonium(IV) polymer appears to be maximized near pH 7.3 for plutonium concentrations typical of some waste streams. Adsorption is affected by dissolved salts, especially calcium and phosphate salts. Freundlich isotherms representing the adsorption of uranium and plutonium have been prepared. The low potential imposed upon aqueous solutions by commercial bone char is adequate for reduction of hexavalent plutonium to a lower plutonium oxidation state

  12. The thermal history of char as disclosed by carbon isotope ratios

    DEFF Research Database (Denmark)

    Egsgaard, Helge; Ambus, Per; Ahrenfeldt, Jesper

    In laboratory experiments, biomass char was produced under controlled conditions using wood chips from French pinewood. Different char qualities were obtained by pyrolysing the biomass at similar heating rates with end-temperatures ranging from 250 to 1000 o C. The char was analysed by flash...... pyrolysis and isotope ratio mass spectrometry. The results demonstrate that the temperature history of the char is reflected in the fine variation of carbon isotopes. The compound classes responsible for the variation were identified. Key words: Isotope ratio, flash pyrolysis, hot gas cleaning...

  13. Time domain-nuclear magnetic resonance study of chars from southern hardwoods

    International Nuclear Information System (INIS)

    Elder, Thomas; Labbe, Nicole; Harper, David; Rials, Timothy

    2006-01-01

    Chars from the thermal degradation of silver maple (Acer saccharinum), red maple (Acer rubrum), sugar maple (Acer saccharum), and white oak (Quercus spp.), performed at temperatures from 250 to 350 o C, were examined using time domain-nuclear magnetic resonance spectroscopy. Prior to analysis, the chars were equilibrated under conditions insuring the presence of bound water only and both bound water and free water. Transverse relaxation times were found to be related to the moisture content of the chars, which varied with temperature. At elevated temperatures the number of signals assigned to free water decreased, indicative of an increase in pore size within the chars

  14. Structure and properties of diamond and diamond-like films

    Energy Technology Data Exchange (ETDEWEB)

    Clausing, R.E. [Oak Ridge National Lab., TN (United States)

    1993-01-01

    This section is broken into four parts: (1) introduction, (2) natural IIa diamond, (3) importance of structure and composition, and (4) control of structure and properties. Conclusions of this discussion are that properties of chemical vapor deposited diamond films can compare favorably with natural diamond, that properties are anisotropic and are a strong function of structure and crystal perfection, that crystal perfection and morphology are functions of growth conditions and can be controlled, and that the manipulation of texture and thereby surface morphology and internal crystal perfection is an important step in optimizing chemically deposited diamond films for applications.

  15. Composition-structure-property relation of oxide glasses

    DEFF Research Database (Denmark)

    Hermansen, Christian

    also increases such properties. Yet, these rules are not strictly followed even for the simplest binary oxide glasses, such as alkali silicates, borates and phosphates. In this thesis it is argued that the missing link between composition and properties is the glass structure. Structural models...... are proposed based on topological selection rules and experimentally verified. The relation between structure and properties is evaluated using topological constraint theory, which in its essence is a theory that quantifies the two intuitions of the glass scientist. The end result is a quantitative model...

  16. Structure and Magnetic Properties of Lanthanide Nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Dickerson, James Henry [Vanderbilt Univ., Nashville, TN (United States)

    2014-06-01

    We have had considerable success on this project, particularly in the understanding of the relationship between nanostructure and magnetic properties in lanthanide nanocrystals. We also have successfully facilitated the doctoral degrees of Dr. Suseela Somarajan, in the Department of Physics and Astronomy, and Dr. Melissa Harrison, in the Materials Science Program. The following passages summarize the various accomplishments that were featured in 9 publications that were generated based on support from this grant. We thank the Department of Energy for their generous support of our research efforts in this area of materials science, magnetism, and electron microscopy.

  17. Electronic structure and properties of superheavy elements

    International Nuclear Information System (INIS)

    Pershina, V.

    2015-01-01

    Spectacular developments in the relativistic quantum theory and computational algorithms in the last few decades allowed for accurate calculations of properties of the superheavy elements (SHE) and their compounds. Often conducted in a close link to the experimental research, these investigations helped predict and interpret an outcome of sophisticated and expensive experiments with single atoms. Most of the works, particularly those related to the experimental studies, are overviewed in this publication. The role of relativistic effects being of paramount importance for the heaviest elements is elucidated.

  18. The Structure and Flexural Properties of Typha Leaves

    Directory of Open Access Journals (Sweden)

    Jingjing Liu

    2017-01-01

    Full Text Available The Typha leaf has a structure of lightweight cantilever beam, exhibiting excellent mechanical properties with low density. Especially, the leaf blade evolved high strength and low density with high porosity. In this paper, the structure of Typha leaf was characterized by microcomputed tomography (Micro-CT and scanning electron microscopy (SEM, and the relationship with flexural properties was analyzed. The three-point bending test was performed on leaves to examine flexural properties, which indicated that the flexural properties vary from the base to the apex in gradient. The cross-sectional geometry shape of the leaf blade presented a strong influence on the optimized flexural stiffness. The load carrying capacity of the leaf depended on the development level of the epidermal tissue, the vascular bundle, the mechanical tissue, and the geometric properties. The investigation can be the basis for lightweight structure design and the application in the bionic engineering field.

  19. Fused aromatic thienopyrazines: structure, properties and function

    KAUST Repository

    Mondal, Rajib

    2010-01-01

    Recent development of a fused aromatic thieno[3.4-b]pyrazine system and their application in optoelectronic devices are reviewed. Introduction of a fused aromatic unit followed by side chain engineering, dramatically enhanced the charge carrier mobility in thin film transistor devices and mobilities up to 0.2 cm2/Vs were achieved. The optoelectronic properties of these fused aromatic thienopyrazine polymers (Eg = 1.3 to 1.6 eV, HOMO = -4.9 to -5.2 V) were tuned by introduction of various fused aromatic rings within thienopyrazine. By balancing the fundamental properties of these polymers, both high charge carrier mobilities and moderate PCEs in solar cells were achieved. Further, effects of copolymerizing units are discussed. Low band gap semiconducting polymer (Eg ∼ 1 eV) with high field effect mobility (0.044 cm2/Vs) was obtained using cyclopentadithiophene as copolymerizing unit. Finally, a molecular design approach to enhance the absorption coefficients is discussed, which resulted in improved power conversion efficiency in bulk heterojunction solar cells. © 2010 The Royal Society of Chemistry.

  20. The kinetics of combustion of chars derived from sewage sludge

    Energy Technology Data Exchange (ETDEWEB)

    J.S. Dennis; R.J. Lambert; A.J. Milne; S.A. Scott; A.N. Hayhurst [University of Cambridge, Cambridge (United Kingdom). Department of Chemical Engineering

    2005-02-01

    Experiments have been conducted to determine the combustion characteristics of sewage sludge chars in electrically heated beds of silica sand fluidised by air. The effects of the initial size of the char particles, the temperature of the bed and the concentration of (O{sub 2}) in the fluidising gas were investigated. Also, the temperatures of burning particles were measured with embedded thermocouples. The kinetics of combustion were measured at temperatures low enough for the CO formed by initial reaction between the carbon and oxygen to burn at some distance away from the particle. It is probable that the lower value is closer to the actual value, thought to be 135{+-}15 kJ/mol, reflecting the catalytic nature of the ash skeleton on which the carbon is supported. It was possible to obtain good agreement between measured burnout times and those predicted using the grain model of Szekely J, Evans JW, Sohn HY. Gas-solid reactions. New York: Academic Press; 1976, for the case where the kinetics are controlled by a combination of: (i) external mass transfer of oxygen from the particulate phase to the external surface of the burning char particle, (ii) diffusion of oxygen from the external surface into the porous matrix to the surfaces of grains, of which the solid is composed, and (iii) diffusion of oxygen into the microporous grains, where reaction occurs with the carbon. It was found that, for particles with diameters of 2 mm or larger, the initial rates of reaction, for bed temperatures in excess of 750{degree}C, are dominated by external mass transfer. 22 refs., 8 figs., 1 tab.

  1. Cesium in Arctic char lakes - effects of the Chernobyl accident

    International Nuclear Information System (INIS)

    Hammar, J.; Notter, M.; Neumann, G.

    1991-01-01

    Fallout radiocesium from the Chernobyl accident caused extensive contamination in a region of previously well studied alpine lake ecosystems in northern Sweden. Levels of Cs-137 in the barren catchment basins reached 20-50 kBq/m 2 during 1986. The distribution, pathways and major transport mechanisms of radiocesium through the lake ecosystems were studied during 1986-1990. Levels of Cs-137, Cs-134 and K-40 in water, surface sediment, detritus (sediment traps) and different trophic levels of the food chains of Arctic char (Salvelinus alpinus) and brown trout (Salmo trutta) were monitored in a series of lakes forming a matrix of 4 natural lakes and 3 lake reservoirs, with or without the introduced new fish food organism, Mysis relicta. The reservoirs were found to act as sinks for radiocesium with extensive accumulation recorded in water, detritus, sediment, invertebrates and salmonids. Whereas concentrations in water and biota have declined from the extreme peak levels in 1986-1987, the levels in surface sediment increased extensively until fall of 1988. The concentration of Cs-137 in fish populations feeding on benthic invertebrates, i.e. mysids and amphipods, were significantly higher than in planktivorous fish. During the three first winters a significant increase in levels of Cs-137 in winter active Arctic char were recorded, whereas the levels declined during the succeeding summers. The introduced Mysis relicta were found to enhance the transport of Cs-137 from zooplankton and settling particles to Arctic char and brown trout. The results suggest a successive change in transport of radiocesium from water via zooplankton to planktivorous fish during the early summer of 1986 to post-depositional mobilization via benthic organisms to benthic fish in successive years. (213 refs.) (au)

  2. Adsorption of copper onto char derived macro alga, Undaria pinnatifida

    International Nuclear Information System (INIS)

    Cho, Hye Jung; Ko, Jeong Huy; Heo, Hyeon Su; Park, Hye Jin; BAe, Yoon Ju; Kim, Jung Hwan; Park, Young-Kwon

    2010-01-01

    Full text: A release of heavy metals into the environment by industrial activities raises much environmental problems because they tend to remain indefinitely, circulating and eventually accumulating throughout the food chain. Copper is essential to human life and health but, like all heavy metals, is potentially toxic as well. The excessive intakes of copper result in its accumulation in the liver and produce gastrointestinal problems, kidney damage, anemia, and continued inhalation of copper-containing sprays is linked with an increase in lung cancer among exposed people. Consequently, we need to eliminate the copper in drinking water. Also, growth rates of marine macro algae far exceed those of terrestrial biomass, without water limitations, so annual primary production rates are higher for the major marine macro algae than for most terrestrial biomass. According to these reasons, we try to use the macro alga, Undaria pinnatifida. Adsorption of heavy metals is one of the possible technologies involved in the removal of toxic metals from industrial waste streams and mining waste water using low-cost adsorbents. In recent years, many low-cost adsorbents such as seaweeds, activated carbon, etc. have been investigated, but the char by macro alga, Undaria pinnatifida, have not proven to be the most effective and promising substrates. The aim of this study is to remove copper from its aqueous solution by Undaria pinnatifida char for various parameters like pH, contact time, and Cu(II) concentration. The adsorption capacity of Cu(II) by Undaria pinnatifida char was investigated as a function of pH, contact time, and Cu(II) concentration at room temperature. And it was verified using equilibrium studies. (author)

  3. Particle behavior and char burnout mechanisms under pressurized combustion conditions

    Energy Technology Data Exchange (ETDEWEB)

    Bauer, C.M.; Spliethoff, H.; Hein, K.R.G.

    1999-07-01

    Combined cycle systems with coal-fired gas turbines promise highest cycle efficiencies for this fuel. Pressurized pulverized coal combustion, in particular, yields high cycle efficiencies due to the high flue gas temperatures possible. The main problem, however, is to ensure a flue gas clean enough to meet the high gas turbine standards with a dirty fuel like coal. On the one hand, a profound knowledge of the basic chemical and physical processes during fuel conversion under elevated pressures is required whereas on the other hand suitable hot gas cleaning systems need to be developed. The objective of this work was to provide experimental data to enable a detailed description of pressurized coal combustion processes. A series of experiments were performed with two German hvb coals, Ensdorf and Goettelborn, and one German brown coal, Garzweiler, using a semi-technical scale pressurized entrained flow reactor. The parameters varied in the experiments were pressure, gas temperature and bulk gas oxygen concentration. A two-color pyrometer was used for in-situ determination of particle surface temperatures and particle sizes. Flue gas composition was measured and solid residue samples taken and subsequently analyzed. The char burnout reaction rates were determinated varying the parameters pressure, gas temperature and initial oxygen concentration. Variation of residence time was achieved by taking the samples at different points along the reaction zone. The most influential parameters on char burnout reaction rates were found to be oxygen partial pressure and fuel volatile content. With increasing pressure the burn-out reactions are accelerated and are mostly controlled by product desorption and pore diffusion being the limiting processes. The char burnout process is enhanced by a higher fuel volatile content.

  4. Structural, optical and electrical properties of chemically deposited ...

    Indian Academy of Sciences (India)

    Structural, optical and electrical properties of chemically deposited nonstoichiometric copper ... One of these compounds, CuInSe2, with its optical absorption .... is clear from SEM images that the number of grains goes on increasing with the ...

  5. Structural properties of carbon nanotubes derived from 13C NMR

    KAUST Repository

    Abou-Hamad, E.; Babaa, M.-R.; Bouhrara, M.; Kim, Y.; Saih, Y.; Dennler, S.; Mauri, F.; Basset, Jean-Marie; Goze-Bac, C.; Wå gberg, T.

    2011-01-01

    We present a detailed experimental and theoretical study on how structural properties of carbon nanotubes can be derived from 13C NMR investigations. Magic angle spinning solid state NMR experiments have been performed on single- and multiwalled

  6. Thermodynamical properties and thermoelastic coupling of complex macroscopic structure

    International Nuclear Information System (INIS)

    Fabbri, M.; Sacripanti, A.

    1996-11-01

    Gross qualitative/quantitative analysis about thermodynamical properties and thermoelastic coupling (or elastocaloric effect) of complex macroscopic structure (running shoes) is performed by infrared camera. The experimental results showed the achievability of a n industrial research project

  7. Detonation-synthesis nanodiamonds: synthesis, structure, properties and applications

    Energy Technology Data Exchange (ETDEWEB)

    Dolmatov, Valerii Yu [Federal State Unitary Enterprise Special Design-Technology Bureau (FSUE SDTB) ' ' Tekhnolog' ' at the St Petersburg State Institute of Technology (Technical University) (Russian Federation)

    2007-04-30

    The review outlines the theoretical foundations and industrial implementations of modern detonation synthesis of nanodiamonds and chemical purification of the nanodiamonds thus obtained. The structure, key properties and promising fields of application of detonation-synthesis nanodiamonds are considered.

  8. Detonation-synthesis nanodiamonds: synthesis, structure, properties and applications

    International Nuclear Information System (INIS)

    Dolmatov, Valerii Yu

    2007-01-01

    The review outlines the theoretical foundations and industrial implementations of modern detonation synthesis of nanodiamonds and chemical purification of the nanodiamonds thus obtained. The structure, key properties and promising fields of application of detonation-synthesis nanodiamonds are considered.

  9. Manganites in Perovskite Superlattices: Structural and Electronic Properties

    KAUST Repository

    Jiwuer, Jilili

    2016-01-01

    Perovskite manganites are widely investigated compounds due to the discovery of the colossal magnetoresistance effect in 1994. They have a broad range of structural, electronic, magnetic properties and potential device applications in sensors

  10. Unveiling DNA structural properties of promoter regions of ...

    Indian Academy of Sciences (India)

    Aditya Kumar

    Unveiling DNA structural properties of promoter regions of prokaryotic transcriptome and their role in gene expression. Aditya Kumar. Assistant Professor. Molecular Biology & Biotechnology. Tezpur University. Tezpur – 784028, Assam ...

  11. Structure, health benefits, antioxidant property and processing and ...

    African Journals Online (AJOL)

    Structure, health benefits, antioxidant property and processing and storage of carotenoids. ... It is sensitive to heat, light and oxygen. Enzymatic ... Thermal treatment and freezing increases the extractability of b-carotene from the food matrices.

  12. Effect of spin polarization on the structural properties and bond ...

    Indian Academy of Sciences (India)

    ties such as structural, hardness, Young modulus and frac- ture toughness ... measurements showed that hardness ranged between 14.5 and 19GPa ... the relative binding forces, is a useful fundamental property. ..... strength [36,39]. Zhang et ...

  13. Ground state structures and properties of small hydrogenated silicon

    Indian Academy of Sciences (India)

    Unknown

    To understand the structural evolutions and properties of silicon cluster due to hydrogenation ... partly due to the growing importance of these systems in applications like .... of the system. Using the Lagrangian (1), equations of motions for the.

  14. Organogels thermodynamics, structure, solvent role, and properties

    CERN Document Server

    Guenet, Jean-Michel

    2016-01-01

    This book provides a physics-oriented introduction to organogels with a comparison to polymer thermoreversible gels whenever relevant. The past decade has seen the development of a wide variety of newly-synthesized molecules that can spontaneously self-assemble or crystallize from their organic or aqueous solutions to produce fibrillar networks, namely organogels, with potential applications in organic electronics, light harvesting, bio-imaging, non-linear optics, and the like. This compact volume presents a detailed outlook of these novel molecular systems with special emphasis upon their thermodynamics, morphology, molecular structure, and rheology. The definition of these complex systems is also tackled, as well as the role of the solvent. The text features numerous temperature-phase diagrams for a variety of organogels as well as illustrations of their structures at the microscopic, mesoscopic and macroscopic level. A review of some potential applications is provided including hybrid functional materials ...

  15. Structure-Property Relationships in Polycyanurate / Graphene Networks

    Science.gov (United States)

    2015-12-12

    Briefing Charts 3. DATES COVERED (From - To) 17 Nov 2015 – 12 Dec 2015 4. TITLE AND SUBTITLE Structure-Property Relationships in Polycyanurate...ANSI Std. 239.18 1 DISTRIBUTION STATEMENT A. Approved for public release; distribution is unlimited. Structure-Property Relationships in...the attractive processing characteristics of LECy are retained in graphene oxide / LECy mixtures. Impurities, such as aryl phenols and transition metals

  16. Mechanical properties along interfaces of bonded structures in fusion reactors

    International Nuclear Information System (INIS)

    Hassan, M.H.; Kulcinski, G.L.

    1993-01-01

    Proper assessment of the mechanical properties along interfaces of bonded structures currently used in many fusion reactor designs is essential to compare the different fabrication techniques. A Mechanical Properties Microprobe (MPM) was used to measure hardness and Young's modules along the interfaces of Be/Cu bonded structure. The MPM was able to distinguish different fabrication techniques by a direct measurement of the hardness, Young's modules, and H/E 2 which reflects the ability of deformation of the interfacial region

  17. High-performance ceramics. Fabrication, structure, properties

    International Nuclear Information System (INIS)

    Petzow, G.; Tobolski, J.; Telle, R.

    1996-01-01

    The program ''Ceramic High-performance Materials'' pursued the objective to understand the chaining of cause and effect in the development of high-performance ceramics. This chain of problems begins with the chemical reactions for the production of powders, comprises the characterization, processing, shaping and compacting of powders, structural optimization, heat treatment, production and finishing, and leads to issues of materials testing and of a design appropriate to the material. The program ''Ceramic High-performance Materials'' has resulted in contributions to the understanding of fundamental interrelationships in terms of materials science, which are summarized in the present volume - broken down into eight special aspects. (orig./RHM)

  18. Preparation of porous bio-char and activated carbon from rice husk by leaching ash and chemical activation.

    Science.gov (United States)

    Ahiduzzaman, Md; Sadrul Islam, A K M

    2016-01-01

    Preparation porous bio-char and activated carbon from rice husk char study has been conducted in this study. Rice husk char contains high amount silica that retards the porousness of bio-char. Porousness of rice husk char could be enhanced by removing the silica from char and applying heat at high temperature. Furthermore, the char is activated by using chemical activation under high temperature. In this study no inert media is used. The study is conducted at low oxygen environment by applying biomass for consuming oxygen inside reactor and double crucible method (one crucible inside another) is applied to prevent intrusion of oxygen into the char. The study results shows that porous carbon is prepared successfully without using any inert media. The adsorption capacity of material increased due to removal of silica and due to the activation with zinc chloride compared to using raw rice husk char. The surface area of porous carbon and activated carbon are found to be 28, 331 and 645 m(2) g(-1) for raw rice husk char, silica removed rice husk char and zinc chloride activated rice husk char, respectively. It is concluded from this study that porous bio-char and activated carbon could be prepared in normal environmental conditions instead of inert media. This study shows a method and possibility of activated carbon from agro-waste, and it could be scaled up for commercial production.

  19. Determining the Mechanical Properties of Lattice Block Structures

    Science.gov (United States)

    Wilmoth, Nathan

    2013-01-01

    Lattice block structures and shape memory alloys possess several traits ideal for solving intriguing new engineering problems in industries such as aerospace, military, and transportation. Recent testing at the NASA Glenn Research Center has investigated the material properties of lattice block structures cast from a conventional aerospace titanium alloy as well as lattice block structures cast from nickel-titanium shape memory alloy. The lattice block structures for both materials were sectioned into smaller subelements for tension and compression testing. The results from the cast conventional titanium material showed that the expected mechanical properties were maintained. The shape memory alloy material was found to be extremely brittle from the casting process and only compression testing was completed. Future shape memory alloy lattice block structures will utilize an adjusted material composition that will provide a better quality casting. The testing effort resulted in baseline mechanical property data from the conventional titanium material for comparison to shape memory alloy materials once suitable castings are available.

  20. Using nonlinearity and spatiotemporal property modulation to control effective structural properties: dynamic rods

    DEFF Research Database (Denmark)

    Thomsen, Jon Juel; Blekhman, Iliya I.

    2007-01-01

    What are the effective properties of a generally nonlinear material or structure, whose local properties are modulated in both space and time? It has been suggested to use spatiotemporal modulation of structural properties to create materials and structures with adjustable effective properties......, and to call these dynamic materials or spatiotemporal composites. Also, according to theoretical predictions, structural nonlinearity enhances the possibilities of achieving specific effective properties. For example, with an elastic rod having cubical elastic nonlinearities, it seems possible to control......, and exemplified. Then simple approximate analytical expressions are derived for the effective wave speed and natural frequencies for one-dimensional wave propagation in a nonlinear elastic rod, where the spatiotemporal modulation is imposed as a high-frequency standing wave, supposed to be given. Finally the more...

  1. Structure and electronic properties of azadirachtin.

    Science.gov (United States)

    de Castro, Elton A S; de Oliveira, Daniel A B; Farias, Sergio A S; Gargano, Ricardo; Martins, João B L

    2014-02-01

    We performed a combined DFT and Monte Carlo (13)C NMR chemical-shift study of azadirachtin A, a triterpenoid that acts as a natural insect antifeedant. A conformational search using a Monte Carlo technique based on the RM1 semiempirical method was carried out in order to establish its preferred structure. The B3LYP/6-311++G(d,p), wB97XD/6-311++G(d,p), M06/6-311++G(d,p), M06-2X/6-311++G(d,p), and CAM-B3LYP/6-311++G(d,p) levels of theory were used to predict NMR chemical shifts. A Monte Carlo population-weighted average spectrum was produced based on the predicted Boltzmann contributions. In general, good agreement between experimental and theoretical data was obtained using both methods, and the (13)C NMR chemical shifts were predicted highly accurately. The geometry was optimized at the semiempirical level and used to calculate the NMR chemical shifts at the DFT level, and these shifts showed only minor deviations from those obtained following structural optimization at the DFT level, and incurred a much lower computational cost. The theoretical ultraviolet spectrum showed a maximum absorption peak that was mainly contributed by the tiglate group.

  2. Optical properties of arbuscular mycorrhizal fungal structures

    International Nuclear Information System (INIS)

    Perez, Adverdi; V-Hernandez, Alejandra; Rudamas, Carlos; Dreyer, Beatriz

    2008-01-01

    It was already reported by B. Dreyer at al. [1] that all fungal structures, both intra- and extra-radical fluoresced under blue light excitation regardless of their state (dead or alive). The source of the so called autofluorescence appears to be localized in the fungal cell wall. This supports the use of photoluminescence for the evaluation of AM colonization. However, the interpretation of these results is still in discussion [1-4]. In this work, arbuscular mycorrhizal spores were isolated from the rhizosphere of mango (Mangifera indica L.) plants by the method of wet sieving and decanting of Gerdemann and Nicolson [5] and studied by photoluminescence spectroscopy. Our experimental setup consists of an epifluorescence microscope (EM) coupled to a CCD-spectrometer through an arrangement of a home-made-telescope + fiber optic. This experimental setup allows the capture of images of the mycorrhizal structures (as usual in a standard epifluorescence microscope) combined with measurements of their corresponding emission bands. The preliminary results based on images obtained by standard EM do not clearly show that the emission is originated in the fungal cell walls as reported in Ref. 1. On the other hand, a very broad emission band in the visible part of the electromagnetic spectrum was observed in these spores by exciting at 450-490 nm and 300- 380 nm. We obtain a Full Width at Half Maximum (FWHM) of around 200 nm for this emission band whichis centered at 515 nm. This broad band seems to be composed of two narrower bands peaked around 494 and 547 nm and with FWHM of 50 nm and 150 nm, respectively. The profile of the observed emission band is in good agreement with the bands reported in Ref. 1 for vesicles, arbuscules and spores measured using the λ-Scan of a confocal laser scanning microscope. However, our results for spores show that the maxima of the narrower bands are shifted to higher energies in comparison to the corresponding bands observed in Ref. 1

  3. Optical properties of semiconductors quantum microcavity structures

    International Nuclear Information System (INIS)

    Afshar, A.M.

    1996-12-01

    The principal phenomenon investigated in this thesis is vacuum Rabi coupling in semiconductor microcavity structures. In these structures quantum well excitons are embedded in a Fabry - Perot like cavity, defined by two semiconductor dielectric mirrors. In such a system the coupled exciton and cavity photon mode form a mixed - mode polariton, where on - resonance there are two branches, each having 50% exciton and 50% photon character. The separation between the upper and lower branches is a measure of the coupling strength where the strength is dependent on the exciton oscillator strength. This interaction is known as vacuum Rabi coupling, and clear anticrossing is seen when the exciton is tuned through the cavity. In our reflectivity experiments we demonstrate control of the coupling between the cavity mode and the exciton by varying temperature, applied electric or magnetic field. Modelling of the reflectivity spectra and the tuning was done using a Transfer Matrix Reflectivity (TMR) model or a linear dispersion model, where in both cases the excitons are treated as Lorentz oscillators. Temperature tuning is achieved because exciton energy decreases with temperature at a much faster rate than the cavity mode. We have demonstrated vacuum Rabi coupling of the cavity mode with both the heavy - hole and light - hole excitons. Electric field tuning is achieved via the quantum confined Stark effect which decreases the exciton energy with increasing field, whilst at the same time the cavity mode energy remains constant. A study of how the electric field reduction of exciton oscillator strength reduces the vacuum Rabi coupling strength is performed. We report the first observation in a semiconductor structure of motional narrowing, seen in both electric field and in temperature tuning experiments at high magnetic field. In magnetic field studies we show how magnetic field induced increase in exciton oscillator strength affects the vacuum Rabi coupling. We also show by

  4. Structural phase transition and elastic properties of samarium monopnictides

    International Nuclear Information System (INIS)

    Pagare, Gitanjali; Chouhan, Sunil Singh; Soni, Pooja; Sanyal, Sankar P.

    2011-01-01

    In recent years the monopnictides and monochalcogenides of the rare-earth elements with rocksalt structure (B 1 ) have aroused intensive interest due to the presence of strongly correlated f electrons in them. Under pressure, the nature of f-electrons of these compounds can be changed from localized to itinerant leading to significant changes in physical and chemical properties. These unusual structural, electronic, and high-pressure properties make them candidates for advanced industrial applications. For these applications they provide unique physical properties which cannot be achieved with other materials

  5. Composition-Structure-Property Relationships in Boroaluminosilicate Glasses

    DEFF Research Database (Denmark)

    Zheng, Qiuju; Potuzak, M.; Mauro, J.C.

    2012-01-01

    boroaluminosilicate glasses from peralkaline to peraluminous compositions by substituting Al2O3 for SiO2. Our results reveal a pronounced change in all the measured physical properties (density, elastic moduli, hardness, glass transition temperature, and liquid fragility) around [Al2O3]–[Na2O]=0. The structural......The complicated structural speciation in boroaluminosilicate glasses leads to a mixed network former effect yielding nonlinear variation in many macroscopic properties as a function of chemical composition. Here we study the composition–structure–property relationships in a series of sodium...

  6. Structured epitaxial graphene: growth and properties

    International Nuclear Information System (INIS)

    Hu Yike; Ruan Ming; Guo Zelei; Dong Rui; Palmer, James; Hankinson, John; Berger, Claire; Heer, Walt A de

    2012-01-01

    Graphene is generally considered to be a strong candidate to succeed silicon as an electronic material. However, to date, it actually has not yet demonstrated capabilities that exceed standard semiconducting materials. Currently demonstrated viable graphene devices are essentially limited to micrometre-sized ultrahigh-frequency analogue field effect transistors and quantum Hall effect devices for metrology. Nanoscopically patterned graphene tends to have disordered edges that severely reduce mobilities thereby obviating its advantage over other materials. Here we show that graphene grown on structured silicon carbide surfaces overcomes the edge roughness and promises to provide an inroad into nanoscale patterning of graphene. We show that high-quality ribbons and rings can be made using this technique. We also report on the progress towards high-mobility graphene monolayers on silicon carbide for device applications. (paper)

  7. Effects of Structural Correlations on Electronic Properties

    International Nuclear Information System (INIS)

    Pastawski, H.M.; Weisz, J.F.

    1984-01-01

    A one dimensional alloy model is treated in the nearest neighbour tight binding approximation in which the correlation of the atoms can be adjusted. The correlation can be changed from a situation in which there is a tendency for atoms to alternate to a situation in which the atoms are randomly located, consistent with a fixed concentration c for A c B 1-c . The results show that when there is short range order, at certain energies there is a tendency for localized states and formation of structure induced minimum in the density of states. The results for the ordered case are similar to those of Charge Density Wave (CDW). A smooth transition is carried out between this case and the randomly disordered case which behaves like the Anderson model for uncorrelated disorder. (M.W.O.) [pt

  8. Structures and properties of anionic clay minerals

    International Nuclear Information System (INIS)

    Koch, Chr. Bender

    1998-01-01

    The Moessbauer spectra of pyroaurite-sjoegrenite-type compounds (PTC) (layered anion exchangers) are discussed with reference to the crystal structure, cation order, and crystallite morphology. It is shown that cation-ordered layers are produced in the synthesis of carbonate and sulphate types of green rust. In contrast, synthetic and natural pyroaurite only occurs as disordered types. The redox chemistry of Fe(III) within the metal hydroxide layer is illustrated with examples of electrochemical oxidation and reversible reduction by boiling glycerol. The chemistry of iron in the interlayer is exemplified by the intercalation of Fe-cyanide complexes in hydrotalcite. This reaction may be used as a probe for the charge distribution in the interlayer

  9. Efficient Air Desulfurization Catalysts Derived from Pig Manure Liquefaction Char

    Directory of Open Access Journals (Sweden)

    Rajiv Wallace

    2017-11-01

    Full Text Available Biochar from the liquefaction of pig manure was used as a precursor of H2S desulfurization adsorbents. In its inorganic matter, it contains marked quantities of calcium, magnesium and iron, which are known as hydrogen sulfide oxidation catalysts. The char was used either as-received or mixed with 10% nanographite. The latter was added to increase both the content of the carbon phase and conductivity. ZnCl2 in two different ratios of char to an activation agent (1:1 and 1:2 was used to create the porosity in the carbon phase. The content of the later was between 18–45%. The activated samples adsorbed 144 mg/g H2S. Sulfur was the predominant product of reactive adsorption. Its deposition in the pore system and blockage of the most active pores ceased the materials’ activity. The presence of the catalytic phase was necessary but not sufficient to guarantee good performance. The developed porosity, which can store oxidation products in the resulting composite, is essential for the good performance of the desulfurization process. The surface of the composite with nanographite showed the highest catalytic activity, similar to that of the commercial Midas® carbon catalyst. The results obtained indicate that a high quality reactive adsorbent/catalyst for H2S removal can be obtained from pig manure liquefaction wastes.

  10. Mechanical Properties for Reliability Analysis of Structures in Glassy Carbon

    CERN Document Server

    Garion, Cédric

    2014-01-01

    Despite its good physical properties, the glassy carbon material is not widely used, especially for structural applications. Nevertheless, its transparency to particles and temperature resistance are interesting properties for the applications to vacuum chambers and components in high energy physics. For example, it has been proposed for fast shutter valve in particle accelerator [1] [2]. The mechanical properties have to be carefully determined to assess the reliability of structures in such a material. In this paper, mechanical tests have been carried out to determine the elastic parameters, the strength and toughness on commercial grades. A statistical approach, based on the Weibull’s distribution, is used to characterize the material both in tension and compression. The results are compared to the literature and the difference of properties for these two loading cases is shown. Based on a Finite Element analysis, a statistical approach is applied to define the reliability of a structural component in gl...

  11. Comparative study of the physiochemical and structural properties of ...

    African Journals Online (AJOL)

    A comparative analysis of some physiochemical and structural parameters of brown (mature) and green (immature) coconut fibre as adsorbents was studied. The physiochemical and structural properties evaluated were surface area, moisture content, pH, bulk density, pore volume, porosity, ash content, tortuocity and metal ...

  12. Effect of annealing time on structural and magnetic properties of ...

    Indian Academy of Sciences (India)

    We studied the effects on the structural and magnetic properties of Fe3O4 thin films. The films have been characterized by X-ray diffraction (XRD), scanning electron microscopy (SEM) and vibrating sample magnetometry (VSM). XRD studies showed pure single phase spinel cubic structure of Fe3O4 with a preferential [111] ...

  13. Structure, composition and mechanical properties of the silk fibres of ...

    Indian Academy of Sciences (India)

    The silk egg case and orb web of spiders are elaborate structures that are assembled from a number of components. We analysed the structure, the amino acid and fibre compositions, and the tensile properties of the silk fibres of the egg case of Nephila clavata. SEM shows that the outer and inner covers of the egg case ...

  14. Thermodynamic and structural properties in complexing media

    International Nuclear Information System (INIS)

    Di Giandomenico, M.V.

    2007-10-01

    Protactinium is experiencing a renewal of interest in the frame of long-term energy production. Modelling the behaviour of this element in the geosphere requires thermodynamic and structural data relevant to environmental conditions. Now deep clayey formation are considered for the disposal of radioactive waste and high values of natural sulphate contents have been determined in pore water in equilibrium with clay surface. Because of its tendency to polymerisation, hydrolysis and sorption on all solid supports, the equilibria constants relative to monomer species were determined at tracer scale (ca. 10 - 12 M) with 233 Pa. The complexation constants of Pa(V) and sulphate ions were calculated starting from a systematic study of the apparent distribution coefficient D in the system TTA/Toluene/H 2 O/Na 2 SO 4 /HClO 4 /NaClO 4 and as a function of ionic strength, temperature, free sulphate, protons and chelatant concentration. First of all, the interaction between free species H + , SO 4 - , Na + leads to the formation of HSO 4 - and NaSO 4 - , for which concentrations depend upon the related thermodynamic constants. For this purpose a computer code was developed in order to determine all free species concentration. This iterative code takes into account the influence of temperature and ionic strength (SIT modelling) on thermodynamic constants. The direct measure of Pa(V) in the organic and aqueous phase by g-spectrometry had conducted to estimate the apparent distribution coefficient D as function of free sulphate ions. Complexation constants have been determined after a mathematical treatment of D. The extrapolation of these constants at zero ionic strength have been realized by SIT modelling at different temperatures. Besides, enthalpy and entropy values were calculated. Parallelly, the structural study of Pa(V) was performed using 231 Pa. XANES and EXAFS spectra show unambiguously the absence of the trans di-oxo bond that characterizes the other early actinide

  15. Bio-char derived from sewage sludge by liquefaction: Characterization and application for dye adsorption

    Energy Technology Data Exchange (ETDEWEB)

    Leng, Lijian [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environment Biology and Pollution Control, Hunan University, Ministry of Education, Changsha 410082 (China); Yuan, Xingzhong, E-mail: yxz@hnu.edu.cn [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environment Biology and Pollution Control, Hunan University, Ministry of Education, Changsha 410082 (China); Huang, Huajun [School of Land Resources and Environment, Jiangxi Agricultural University, Nanchang 330045 (China); Shao, Jianguang; Wang, Hou [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environment Biology and Pollution Control, Hunan University, Ministry of Education, Changsha 410082 (China); Chen, Xiaohong [School of Business, Central South University, Changsha 410083 (China); Zeng, Guangming [College of Environmental Science and Engineering, Hunan University, Changsha 410082 (China); Key Laboratory of Environment Biology and Pollution Control, Hunan University, Ministry of Education, Changsha 410082 (China)

    2015-08-15

    Graphical abstract: - Highlights: • SS liquefaction bio-chars were effective on MG and MB removal from aqueous. • MG adsorption capacity depended strongly on carboxylic and phenolic groups. • Metal release accounted for nearly 30% of the total MG adsorbed on bio-chars. • Acetone and low temperature favor effective adsorbent production by liquefaction. - Abstract: Bio-chars produced by liquefaction of sewage sludge with methanol, ethanol, or acetone as the solvent at 260–380 °C were characterized in terms of their elemental composition, thermogravimetric characteristics, surface area and pore size distribution, and oxygen-containing functional groups composition. The surface area and total volume of the bio-chars were low, but the contents of oxygen-containing functional groups were high. The bio-chars were effective on Malachite green (MG) and Methylene blue (MB) removal from aqueous solution. The MG adsorption equilibrium data showed excellent fit to the Langmuir model and the kinetic data fitted well to the Pseudo-second-order model. Thermodynamic investigations indicated that MG adsorption on bio-char was spontaneous and endothermic. The MG adsorption mechanism appears to be associated with cation release and functional group participation. Additionally, liquefaction of SS with acetone as the solvent at low temperature (280 °C) would favor the production of bio-char adsorbent in terms of bio-char yield and MG and MB adsorption capacity.

  16. Electron paramagnetic resonance and dynamic nuclear polarization of char suspensions: surface science and oximetry

    DEFF Research Database (Denmark)

    Clarkson, R B; Odintsov, B M; Ceroke, P J

    1998-01-01

    ; they can be calibrated and used for oximetry. Biological stability and low toxicity make chars good sensors for in vivo measurements. Scalar and dipolar interactions of water protons at the surfaces of chars may be utilized to produce dynamic nuclear polarization (DNP) of the nuclear spin population...

  17. Influence of coal rank and pyrolysis/hydropyrolysis temperature on nitrogen oxide emission during coal char combustion

    Energy Technology Data Exchange (ETDEWEB)

    Stanczyk, K.; Miga, K. [Polish Academy of Sciences, Gliwice (Poland). Institute of Coal Chemistry

    1999-07-01

    The formation of NO during the combustion of chars was investigated. The formation of NO was correlated with carbon oxides emission. The way in which the reactivity of chars influences NO emission was investigated. 6 refs., 2 figs., 2 tabs.

  18. The structural heterogeneity and optical properties in chalcogenide glass films

    International Nuclear Information System (INIS)

    Shurgalin, Max; Fuflyigin, Vladimir N; Anderson, Emilia G

    2005-01-01

    The microscopic structure and optical properties of glassy films prepared by vapour phase deposition process from the germanium-arsenic-selenium family of chalcogenide glasses have been studied. A number of different molecular clusters or domains that can exist in the glass structure are found to play a significant role in determining the absorption characteristics and refractive index of the glass films. Modifications of the glass structure can be described by a variation of relative concentrations of the clusters and can be effected by modifications of film chemical composition and deposition conditions. Changes in absorption spectra are directly correlated with variation in relative concentrations of the structural fragments with different electronic bandgap properties. Experimental results suggest structural heterogeneity and support validity of the cluster structural model for the chalcogenide glasses

  19. The Effect of Bedding Structure on Mechanical Property of Coal

    Directory of Open Access Journals (Sweden)

    Zetian Zhang

    2014-01-01

    Full Text Available The mechanical property of coal, influencing mining activity considerably, is significantly determined by the natural fracture distributed within coal mass. In order to study the effecting mechanism of bedding structure on mechanical property of coal, a series of uniaxial compression tests and mesoscopic tests have been conducted. The experimental results show that the distribution characteristic of calcite particles, which significantly influences the growth of cracks and the macroscopic mechanical properties of coal, is obviously affected by the bedding structure. Specifically, the uniaxial compression strength of coal sample is mainly controlled by bedding structure, and the average peak stress of specimens with axes perpendicular to the bedding planes is 20.00 MPa, which is 2.88 times the average amount of parallel ones. The test results also show a close relationship between the bedding structure and the whole deformation process under uniaxial loading.

  20. Structure and transport properties of nanostructured materials.

    Science.gov (United States)

    Sonwane, C G; Li, Q

    2005-03-31

    In the present manuscript, we have presented the simulation of nanoporous aluminum oxide using a molecular-dynamics approach with recently developed dynamic charge transfer potential using serial/parallel programming techniques (Streitz and Mintmire Phys. Rev. B 1994, 50, 11996). The structures resembling recently invented ordered nanoporous crystalline material, MCM-41/SBA-15 (Kresge et al. Nature 1992, 359, 710), and inverted porous solids (hollow nanospheres) with up to 10 000 atoms were fabricated and studied in the present work. These materials have been used for separation of gases and catalysis. On several occasions including the design of the reactor, the knowledge of surface diffusion is necessary. In the present work, a new method for estimating surface transport of gases based on a hybrid Monte Carlo method with unbiased random walk of tracer atom on the pore surface has been introduced. The nonoverlapping packings used in the present work were fabricated using an algorithm of very slowly settling rigid spheres from a dilute suspension into a randomly packed bed. The algorithm was modified to obtain unimodal, homogeneous Gaussian and segregated bimodal porous solids. The porosity of these solids was varied by densification using an arbitrary function or by coarsening from a highly densified pellet. The surface tortuosity for the densified solids indicated an inverted bell shape curve consistent with the fact that at very high porosities there is a reduction in the connectivity while at low porosities the pores become inaccessible or dead-end. The first passage time distribution approach was found to be more efficient in terms of computation time (fewer tracer atoms needed for the linearity of Einstein's plot). Results by hybrid discrete-continuum simulations were close to the discrete simulations for a boundary layer thickness of 5lambda.

  1. Properties of sorbents from brown coal

    Energy Technology Data Exchange (ETDEWEB)

    Straka, P.; Buchtele, J. [Academy of Sciences of the Czech Republic, Prague (Czech Republic)

    2000-07-01

    The surface and sorptional properties of carbonaceous materials prepared from brown coal and their relation to minerals content and coal bulk density as technologically important parameters of starting coal were described. Chars were prepared from brown coal of North Bohemian Brown Coal District and activated with CO{sub 2} in a large-scale laboratory unit. Their surface and sorptive properties were investigated. It was found that mineral matter/ash content favourably affects the mesoporosity development in chars/activated chars as the sorption capacity increased with increasing ash content in chars. No influence of ash content on the macroporosity was observed. With the activated chars, both the inner surface and sorption capacity showed the maximum in the burn-off range of 41-64%. Optimization of the process is discussed.

  2. Transport properties of electrons in fractal magnetic-barrier structures

    Science.gov (United States)

    Sun, Lifeng; Fang, Chao; Guo, Yong

    2010-09-01

    Quantum transport properties in fractal magnetically modulated structures are studied by the transfer-matrix method. It is found that the transmission spectra depend sensitively not only on the incident energy and the direction of the wave vector but also on the stage of the fractal structures. Resonance splitting, enhancement, and position shift of the resonance peaks under different magnetic modulation are observed at four different fractal stages, and the relationship between the conductance in the fractal structure and magnetic modulation is also revealed. The results indicate the spectra of the transmission can be considered as fingerprints for the fractal structures, which show the subtle correspondence between magnetic structures and transport behaviors.

  3. Report on results of research. Basic studies on characteristics of coal char gasification under pressure; Sekitan char no kaatsuka ni okeru gas ka tokuseino kiso kenkyu seika hokokusho

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    1981-03-01

    This paper explains basic studies on characteristics of coal char gasification under pressure. Hydro-gasification of coal needs as a gasifying agent a large amount of hydrogen, which is effectively produced by the water gasification of exhaust unreacted residual char. In fiscal 1975, gasification was tested on Taiheiyo coal carbonized char by an atmospheric fluidized gasifier of 28 mm bore. In fiscal 1976, experiment was conducted under pressure by fully improving the auxiliary safety equipment. The char and gas yield increased with higher pressure in pressurized carbonization by an autoclave. In fiscal 1977, clinker was successfully prevented by using quartz sand for a fluidized medium. In fiscal 1978, two-stage continuous gasification was examined. In fiscal 1979, correlation was determined between operation factors such as gasification pressure, temperature, etc., and clinker formation/char reactivity. An experiment was conducted for particle pop-out using a pressurized fluidized bed of 100 mm inner diameter, with the pop-out quantity found to be proportional to the 0.38th power of a pressure. A high pressure fluidized gasifier was built having a char processing capacity of 1 t/day, 20 atmospheric pressure, and an inner diameter of 100 mm. In fiscal 1980, this device was continuously operated, elucidating problems for the practicability. (NEDO)

  4. Kinetics of coal combustion: Part 3, Mechanisms and kinetics of char combustion

    Energy Technology Data Exchange (ETDEWEB)

    Gavalas, G. R.; Flagan, R. C. [California Inst. of Tech., Pasadena, CA (USA)

    1988-09-01

    This report summarizes a three-year research program aimed at developing this level of understanding of char combustion through a combination of detailed analysis of chars as produced during devolatilization and as they evolve during oxidation, and theoretical studies of the porous microstructures and of pore diffusion and reaction within the coal particles. A small number of coals have been studied in detail, namely a HVA bituminous (PSOC 1451), a sub-bituminous (PSOC 1488), and a lignite (PSOC 1443). Chars have been generated from size-classified samples of these coals by pyrolysis in an inert atmosphere in a drop tube furnace. The chars were then characterized both chemically and physically. Subsequent oxidation studies were performed on these chars. 42 refs., 54 figs., 4 tabs.

  5. Electron paramagnetic resonance and dynamic nuclear polarization of char suspensions: surface science and oximetry

    International Nuclear Information System (INIS)

    Clarkson, R.B.; Odintsov, B.M.; Ceroke, P.J.; Ardenkjaer-Larsen, J.H.; Fruianu, M.; Belford, R.L.

    1998-01-01

    Carbon chars have been synthesized in our laboratory from a variety of starting materials, by means of a highly controlled pyrolysis technique. These chars exhibit electron paramagnetic resonance (EPR) line shapes which change with the local oxygen concentration in a reproducible and stable fashion; they can be calibrated and used for oximetry. Biological stability and low toxicity make chars good sensors for in vivo measurements. Scalar and dipolar interactions of water protons at the surfaces of chars may be utilized to produce dynamic nuclear polarization (DNP) of the 1 H nuclear spin population in conjunction with electron Zeeman pumping. Low-frequency EPR, DNP and DNP-enhanced MRI all show promise as oximetry methods when used with carbon chars. (author)

  6. Influence of pressure on pyrolysis of black liquor: 2. Char yields and component release.

    Science.gov (United States)

    Whitty, Kevin; Kullberg, Mika; Sorvari, Vesa; Backman, Rainer; Hupa, Mikko

    2008-02-01

    This is the second in a series of papers concerning the behavior of black liquor during pyrolysis at elevated pressures. Two industrial black liquors were pyrolyzed under pressurized conditions in two laboratory-scale devices, a pressurized single-particle reactor and a pressurized grid heater. Temperatures ranging between 650 and 1100 degrees C and pressures in the range 1-20 bar were studied. Char yields were calculated and based on analysis of some of the chars the fate of carbon, sodium, potassium and sulfur was determined as a function of pyrolysis pressure. At temperatures below 800 degrees C little variation in char yield was observed at different pressures. At higher temperatures char yield increased with pressure due to slower decomposition of sodium carbonate. For the same reason, sodium release decreased with pressure. Sulfur release, however, increased with pressure primarily because there was less opportunity for its capture in the less-swollen chars.

  7. Numerical calculations of effective elastic properties of two cellular structures

    International Nuclear Information System (INIS)

    Tuncer, Enis

    2005-01-01

    Young's moduli of regular two-dimensional truss-like and eye-shaped structures are simulated using the finite element method. The structures are idealizations of soft polymeric materials used in ferro-electret applications. In the simulations, the length scales of the smallest representative units are varied, which changes the dimensions of the cell walls in the structures. A power-law expression with a quadratic as the exponent term is proposed for the effective Young's moduli of the systems as a function of the solid volume fraction. The data are divided into three regions with respect to the volume fraction: low, intermediate and high. The parameters of the proposed power-law expression in each region are later represented as a function of the structural parameters, the unit-cell dimensions. The expression presented can be used to predict a structure/property relationship in materials with similar cellular structures. The contribution of the cell-wall thickness to the elastic properties becomes significant at concentrations >0.15. The cell-wall thickness is the most significant factor in predicting the effective Young's modulus of regular cellular structures at high volume fractions of solid. At lower concentrations of solid, the eye-shaped structure yields a lower Young's modulus than a truss-like structure with similar anisotropy. Comparison of the numerical results with those of experimental data for poly(propylene) show good agreement regarding the influence of cell-wall thickness on elastic properties of thin cellular films

  8. Predicting structural properties of fluids by thermodynamic extrapolation

    Science.gov (United States)

    Mahynski, Nathan A.; Jiao, Sally; Hatch, Harold W.; Blanco, Marco A.; Shen, Vincent K.

    2018-05-01

    We describe a methodology for extrapolating the structural properties of multicomponent fluids from one thermodynamic state to another. These properties generally include features of a system that may be computed from an individual configuration such as radial distribution functions, cluster size distributions, or a polymer's radius of gyration. This approach is based on the principle of using fluctuations in a system's extensive thermodynamic variables, such as energy, to construct an appropriate Taylor series expansion for these structural properties in terms of intensive conjugate variables, such as temperature. Thus, one may extrapolate these properties from one state to another when the series is truncated to some finite order. We demonstrate this extrapolation for simple and coarse-grained fluids in both the canonical and grand canonical ensembles, in terms of both temperatures and the chemical potentials of different components. The results show that this method is able to reasonably approximate structural properties of such fluids over a broad range of conditions. Consequently, this methodology may be employed to increase the computational efficiency of molecular simulations used to measure the structural properties of certain fluid systems, especially those used in high-throughput or data-driven investigations.

  9. High temperature structural and magnetic properties of cobalt nanorods

    Energy Technology Data Exchange (ETDEWEB)

    Ait Atmane, Kahina [Univ. Paris Diderot, Sorbonne Paris Cite, ITODYS, UMR CNRS 7086, 15 rue J.-A. de Baief, 75205 Paris Cedex 13 (France); Zighem, Fatih [Laboratoire Leon Brillouin, CEA CNRS UMR 12, IRAMIS, CEA-Saclay, 91191 Gif sur Yvette (France); Soumare, Yaghoub [Univ. Paris Diderot, Sorbonne Paris Cite, ITODYS, UMR CNRS 7086, 15 rue J.-A. de Baief, 75205 Paris Cedex 13 (France); Ibrahim, Mona; Boubekri, Rym [Universite de Toulouse, LPCNO, INSA CNRS UMR 5215, 135 av. de Rangueil, 31077 Toulouse Cedex 4 (France); Maurer, Thomas [Laboratoire Leon Brillouin, CEA CNRS UMR 12, IRAMIS, CEA-Saclay, 91191 Gif sur Yvette (France); Margueritat, Jeremie [Univ. Paris Diderot, Sorbonne Paris Cite, ITODYS, UMR CNRS 7086, 15 rue J.-A. de Baief, 75205 Paris Cedex 13 (France); Piquemal, Jean-Yves, E-mail: jean-yves.piquemal@univ-paris-diderot.fr [Univ. Paris Diderot, Sorbonne Paris Cite, ITODYS, UMR CNRS 7086, 15 rue J.-A. de Baief, 75205 Paris Cedex 13 (France); Ott, Frederic; Chaboussant, Gregory [Laboratoire Leon Brillouin, CEA CNRS UMR 12, IRAMIS, CEA-Saclay, 91191 Gif sur Yvette (France); Schoenstein, Frederic; Jouini, Noureddine [LSPM, CNRS UPR 9001, Universite Paris XIII, Institut Galilee, 99 av. J.-B. Clement, 93430 Villetaneuse (France); Viau, Guillaume, E-mail: gviau@insa-toulouse.fr [Universite de Toulouse, LPCNO, INSA CNRS UMR 5215, 135 av. de Rangueil, 31077 Toulouse Cedex 4 (France)

    2013-01-15

    We present in this paper the structural and magnetic properties of high aspect ratio Co nanoparticles ({approx}10) at high temperatures (up to 623 K) using in-situ X ray diffraction (XRD) and SQUID characterizations. We show that the anisotropic shapes, the structural and texture properties are preserved up to 500 K. The coercivity can be modelled by {mu}{sub 0}H{sub C}=2(K{sub MC}+K{sub shape})/M{sub S} with K{sub MC} the magnetocrystalline anisotropy constant, K{sub shape} the shape anisotropy constant and M{sub S} the saturation magnetization. H{sub C} decreases linearly when the temperature is increased due to the loss of the Co magnetocrystalline anisotropy contribution. At 500 K, 50% of the room temperature coercivity is preserved corresponding to the shape anisotropy contribution only. We show that the coercivity drop is reversible in the range 300-500 K in good agreement with the absence of particle alteration. Above 525 K, the magnetic properties are irreversibly altered either by sintering or by oxidation. - Graphical abstract: We present in this paper the structural and magnetic properties of high aspect ratio Co nanorods ({approx}10) at high temperatures (up to 623 K) using in-situ X-ray diffraction and SQUID characterizations. We show that the anisotropic shapes, the structural and texture properties are preserved up to 500 K. Above 525 K, the magnetic properties are irreversibly altered either by sintering or by oxidation. Highlights: Black-Right-Pointing-Pointer Ferromagnetic Co nanorods are prepared using the polyol process. Black-Right-Pointing-Pointer The structural and texture properties of the Co nanorods are preserved up to 500 K. Black-Right-Pointing-Pointer The magnetic properties of the Co nanorods are irreversibly altered above 525 K.

  10. Investigation on the ignition, thermal acceleration and characteristic temperatures of coal char combustion

    International Nuclear Information System (INIS)

    Zhang, Bin; Fu, Peifang; Liu, Yang; Yue, Fang; Chen, Jing; Zhou, Huaichun; Zheng, Chuguang

    2017-01-01

    Highlights: • A new thermal model and measuring method for the ignition temperature are proposed. • Ignition occurs in a region but not a point with ambient conditions changing. • Ignition region is measured from the minimum to maximum ignition temperature. • T_i_g_,_m_a_x of coal char in TG-DSC is in line with the ignition temperature of EFR. - Abstract: Through using a new thermal analysis model and a method of coal/char combustion, the minimum ignition temperature and minimum ignition heat of three different ranks of pulverized coal char were measured by simultaneous Thermogravimetry and Differential Scanning Calorimetry (TG-DSC) experiments. The results show that the ignition of coal char occurs in the range between the minimum ignition temperature and the inflection-point temperature. The thermal acceleration and its gradient G_T increase with increasing heating rate and decrease with increasing coal char rank. The higher the G_T of the coal char, the more easily the ignition occurs and more rapidly the burning and burnout occur. The data show that the G_T of coal char of SLH lignite is 1.6 times more than that of coal char of ZCY bituminous and JWY anthracite in ignition zone, and 3.4 times in burning zone. The characteristic temperatures increase with increasing temperature of prepared char, heating rate and char rank. Moreover, the T_i_g_,_m_a_x calculated in DSC experiment is approximately in line with the ignition temperature obtained in the entrained flow reactor, which demonstrates the feasibility of the proposed theory.

  11. Coal pyrolysis and char burnout under conventional and oxy-fuel conditions

    Energy Technology Data Exchange (ETDEWEB)

    Al-Makhadmeh, L.; Maier, J.; Scheffknecht, G. [Stuttgart Univ. (Germany). Institut fuer Verfahrenstechnik und Dampfkesselwesen

    2009-07-01

    Coal utilization processes such as combustion or gasification generally involve several steps i.e., the devolatilization of organic materials, homogeneous reactions of volatile matter with the reactant gases, and heterogeneous reactions of the solid (char) with the reactant gases. Most of the reported work about coal pyrolysis and char burnout were performed at low temperatures under environmental conditions related to the air firing process with single particle tests. In this work, coal combustion under oxy-fuel conditions is investigated by studying coal pyrolysis and char combustion separately in practical scales, with the emphasis on improving the understanding of the effect of a CO{sub 2}-rich gas environment on coal pyrolysis and char burnout. Two coals, Klein Kopje a medium volatile bituminous coal and a low-rank coal, Lausitz coal were used. Coal pyrolysis in CO{sub 2} and N{sub 2} environments were performed for both coals at different temperatures in an entrained flow reactor. Overall mass release, pyrolysis gas concentrations, and char characterization were performed. For char characterization ultimate analysis, particle size, and BET surface area were measured. Chars for both coals were collected at 1150 C in both CO{sub 2} and N{sub 2} environments. Char combustion was performed in a once-through 20 kW test facility in O{sub 2}/CO{sub 2} and O{sub 2}/N{sub 2} atmospheres. Besides coal quality, oxygen partial pressure was chosen as a variable to study the effect of the gas environment on char burnout. In general, it is found that the CO{sub 2} environment and coal rank have a significant effect on coal pyrolysis and char burnout. (orig.)

  12. Study of electronic and structural properties of CaS

    International Nuclear Information System (INIS)

    Mirfenderski, M.; Akbarzdeh, H.; Mokhtari, A.

    2003-01-01

    The electronic and structural properties of CaS are calculated using full potential linearized augmented plane wave method within the local density approximation and generalized gradient approximation for the exchange -correlation energy. For both structures, NaCl structure (B1) and CsCl structure (B2), the obtained values for lattice parameters, bulk modulus and its pressure derivative and transition pressure are in reasonable agreement with the experimental values. For electronic properties, the obtained value for band gap is smaller than the experimental value as well as other calculated results based on density functional theory. Engel and Vosko calculated an exchange potential for some atoms within the so-called optimize-potential model and then used the virial relation and constructed a new exchange-correlation functional. We used that functional and obtained reasonable results for band gap. Finally we investigated the possibility for a third phase ( Zinc Blend structure) for this crystal

  13. Tribological properties of nanostripe surface structures-a design concept for improving tribological properties

    International Nuclear Information System (INIS)

    Miyake, K; Nakano, M; Korenaga, A; Mano, H; Ando, Y

    2010-01-01

    The tribological properties of nanostripe surface structures were investigated using a pin-on-plate tribometer in order to propose a design concept for improving the tribological properties. The authors used four kinds of nanostripe structures consisting of different combinations of materials (Fe-Au, C-SiC, Al-Al 2 O 3 and Al-Pt) fabricated by a process they had previously proposed. The frictional properties of the nanostripe structures depended on the materials that constituted the nanostripes. When the sliding direction in friction tests was parallel to the microgrooves, nanostripe structures remained on all surfaces even after friction tests. Based on the friction test results, the authors considered a design concept for nanostripe structures in tribological applications.

  14. Structural stability, electronic structure and mechanical properties of actinide carbides AnC (An = U, Np)

    International Nuclear Information System (INIS)

    Manikandan, M.; Santhosh, M.; Rajeswarapalanichamy, R.

    2016-01-01

    Ab initio calculations are performed to investigate the structural stability, electronic structure and mechanical properties of actinide carbides AnC (An=U, Np) for three different crystal structures, namely NaCl, CsCl and ZnS. Among the considered structures, NaCl structure is found to be the most stable structure for these carbides at normal pressure. A pressure induced structural phase transition from NaCl to ZnS is observed. The electronic structure reveals that these carbides are metals. The calculated elastic constants indicate that these carbides are mechanically stable at normal pressure.

  15. Synthesis, Amphiphilic Property and Thermal Stability of Novel Main-chain Poly(o-carborane-benzoxazines)

    Science.gov (United States)

    Yang, Xiaoxue; Han, Guo; Yang, Zhen; Zhang, Xiaoa; Jiang, Shengling; Lyu, Yafei

    2017-10-01

    Five poly(o-carborane-benzoxazines) were synthesized via Mannich reaction of o-carborane bisphenol, paraformaldehyde, and diamine, and their structures were well characterized. Light transmission and 1H NMR in D2O confirmed that poly(o-carborane-benzoxazines) with PEG segments showed excellent water solubility and amphiphilic property. TGA analyses were conducted under nitrogen and air, and the results showed that the polymers own high initial decomposition temperatures owing to the shielding effect of carborane moiety on its adjacent aromatic structures. Besides, poly(o-carborane-benzoxazines) own high char yield at elevated temperatures, for the boron atom could combine with oxygen from the polymer structure or/and the air and be oxidized to form boron oxide, and thus the polymer weight is retained to a large extent. PEG segments had an adverse effect on the initial decomposition and char yield, and thus their concentration should be adjusted to control the polymer’s thermal stability.

  16. Distributing Correlation Coefficients of Linear Structure-Activity/Property Models

    Directory of Open Access Journals (Sweden)

    Sorana D. BOLBOACA

    2011-12-01

    Full Text Available Quantitative structure-activity/property relationships are mathematical relationships linking chemical structure and activity/property in a quantitative manner. These in silico approaches are frequently used to reduce animal testing and risk-assessment, as well as to increase time- and cost-effectiveness in characterization and identification of active compounds. The aim of our study was to investigate the pattern of correlation coefficients distribution associated to simple linear relationships linking the compounds structure with their activities. A set of the most common ordnance compounds found at naval facilities with a limited data set with a range of toxicities on aquatic ecosystem and a set of seven properties was studied. Statistically significant models were selected and investigated. The probability density function of the correlation coefficients was investigated using a series of possible continuous distribution laws. Almost 48% of the correlation coefficients proved fit Beta distribution, 40% fit Generalized Pareto distribution, and 12% fit Pert distribution.

  17. Effect of monohydric alcohols on structural properties of macromolecular solutions

    International Nuclear Information System (INIS)

    Giordano, R.; Wanderlingh, F.; Cordone, L.; Cupane, A.

    1983-01-01

    A report on the effects of monohydric alcohols on the thixotropic properties of a 1% (by weight) BSA solution is given. The presence of alcohols in the solution medium, even in a very small amount, weakens the structure responsible for the thixotropic properties: this effect increases with increasing alcohol concentration and alkyl group size. Indirect evidence relating the observed effects to the alteration, in the presence of alcohol, of protein-solvent hydrophobic interactions is also presented

  18. Rare Earth Borohydrides—Crystal Structures and Thermal Properties

    Directory of Open Access Journals (Sweden)

    Christoph Frommen

    2017-12-01

    Full Text Available Rare earth (RE borohydrides have received considerable attention during the past ten years as possible hydrogen storage materials due to their relatively high gravimetric hydrogen density. This review illustrates the rich chemistry, structural diversity and thermal properties of borohydrides containing RE elements. In addition, it highlights the decomposition and rehydrogenation properties of composites containing RE-borohydrides, light-weight metal borohydrides such as LiBH4 and additives such as LiH.

  19. Electronic structure and physical properties of 13C carbon composite

    OpenAIRE

    Zhmurikov, Evgenij

    2015-01-01

    This review is devoted to the application of graphite and graphite composites in science and technology. Structure and electrical properties, as so technological aspects of producing of high-strength artificial graphite and dynamics of its destruction are considered. These type of graphite are traditionally used in the nuclear industry. Author was focused on the properties of graphite composites based on carbon isotope 13C. Generally, the review relies on the original results and concentrates...

  20. Influence of pH on pesticide sorption by soil containing wheat residue-derived char

    International Nuclear Information System (INIS)

    Sheng Guangyao; Yang Yaning; Huang Minsheng; Yang Kai

    2005-01-01

    Field burning of crop residues incorporates resulting chars into soil and may thus influence the environmental fate of pesticides in the soil. This study evaluated the influence of pH on the sorption of diuron, bromoxynil, and ametryne by a soil in the presence and absence of a wheat residue-derived char. The sorption was measured at pHs ∼3.0 and ∼7.0. Wheat char was found to be a highly effective sorbent for the pesticides, and its presence (1% by weight) in soil contributed >70% to the pesticide sorption (with one exception). The sorption of diuron was not influenced by pH, due to its electroneutrality. Bromoxynil becomes dissociated at high pHs to form anionic species. Its sorption by soil and wheat char was lower at pH ∼7.0 than at pH ∼3.0, probably due to reduced partition of the anionic species of bromoxynil into soil organic matter and its weak interaction with the carbon surface of the char. Ametryne in its molecular form at pH ∼7.0 was sorbed by char-amended soil via partitioning into soil organic matter and interaction with the carbon surface of the char. Protonated ametryne at pH ∼3.0 was substantially sorbed by soil primarily via electrostatic forces. Sorption of protonated ametryne by wheat char was also significant, likely due not only to the interaction with the carbon surface but also to interactions with hydrated silica and surface functional groups of the char. Sorption of ametryne by char-amended soil at pH ∼3.0 was thus influenced by both the soil and the char. Environmental conditions may thus significantly influence the sorption and behavior of pesticides in agricultural soils containing crop residue-derived chars. - Wheat char was effective for adsorption of pesticides in soil, with efficacy varying with pH and particular pesticides

  1. Influence of pH on pesticide sorption by soil containing wheat residue-derived char

    Energy Technology Data Exchange (ETDEWEB)

    Sheng Guangyao [Department of Crop, Soil, and Environmental Sciences, University of Arkansas, Fayetteville, AR 72701 (United States)]. E-mail: gsheng@uark.edu; Yang Yaning [Department of Crop, Soil, and Environmental Sciences, University of Arkansas, Fayetteville, AR 72701 (United States); Huang Minsheng [Department of Environmental Science and Technology, East China Normal University, Shanghai 200062 (China); Yang Kai [Department of Environmental Science and Technology, East China Normal University, Shanghai 200062 (China)

    2005-04-01

    Field burning of crop residues incorporates resulting chars into soil and may thus influence the environmental fate of pesticides in the soil. This study evaluated the influence of pH on the sorption of diuron, bromoxynil, and ametryne by a soil in the presence and absence of a wheat residue-derived char. The sorption was measured at pHs {approx}3.0 and {approx}7.0. Wheat char was found to be a highly effective sorbent for the pesticides, and its presence (1% by weight) in soil contributed >70% to the pesticide sorption (with one exception). The sorption of diuron was not influenced by pH, due to its electroneutrality. Bromoxynil becomes dissociated at high pHs to form anionic species. Its sorption by soil and wheat char was lower at pH {approx}7.0 than at pH {approx}3.0, probably due to reduced partition of the anionic species of bromoxynil into soil organic matter and its weak interaction with the carbon surface of the char. Ametryne in its molecular form at pH {approx}7.0 was sorbed by char-amended soil via partitioning into soil organic matter and interaction with the carbon surface of the char. Protonated ametryne at pH {approx}3.0 was substantially sorbed by soil primarily via electrostatic forces. Sorption of protonated ametryne by wheat char was also significant, likely due not only to the interaction with the carbon surface but also to interactions with hydrated silica and surface functional groups of the char. Sorption of ametryne by char-amended soil at pH {approx}3.0 was thus influenced by both the soil and the char. Environmental conditions may thus significantly influence the sorption and behavior of pesticides in agricultural soils containing crop residue-derived chars. - Wheat char was effective for adsorption of pesticides in soil, with efficacy varying with pH and particular pesticides.

  2. Investigation of optical properties of Ag: PMMA nanocomposite structures

    Science.gov (United States)

    Ponelyte, S.; Palevicius, A.; Guobiene, A.; Puiso, J.; Prosycevas, I.

    2010-05-01

    In the recent years fundamental research involving the nanodimensional materials has received enormous momentum for observing and understanding new types of plasmonic materials and their physical phenomena occurring in the nanoscale. Mechanical and optical properties of these polymer based nanocomposite structures depend not only on type, dimensions and concentration of filler material, but also on a kind of polymer matrix used. By proper selection of polymer matrix and nanofillers, it is possible to engineer nanocomposite materials with certain favorable properties. One of the most striking features of nanocomposite materials is that they can expose unique optical properties that are not intrinsic to natural materials. In these researches, nanocomposite structures were formed using polymer (PMMA) as a matrix, and silver nanoparticles as fillers. By hot embossing procedure a diffraction grating was imprinted on formed layers. The effect of UV exposure time on nanocomposite structures morphology, optical (diffraction effectiveness, absorbance) and mechanical properties was investigated. Results were confirmed by UV-VIS spectrometer, Laser Diffractometer, PMT- 3 and AFM. Investigations proposed new nanocomposite structures as plasmonic materials with improved optical and mechanical properties, which may be applied for a number of technological applications: micro-electro-mechanical devices, optical devices, various plasmonic sensors, or even in DNA nanotechnology.

  3. Composition-Structure-Property Relations of Compressed Borosilicate Glasses

    Science.gov (United States)

    Svenson, Mouritz N.; Bechgaard, Tobias K.; Fuglsang, Søren D.; Pedersen, Rune H.; Tjell, Anders Ø.; Østergaard, Martin B.; Youngman, Randall E.; Mauro, John C.; Rzoska, Sylwester J.; Bockowski, Michal; Smedskjaer, Morten M.

    2014-08-01

    Hot isostatic compression is an interesting method for modifying the structure and properties of bulk inorganic glasses. However, the structural and topological origins of the pressure-induced changes in macroscopic properties are not yet well understood. In this study, we report on the pressure and composition dependences of density and micromechanical properties (hardness, crack resistance, and brittleness) of five soda-lime borosilicate glasses with constant modifier content, covering the extremes from Na-Ca borate to Na-Ca silicate end members. Compression experiments are performed at pressures ≤1.0 GPa at the glass transition temperature in order to allow processing of large samples with relevance for industrial applications. In line with previous reports, we find an increasing fraction of tetrahedral boron, density, and hardness but a decreasing crack resistance and brittleness upon isostatic compression. Interestingly, a strong linear correlation between plastic (irreversible) compressibility and initial trigonal boron content is demonstrated, as the trigonal boron units are the ones most disposed for structural and topological rearrangements upon network compaction. A linear correlation is also found between plastic compressibility and the relative change in hardness with pressure, which could indicate that the overall network densification is responsible for the increase in hardness. Finally, we find that the micromechanical properties exhibit significantly different composition dependences before and after pressurization. The findings have important implications for tailoring microscopic and macroscopic structures of glassy materials and thus their properties through the hot isostatic compression method.

  4. Process, structure, property and applications of metallic glasses

    Directory of Open Access Journals (Sweden)

    B. Geetha Priyadarshini

    2016-07-01

    Full Text Available Metallic glasses (MGs are gaining immense technological significance due to their unique structure-property relationship with renewed interest in diverse field of applications including biomedical implants, commercial products, machinery parts, and micro-electro-mechanical systems (MEMS. Various processing routes have been adopted to fabricate MGs with short-range ordering which is believed to be the genesis of unique structure. Understanding the structure of these unique materials is a long-standing unsolved mystery. Unlike crystalline counterpart, the outstanding properties of metallic glasses owing to the absence of grain boundaries is reported to exhibit high hardness, excellent strength, high elastic strain, and anti-corrosion properties. The combination of these remarkable properties would significantly contribute to improvement of performance and reliability of these materials when incorporated as bio-implants. The nucleation and growth of metallic glasses is driven by thermodynamics and kinetics in non-equilibrium conditions. This comprehensive review article discusses the various attributes of metallic glasses with an aim to understand the fundamentals of relationship process-structure-property existing in such unique class of material.

  5. Fire Safety Design of Wood Structures

    DEFF Research Database (Denmark)

    Hertz, Kristian Dahl

    2006-01-01

    Lecture Notes on Fire Safety Design of Wood Structures including charring of wood and load bearing capacity of beams, columns, and connections.......Lecture Notes on Fire Safety Design of Wood Structures including charring of wood and load bearing capacity of beams, columns, and connections....

  6. Structural Dependence of Physical Properties in Sodium Boroaluminosilicate Glasses

    DEFF Research Database (Denmark)

    Zheng, Qiuju; Potuzak, Marcel; Mauro, John C.

    Boroaluminosilicate glasses have found applications in many fields. The extent and nature of the mixing of network formers like SiO2, B2O3, and Al2O3 play an important role in controlling the macroscopic properties. To understand the structure-property correlations in these glasses, we study...... a series of sodium boroaluminosilicate glasses with various [Al2O3]/[SiO2] ratios to access different regimes of sodium behavior. We determine dynamic properties, elastic moduli, and hardness of these glasses. The results reveal an existence of local minimum for density, fragility index, Young’s and shear...

  7. Correlation between fuel structure and mechanical properties of UO2

    International Nuclear Information System (INIS)

    Blank, H.; Mandler, R.; Matzke, H.; Routbort, J.; Werner, P.

    1982-10-01

    The relation between the structure of a UO 2 fuel and its mechanical properties are discussed and illustrated for particular types of UO 2 by measurements of fracture surface energy, hardness, fracture stress and of compressive deformation at 1870 and 1970 0 K. This gives the background for treating the question whether it is possible to find a simple experimental method for correlating the mechanical properties of UO 2 before irradiation with those after various irradiation histories. Hardness measurements might be such a method if combined with a detailed structural analysis and sufficient knowledge about the irradiation history

  8. Structure/property relationships in non-linear optical materials

    Energy Technology Data Exchange (ETDEWEB)

    Cole, J M [Institut Max von Laue - Paul Langevin (ILL), 38 - Grenoble (France); [Durham Univ. (United Kingdom); Howard, J A.K. [Durham Univ. (United Kingdom); McIntyre, G J [Institut Max von Laue - Paul Langevin (ILL), 38 - Grenoble (France)

    1997-04-01

    The application of neutrons to the study of structure/property relationships in organic non-linear optical materials (NLOs) is described. In particular, charge-transfer effects and intermolecular interactions are investigated. Charge-transfer effects are studied by charge-density analysis and an example of one such investigation is given. The study of intermolecular interactions concentrates on the effects of hydrogen-bonding and an example is given of two structurally similar molecules with very disparate NLO properties, as a result of different types of hydrogen-bonding. (author). 3 refs.

  9. Structure and properties of Titanium for dental implants

    Directory of Open Access Journals (Sweden)

    M. Greger

    2009-10-01

    Full Text Available This paper describes manufacture of nano-structural titanium, its structure and properties. Nano-titanium has higher specific strength properties than ordinary (coarse-grained titanium. Nano-titanium was produced by the equal-channel angular pressing (ETAP process. The research it self was focused on physical base of strengthening and softening processes and developments occurring at the grain boundaries during the ECAP process at half-hot temperature. Strength of nano-titanium varies around 960 MPa, grain size around 300 nm.

  10. Combustion Characteristics Of Agricultural Waste-Coal Char Blends

    International Nuclear Information System (INIS)

    Akpabio, I. O; Danbature W

    2002-01-01

    Shortage of petroleum products, depletion of huge forest reserves for fuel purposes with its attendant erosion problems and other environmental considerations have necessitated investigations into other sources of fuel. In this wise. a set of seven types of briquettes were prepared from agricultural wastes such as rice husk, maize husk and saw-dust and blends of carbonized coal char. Strong and well-formed briquettes with good combustion characteristics were obtained. The results obtained from water boiling tests show that 2 litres of water could be boiled just under 23 minutes. Moisture contents and strengths of these briquettes were also determined and are discussed. The results show that wastes could be converted into useful fuel

  11. The removal of reactive dyes using high-ash char

    Directory of Open Access Journals (Sweden)

    Moreira R.F.P.M.

    2001-01-01

    Full Text Available The thermodynamics and kinetics of adsorption of reactive dyes on high-ash char was studied. Equilibrium data were obtained using the static method with controlled agitation at temperatures in the range of 30 to 60ºC. The Langmuir isotherm model was used to describe the equilibrium of adsorption, and the equilibrium parameters, R L, in the range of 0 to 1 indicate favorable adsorption. The amount of dye adsorbed increased as temperature increased from 30 to 40ºC, but above 40ºC the increase in temperature resulted in a decrease in the amount of dye adsorbed. The kinetic data presented are for controlled agitation at 50 rpm and constant temperature with dye concentrations in the range of 10 ppm to50 ppm. The film mass transfer coefficient, Kf, and the effective diffusivity inside the particle, De, were fitted to the experimental data. The results indicate that internal diffusion governs the adsorption rate.

  12. Low Velocity Impact Properties of Aluminum Foam Sandwich Structural Composite

    Directory of Open Access Journals (Sweden)

    ZHAO Jin-hua

    2018-01-01

    Full Text Available Sandwich structural composites were prepared by aluminum foam as core materials with basalt fiber(BF and ultra-high molecular weight polyethylene(UHMWPE fiber composite as faceplate. The effect of factors of different fiber type faceplates, fabric layer design and the thickness of the corematerials on the impact properties and damage mode of aluminum foam sandwich structure was studied. The impact properties were also analyzed to compare with aluminum honeycomb sandwich structure. The results show that BF/aluminum foam sandwich structural composites has bigger impact damage load than UHMWPE/aluminum foam sandwich structure, but less impact displacement and energy absorption. The inter-layer hybrid fabric design of BF and UHMWPE has higher impact load and energy absorption than the overlay hybrid fabric design faceplate sandwich structure. With the increase of the thickness of aluminum foam,the impact load of the sandwich structure decreases, but the energy absorption increases. Aluminum foam sandwich structure has higher impact load than the aluminum honeycomb sandwich structure, but smaller damage energy absorption; the damage mode of aluminum foam core material is mainly the fracture at the impact area, while aluminum honeycomb core has obvious overall compression failure.

  13. Molecular structure based property modeling: Development/ improvement of property models through a systematic property-data-model analysis

    DEFF Research Database (Denmark)

    Hukkerikar, Amol Shivajirao; Sarup, Bent; Sin, Gürkan

    2013-01-01

    models. To make the property-data-model analysis fast and efficient, an approach based on the “molecular structure similarity criteria” to identify molecules (mono-functional, bi-functional, etc.) containing specified set of structural parameters (that is, groups) is employed. The method has been applied...

  14. Mechanical properties and impact behavior of a microcellular structural foam

    Directory of Open Access Journals (Sweden)

    M. Avalle

    Full Text Available Structural foams are a relatively new class of materials with peculiar characteristics that make them very attractive in some energy absorption applications. They are currently used for packaging to protect goods from damage during transportation in the case of accidental impacts. Structural foams, in fact, have sufficient mechanical strength even with reduced weight: the balance between the two antagonist requirements demonstrates that these materials are profitable. Structural foams are generally made of microcellular materials, obtained by polymers where voids at the microscopic level are created. Although the processing technologies and some of the material properties, including mechanical, are well known, very little is established for what concerns dynamic impact properties, for the design of energy absorbing components made of microcellular foams. The paper reports a number of experimental results, in different loading conditions and loading speed, which will be a basis for the structural modeling.

  15. Corn stalks char from fast pyrolysis as precursor material for preparation of activated carbon in fluidized bed reactor.

    Science.gov (United States)

    Wang, Zhiqi; Wu, Jingli; He, Tao; Wu, Jinhu

    2014-09-01

    Corn stalks char from fast pyrolysis was activated by physical and chemical activation process in a fluidized bed reactor. The structure and morphology of the carbons were characterized by N2 adsorption and SEM. Effects of activation time and activation agents on the structure of activation carbon were investigated. The physically activated carbons with CO2 have BET specific surface area up to 880 m(2)/g, and exhibit microporous structure. The chemically activated carbons with H3PO4 have BET specific surface area up to 600 m(2)/g, and exhibit mesoporous structure. The surface morphology shows that physically activated carbons exhibit fibrous like structure in nature with long ridges, resembling parallel lines. Whereas chemically activated carbons have cross-interconnected smooth open pores without the fibrous like structure. Copyright © 2014 Elsevier Ltd. All rights reserved.

  16. Effect of sewage sledge and their bio-char on some soil qualities in Second year cropping

    Science.gov (United States)

    fathi dokht, hamed; Movahedi Naeini, Seyed Alireza; Dordipor, Esmaeil; mirzanejad, moujan

    2016-04-01

    Bio char (BC) application as a soil amendment has achieved much interest and has been found that considerably improves soil nutrient status and crop yields on poor soils. However, information on the effect of BC on illitic soils in temperate climates is still insufficient. The primary objective in this study was to assess the influence of sewage sledge and their bio-char on the soil physical properties, nutrient status and plant production in Second year cropping. The result may also provide a reference for the use of biochars as a solution in agricultural waste management when sludge with considerable load of pathogens are involved. Soybean was already grown one year and will be repeated one more year with same treatments. The investigated soil properties included soil water content and mechanical resistance, pH, electrical conductivity (EC), calcium- acetate-lactate (CAL)-extractable P (PCAL) and K (KCAL), C, N, and nitrogen-supplying potential (NSP). The results show soil water content, potassium uptake and plant yield were increased. Heating sludge removed all pathogens and soybean yield was increased by 7%.

  17. Intrinsic char reactivity of plastic waste (PET) during CO2 gasification

    International Nuclear Information System (INIS)

    Gil, M.V.; Fermoso, J.; Pevida, C.; Pis, J.J.; Rubiera, F.

    2010-01-01

    Char reactivity has a strong influence on the gasification process, since char gasification is the slowest step in the process. A sample of waste PET was devolatilised in a vertical quartz reactor and the resulting char was partially gasified under a CO 2 atmosphere at 925 C in order to obtain samples with different degrees of conversion. The reactivity of the char in CO 2 was determined by isothermal thermogravimetric analysis at different temperatures in a kinetically controlled regime and its reactive behaviour was evaluated by means of the random pore model (RPM). The texture of the char was characterised by means of N 2 and CO 2 adsorption isotherms. The results did not reveal any variation in char reactivity during conversion, whereas the micropore surface area was affected during the gasification process. It was found that the intrinsic reaction rate of the char can be satisfactorily calculated by normalizing the reaction rate by the narrow micropore surface area calculated from the CO 2 adsorption isotherms. It can be concluded therefore that the surface area available for the gasification process is the area corresponding to the narrow microporosity. (author)

  18. Fabrication and properties of submicrometer structures of magnetic materials

    International Nuclear Information System (INIS)

    Martin, J.I.; Velez, M.; Nogues, J.; Schuller, I.K.

    1998-01-01

    The method of electron beam lithography is described. This technique allows to fabricate well defined submicrometer structures of magnetic materials, that are suitable to show and study interesting physical properties by transport measurements either in Superconductivity or in Magnetism. In particular, using these structures, we have analyzed pinning effects of the vortex lattice in superconductors and magnetization reversal processes in magnetic materials. (Author) 15 refs

  19. Band Gap Properties of Magnetoelectroelastic Grid Structures with Initial Stress

    International Nuclear Information System (INIS)

    Wang Yi-Ze; Li Feng-Ming

    2012-01-01

    The propagation of elastic waves in magnetoelectroelastic grid structures is studied. Band gap properties are presented and the effects of the magnetoelectroelastic coupling and initial stress are considered. Numerical calculations are performed using the plane-wave expansion method. The results show that the band gap width can be tuned by the initial stress. It is hoped that our results will be helpful for designing acoustic filters with magnetoelectroelastic materials and grid structures

  20. Path Integration Applied to Structural Systems with Uncertain Properties

    DEFF Research Database (Denmark)

    Nielsen, Søren R.K.; Köylüoglu, H. Ugur

    Path integration (cell-to-cell mapping) method is applied to evaluate the joint probability density function (jpdf) of the response of the structural systems, with uncertain properties, subject to white noise excitation. A general methodology to deal with uncertainties is outlined and applied...... to the friction controlled slip of a structure on a foundation where the friction coefficient is modelled as a random variable. Exact results derived using the total probability theorem are compared to the ones obtained via path integration....

  1. Comparison of high temperature chars of wheat straw and rice husk with respect to chemistry, morphology and reactivity

    DEFF Research Database (Denmark)

    Trubetskaya, Anna; Jensen, Peter Arendt; Jensen, Anker Degn

    2016-01-01

    Fast pyrolysis of wheat straw and rice husk was carried out in an entrained flow reactor at hightemperatures(1000e1500) C. The collected char was analyzed using X-ray diffractometry, N2-adsorption,scanning electron microscopy, particle size analysis with CAMSIZER XT, 29Si and 13C solid-statenucle......), which led to the formation of a glassy char shell, resulting in a preserved particlesize and shape of chars. The high alkali content in the wheat straw resulted in higher char reactivity,whereas the lower silicon content caused variations in the char shape from cylindrical to near...

  2. Modeling char conversion under suspension fired conditions in O2/N2 and O2/CO2 atmospheres

    DEFF Research Database (Denmark)

    Brix, Jacob; Jensen, Peter Arendt; Jensen, Anker Degn

    2011-01-01

    The aim of this investigation has been to model combustion under suspension fired conditions in O2/N2 and O2/CO2 mixtures. Experiments used for model validation have been carried out in an electrically heated Entrained Flow Reactor (EFR) at temperatures between 1173 K and 1673 K with inlet O2...... concentrations between 5 and 28 vol.%. The COal COmbustion MOdel, COCOMO, includes the three char morphologies: cenospheric char, network char and dense char each divided between six discrete particle sizes. Both combustion and gasification with CO2 are accounted for and reaction rates include thermal char...

  3. Structure and physical properties of bio membranes and model membranes

    International Nuclear Information System (INIS)

    Tibor Hianik

    2006-01-01

    Bio membranes belong to the most important structures of the cell and the cell organelles. They play not only structural role of the barrier separating the external and internal part of the membrane but contain also various functional molecules, like receptors, ionic channels, carriers and enzymes. The cell membrane also preserves non-equilibrium state in a cell which is crucial for maintaining its excitability and other signaling functions. The growing interest to the bio membranes is also due to their unique physical properties. From physical point of view the bio membranes, that are composed of lipid bilayer into which are incorporated integral proteins and on their surface are anchored peripheral proteins and polysaccharides, represent liquid s crystal of smectic type. The bio membranes are characterized by anisotropy of structural and physical properties. The complex structure of bio membranes makes the study of their physical properties rather difficult. Therefore several model systems that mimic the structure of bio membranes were developed. Among them the lipid monolayers at an air-water interphase, bilayer lipid membranes, supported bilayer lipid membranes and liposomes are most known. This work is focused on the introduction into the physical word of the bio membranes and their models. After introduction to the membrane structure and the history of its establishment, the physical properties of the bio membranes and their models are stepwise presented. The most focus is on the properties of lipid monolayers, bilayer lipid membranes, supported bilayer lipid membranes and liposomes that were most detailed studied. This lecture has tutorial character that may be useful for undergraduate and graduate students in the area of biophysics, biochemistry, molecular biology and bioengineering, however it contains also original work of the author and his co-worker and PhD students, that may be useful also for specialists working in the field of bio membranes and model

  4. Structure and Magnetic Properties of Rare Earth Doped Transparent Alumina

    Science.gov (United States)

    Limmer, Krista; Neupane, Mahesh; Chantawansri, Tanya

    Recent experimental studies of rare earth (RE) doped alumina suggest that the RE induced novel phase-dependent structural and magnetic properties. Motivated by these efforts, the effects of RE doping of alpha and theta alumina on the local structure, magnetic properties, and phase stability have been examined in this first principles study. Although a direct correlation between the magnetic field dependent materials properties observed experimentally and calculated from first principles is not feasible because of the applied field and the scale, the internal magnetic properties and other properties of the doped materials are evaluated. The RE dopants are shown to increase the substitutional site volume as well as increasingly distort the site structure as a function of ionic radii. Doping both the alpha (stable) and theta (metastable) phases enhanced the relative stability of the theta phase. The energetic doping cost and internal magnetic moment were shown to be a function of the electronic configuration of the RE-dopant, with magnetic moment directly proportional to the number of unpaired electrons and doping cost being inversely related.

  5. A first step towards identification of tannin-derived black carbon: Conventional pyrolysis (Py–GC–MS) and thermally assisted hydrolysis and methylation (THM–GC–MS) of charred condensed tannins

    NARCIS (Netherlands)

    Kaal, J.; Nierop, K.G.J.; Kraal, P.; Preston, C.M.

    2012-01-01

    Tannins account for a significant proportion of plant biomass and are likely to contribute to the residues formed by incomplete biomass combustion (black carbon, BC). Nonetheless, the molecular properties of thermally modified tannins have not been investigated in laboratory charring experiments. We

  6. Crystal structure, characterization and magnetic properties of a 1D ...

    Indian Academy of Sciences (India)

    Crystal structure, characterization and magnetic properties of a 1D copper(II) polymer incorporating a Schiff base with carboxylate side arm. SHYAMAPADA SHIT MADHUSUDAN NANDY CORRADO RIZZOLI CÉDRIC DESPLANCHES SAMIRAN MITRA. Regular Article Volume 128 Issue 6 June 2016 pp 913-920 ...

  7. Structure And Properties Of PVD Coatings Deposited On Cermets

    Directory of Open Access Journals (Sweden)

    Żukowska L.

    2015-06-01

    Full Text Available The main aim of the research is the investigation of the structure and properties of single-layer and gradient coatings of the type (Ti,AlN and Ti(C,N deposited by physical vapour deposition technology (PVD on the cermets substrate.

  8. Ab-initio theoretical predictions of structural properties of semiconductors

    International Nuclear Information System (INIS)

    Rodriguez, C.O.; Peltzer y Blanca, E.L.; Cappannini, O.M.

    1983-01-01

    Calculations of the total energies of Si, GaP and C together with related structural properties are presented. The results show good agreement with experimental values (differences of less than 6%). They also agree with other recent theoretical results. Calculations for Si and GaP have already been reported and are given here as a reference. (L.C.) [pt

  9. Ab-initio theoretical predictions of structure properties of semiconductors

    International Nuclear Information System (INIS)

    Rodriguez, C.O.; Peltzer y Blanca, E.L.; Cappannini, O.M.

    1983-01-01

    In this paper, calculations of the total energies and related structural properties of Si, GaP and C are presented showing good agreement with experimental values. The total energy is calculated within the local-density functional formalism using first principles non-local pseudopotentials. (A.C.A.S.) [pt

  10. Structural, elastic, electronic and optical properties of bi-alkali ...

    Indian Academy of Sciences (India)

    The structural parameters, elastic constants, electronic and optical properties of the bi-alkali ... and efficient method for the calculation of the ground-state ... Figure 2. Optimization curve (E–V) of the bi-alkali antimonides: (a) Na2KSb, (b) Na2RbSb, (c) Na2CsSb, .... ical shape of the charge distributions in the contour plots.

  11. Piezoelectric and mechanical properties of structured PZT-epoxy composites

    NARCIS (Netherlands)

    James, N.K.; Ende, D.A. van den; Lafont, U.; Zwaag, S. van der; Groen, W.A.

    2013-01-01

    Structured lead zirconium titanate (PZT)-epoxy composites are prepared by dielectrophoresis. The piezoelectric and dielectric properties of the composites as a function of PZT volume fraction are investigated and compared with the corresponding unstructured composites. The effect of poling voltage

  12. Structural, morphological and magnetic properties of La1 ...

    Indian Academy of Sciences (India)

    2016-08-26

    Aug 26, 2016 ... Home; Journals; Bulletin of Materials Science; Volume 38; Issue 7. Structural, morphological and magnetic properties of La1−NaMnO3 ( ≤ ) nanoparticles produced by the solution combustion method. C O Ehi-Eromosele B I Ita K O Ajanaku A Edobor-Osoh O Aladesuyi S A Adalikwu F E Ehi- ...

  13. Major dimensions in food-web structure properties

    NARCIS (Netherlands)

    Vermaat, J.E.; Dunne, J. A.; Gilbert, A.J.

    2009-01-01

    The covariance among a range of 20 network structural properties of food webs plus net primary productivity was assessed for 14 published food webs using principal components analysis. Three primary components explained 84% of the variability in the data sets, suggesting substantial covariance among

  14. Size Induced Structural and Magnetic Properties of Nanostructured ...

    African Journals Online (AJOL)

    Their structural and magnetic properties were investigated using X-ray diffraction (XRD), scanning electron microscopy (SEM) and vibrating sample magnetometer (VSM) measurements. The average crystallite size of CoFe2O4was observed to increase from 23 to 65 nm as the annealing temperature was increased from ...

  15. Structural, energetic and electronic properties of intercalated boron ...

    Indian Academy of Sciences (India)

    2National Institute for R&D of Isotopic and Molecular Technologies, Cluj-Napoca 400 293, Romania. MS received 8 November 2010; revised 28 March 2012. Abstract. The effects of chirality and the intercalation of transitional metal atoms inside single walled BN nano- tubes on structural, energetic and electronic properties ...

  16. Synthesis, structure, thermal, transport and magnetic properties of VN ceramics

    Czech Academy of Sciences Publication Activity Database

    Huber, Š.; Jankovský, O.; Sedmidubský, D.; Luxa, J.; Klimová, K.; Hejtmánek, Jiří; Sofer, Z.

    2016-01-01

    Roč. 42, č. 16 (2016), s. 18779-18784 ISSN 0272-8842 R&D Projects: GA ČR GA13-20507S Institutional support: RVO:68378271 Keywords : vanadium mononitride * phase transition * electronic structure * heat capacity * transport properties Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.986, year: 2016

  17. Piezoelectric and mechanical properties of structured PZT–epoxy composites

    NARCIS (Netherlands)

    Kunnamkuzhakkal James, N.; Van den Ende, D.; Lafont, U.; Van der Zwaag, S.; Groen, W.A.

    2013-01-01

    Structured lead zirconium titanate (PZT)–epoxy composites are prepared by dielectrophoresis. The piezoelectric and dielectric properties of the composites as a function of PZT volume fraction are investigated and compared with the corresponding unstructured composites. The effect of poling voltage

  18. Synthesis, structural and optical properties of nanoparticles (Al, V ...

    Indian Academy of Sciences (India)

    The synthesis by the sol–gel method, structural and optical properties of ZnO, Zn0.99Al0.01O (AlZ),. Zn0.9V0.1O (VZ) ... drops of the resulting suspension containing the synthesized .... ZnO films on silicon substrate, they thought that this emis-.

  19. Electronic structure and optical properties of thorium monopnictides

    Indian Academy of Sciences (India)

    Unknown

    Indian Academy of Sciences. 165. Electronic structure and optical properties of thorium monopnictides. S KUMAR* and S AULUCK†. Physics Department, Institute of Engineering and Technology, M.J.P. Rohilkhand University, Bareilly 243 006,. India. †Department of Physics, Indian Institute of Technology, Roorkee 247 667, ...

  20. Structure and properties of compositions based on petroleum sulfonic acids

    Energy Technology Data Exchange (ETDEWEB)

    Tutorskii, I.A.; Sultanova, A.S.; Belkina, E.V.; Fomin, A.G. [Lomonosov Academy of Fine Chemical Technology, Moscow (Russian Federation)

    1995-03-01

    Colloidal characteristics of compositions based on petroleum sulfonic acids were studied. Neutralized heavy oil residue exhibits surface-active properties and contains an ultradisperse filler. Analysis of the compositions by size-exclusion-chromatography shows deep structural changes in the heavy acid residue upon neutralization with calcium carbonate.

  1. Structural properties of reflected Lévy processes

    DEFF Research Database (Denmark)

    Andersen, Lars Nørvang; Mandjes, Michel

    This paper considers a number of structural properties of reflected Lévy processes, where both one-sided reflection (at 0) and two-sided reflection (at both 0 and K > 0) are examined. With Vt being the position of the reflected process at time t, we focus on the analysis of ζ(t) := EVt and ξ(t) :...

  2. Intrinsic structure and friction properties of graphene and graphene

    Indian Academy of Sciences (India)

    In this paper, atomic structure of single-layered graphene oxide (GO) and chemically reduced graphene oxide (CRGO) nanosheets was investigated using atomic force microscopy and scanning tunnelingmicroscopy (AFM and STM). Furthermore, friction properties of the graphene and GO nanosheets were studied by ...

  3. Anomalous structural changes and elastic properties of bismuth oxide superconductors

    International Nuclear Information System (INIS)

    He, Y.S.; Xiang, J.; Chang, F.G.; Zhang, J.C.; He, A.S.; Wang, H.; Gu, B.L.

    1989-01-01

    Ultrasonic measurement revealed that there are anomalous structural changes near 200 K in single 2212 or 2223 phase samples of Bi(Pb)-Sr-Ca-Cu-O. Detailed study showed such anomalous changes are isothermal-like processes and have a characteristics of second order phase transition, accompanying with increases in lattice constants. The elastic properties of these ceramics and related systems are discussed

  4. Effect of heat treatment on structure and magnetic properties

    Indian Academy of Sciences (India)

    Fe46Co35Ni19/CNTs nanocomposites have been prepared by an easy two-step route including adsorption and heat treatment processes. We investigated the effect of heat treatment conditions on structure, morphology, nanoparticle sizes and magnetic properties of the Fe46Co35Ni19 alloy nanoparticles attached on the ...

  5. Structural, morphological and magnetic properties of La1 ...

    Indian Academy of Sciences (India)

    Home; Journals; Bulletin of Materials Science; Volume 38; Issue 7. Structural, morphological and magnetic properties of La1−NaMnO3 ( ≤ ) nanoparticles produced by the solution combustion method. C O Ehi-Eromosele B I Ita K O Ajanaku A Edobor-Osoh O Aladesuyi S A Adalikwu F E Ehi-Eromosele. Volume 38 ...

  6. Structural and morphological properties of electroceramics for chemical sensors

    International Nuclear Information System (INIS)

    Tor Vergata, Via della Ricerca Scientifica, Roma (Italy). Dipartimento di Scienze e Tecnologie Chimiche)" data-affiliation=" (Universita' di Roma Tor Vergata, Via della Ricerca Scientifica, Roma (Italy). Dipartimento di Scienze e Tecnologie Chimiche)" >Enrico Traversa

    1996-01-01

    Ceramic materials possess a unique structure consisting of grains, grain boundaries, surfaces and pores, which makes them suitable for chemical sensors. The control of the chemical composition and microstructure of electrochemicals is fundamental for controlling their properties. Ceramics with a given composition and microstructure can be produced by controlling the different steps of their processing. The chemical processing of ceramics offer many advantages in terms of control and reproducibility, with respect to the conventional ceramics processing. Results are reported about the chemical processing of perovskite-type oxides for gas sensors and about the novel humidity-sensitive electrical properties of sol-gel processed alkali-doped titania films. The structural and morphological characterization of these materials permits the understanding of the sensitive electrical properties of the ceramics (71 refs.)

  7. History, Violence and Poetics: Saint-John Perse and René Char

    Directory of Open Access Journals (Sweden)

    Nathan Bracher

    1991-06-01

    Full Text Available This essay explores the parallel yet opposite stances taken both personally and textually by Perse and Char with respect to drama of World War II. While Perse remained disdainfully aloof from public affairs after the defeat and proclaimed in his poetry his solidarity with all humanity, Char explicitly linked his writing to events, yet sought to create a human space removed from history's upheavals. Striving to transcend the vicissitudes of individual existence, Perse celebrates an epic vision of history that overlooks and even condones its violence. Focusing on the inconsistent, fragmentary nature of existence, Char prevents us from having any teleological delusions concerning war.

  8. Floor response spectra of buildings with uncertain structural properties

    International Nuclear Information System (INIS)

    Chen, P.C.

    1975-01-01

    All Category I equipment, such as reactors, vessels, and major piping systems of nuclear power plants, is required to withstand earthquake loadings in order to minimize risk of seismic damage. The equipment is designed by using response spectra of the floor on which the equipment is mounted. The floor response spectra are constructed usually from the floor response time histories which are obtained through a deterministic dynamic analysis. This analysis assumes that all structural parameters, such as mass, stiffness, and damping have been calculated precisely, and that the earthquakes are known. However, structural parameters are usually difficult to determine precisely if the structures are massive and/or irregular, such as nuclear containments and its internal structures with foundation soil incorporated into the analysis. Faced with these uncertainties, it has been the practice to broaden the floor response spectra peaks by +-10 percent of the peak frequencies on the basis of conservatism. This approach is based on engineering judgement and does not have an analytical basis to provide a sufficient level of confidence in using these spectra for equipment design. To insure reliable design, it is necessary to know structural response variations due to variations in structural properties. This consideration leads to the treatment of structural properties as random variables and the use of probabilistic methods to predict structural response more accurately. New results on floor response spectra of buildings with uncertain structural properties obtained by determining the probabilistic dynamic response from the deterministic dynamic response and its standard deviation are presented. The resulting probabilistic floor response spectra are compared with those obtained deterministically, and are shown to provide a more reliable method for determining seismic forces

  9. Properties of structural materials in liquid metal environment. Proceedings

    Energy Technology Data Exchange (ETDEWEB)

    Borgstedt, H U [ed.

    1991-12-15

    The International Working Group on Fast Reactors (IWGFR) Specialists Meeting on Properties of Structural Materials in Liquid Metal Environment was held during June 18 to June 20, 1991, at the Nuclear Research Centre (Kernforschungszentrum) in Karlsruhe, Germany. The Specialists Meeting was divided into five technical sessions which addressed topics as follows: Creep-Rupture Behaviour of Structural Materials in Liquid Metal Environment; Behaviour of Materials in Liquid Metal Environments under Off-Normal Conditions;Fatigue and Creep-Fatigue of Structural Materials in Liquid Metal Environment; Crack Propagation in Liquid Sodium; and Conclusions and recommendations. Individual papers have been cataloged separately.

  10. One-Electron Theory of Metals. Cohesive and Structural Properties

    DEFF Research Database (Denmark)

    Skriver, Hans Lomholt

    The work described in the report r.nd the 16 accompanying publications is based upon a one-electron theory obtained within the local approximation to density-functional theory, and deals with the ground state of metals as obtained from selfconsistent electronic-structure calculations performed...... by means of the Linear Muffin-Tin Orbital (LMTO) method. It has been the goal of the work to establish how well this one-electron approach describes physical properties such as the crystal structures of the transition metals, the structural phase transitions in the alkali, alkaline earth, and rare earth...

  11. Band structures and localization properties of aperiodic layered phononic crystals

    Energy Technology Data Exchange (ETDEWEB)

    Yan Zhizhong, E-mail: zzyan@bit.edu.cn [Department of Applied Mathematics, Beijing Institute of Technology, Beijing 100081 (China); Zhang Chuanzeng [Department of Civil Engineering, University of Siegen, D-57078 Siegen (Germany)

    2012-03-15

    The band structures and localization properties of in-plane elastic waves with coupling of longitudinal and transverse modes oblique propagating in aperiodic phononic crystals based on Thue-Morse and Rudin-Shapiro sequences are studied. Using transfer matrix method, the concept of the localization factor is introduced and the correctness is testified through the Rytov dispersion relation. For comparison, the perfect periodic structure and the quasi-periodic Fibonacci system are also considered. In addition, the influences of the random disorder, local resonance, translational and/or mirror symmetries on the band structures of the aperiodic phononic crystals are analyzed in this paper.

  12. Conference Proceedings: Structuring oil and gas property transactions

    International Nuclear Information System (INIS)

    1999-01-01

    The 12 presentations at this conference dealt with issues concerning the legal aspects of oil and gas property transaction agreements. Several issues regarding sales and purchase negotiations of oil and gas property are reviewed and some of the basic principles of contract law are explained. Advantages, disadvantages and opportunities of structuring oil and gas property acquisitions, as well as their tax consequences are also identified. The issue of risk assessment regarding environmental consequences and how public concerns regarding the state of the environment has had an impact on oil and gas transactions, is addressed. Interest in this topic stems from the fact that improved enforcement of existing laws regarding the environment can potentially make purchasers liable for significant costs associated with remediation or clean-up of contaminated properties. refs., tabs., figs

  13. Microstructure characterization and magnetic properties of nano structured materials

    International Nuclear Information System (INIS)

    Sun, X.C.

    2000-01-01

    The present thesis deals with the unique microstructural properties and their novel magnetic properties of core-shell Ni-Ce nano composite particles, carbon encapsulated Fe, Co, and Ni nanoparticles and the nano crystallization behavior of typical ferromagnetic Fe 78 Si 9 B 13 ribbons. These properties have intensively been investigated by high resolution transmission electron microscopy (HREM), X-ray diffraction (XRD), scanning electron microscopy (Sem), X-ray energy dispersive spectroscopy (Eds.); selected area electron diffraction pattern (SAED), Ft-IR, differential scanning calorimeter (DSC). In addition, magnetic moments measurements at different temperatures and applied fields have been performed by transmission Moessbauer spectroscopy, superconducting quantum interference device magnetometer (SQUID), and vibrating sample magnetometer (VSM). The present studies may provide the insights for the better understanding of the correlation between the unique microstructure and novel magnetic properties for several magnetic nano structured materials. (Author)

  14. Microstructure characterization and magnetic properties of nano structured materials

    Energy Technology Data Exchange (ETDEWEB)

    Sun, X.C

    2000-07-01

    The present thesis deals with the unique microstructural properties and their novel magnetic properties of core-shell Ni-Ce nano composite particles, carbon encapsulated Fe, Co, and Ni nanoparticles and the nano crystallization behavior of typical ferromagnetic Fe{sub 78}Si{sub 9}B{sub 13} ribbons. These properties have intensively been investigated by high resolution transmission electron microscopy (HREM), X-ray diffraction (XRD), scanning electron microscopy (Sem), X-ray energy dispersive spectroscopy [eds.]; selected area electron diffraction pattern (SAED), Ft-IR, differential scanning calorimeter (DSC). In addition, magnetic moments measurements at different temperatures and applied fields have been performed by transmission Moessbauer spectroscopy, superconducting quantum interference device magnetometer (SQUID), and vibrating sample magnetometer (VSM). The present studies may provide the insights for the better understanding of the correlation between the unique microstructure and novel magnetic properties for several magnetic nano structured materials. (Author)

  15. Oxidation rates of carbon and nitrogen in char residues from solid fuels

    Energy Technology Data Exchange (ETDEWEB)

    Karlstroem, O.

    2013-06-01

    Computational fluid dynamics (CFD) modeling is an important tool in designing new combustion systems. By using CFD modeling, entire combustion systems can be modeled and the emissions and the performance can be predicted. CFD modeling can also be used to develop new and better combustion systems from an economical and environmental point of view. In CFD modeling of solid fuel combustion, the combustible fuel is generally treated as single fuel particles. One of the limitations with the CFD modeling concerns the sub-models describing the combustion of single fuel particles. Available models in the scientific literature are in many cases not suitable as submodels for CFD modeling since they depend on a large number of input parameters and are computationally heavy. In this thesis CFD-applicable models are developed for the combustion of single fuel particles. The single particle models can be used to improve the combustion performance in various combustion devices or develop completely new technologies. The investigated fields are oxidation of carbon (C) and nitrogen (N) in char residues from solid fuels. Modeled char-C oxidation rates are compared to experimental oxidation rates for a large number of pulverized solid fuel chars under relevant combustion conditions. The experiments have been performed in an isothermal plug flow reactor operating at 1123-1673 K and 3-15 vol.% O{sub 2}. In the single particle model, the char oxidation is based on apparent kinetics and depends on three fuel specific parameters: apparent pre-exponential factor, apparent activation energy, and apparent reaction order. The single particle model can be incorporated as a sub-model into a CFD code. The results show that the modeled char oxidation rates are in good agreement with experimental char oxidation rates up to around 70% of burnout. Moreover, the results show that the activation energy and the reaction order can be assumed to be constant for a large number of bituminous coal chars

  16. Relation between rheological and structural properties of suspensions

    Energy Technology Data Exchange (ETDEWEB)

    Barcal, M; Sebor, G; Volsicky, Z

    1982-01-01

    The paper discusses results of investigations into separation processes for coal and kaolin suspensions. Effects of potassium chlorides and methanol additives on electrostatic potential of solid particles and on sedimentation rate are analyzed. Investigation results are shown in 5 diagrams. The relation between rheological and structural properties of coal and clay suspensions is investigated. Investigations show that the non-Newtonian behavior of suspensions cannot be attributed exclusively to the electrostatic and mechanical action of the solid phase particles. It is also caused by structure of the liquid phase, particularly on the surface of the solid particles, which depends mostly on hydrogen bonds. The internal structure of the liquid phase influences differential viscosity much more than the electrical surface properties of the solid phase. Bonds between the molecules of water and methanol are much stronger than bonds between water molecules alone. (9 refs.)

  17. Sorption of diuron, atrazine, and copper ion on chars with long-term natural oxidation in soils

    Science.gov (United States)

    Cheng, C.; Lin, T.; Lai, C.

    2011-12-01

    Biochar has been proposed as a measure to sequestrate carbon (C) and to increase soil fertility in sustainable agriculture. However, its sorption characteristics to herbicides, such as lowing herbicides efficacy, may constrain its agricultural application. This assertion may be arguable because most studies so far were conducted with the newly produced char and barely considered the "ageing effect" of old char since it could be oxidized over long time. In this study, historical char samples were collected and compared with the newly produced char. Batch sorption studies of diuron, atrazine, and copper ion onto chars was performed. Greater sorption of Cu was observed on the historical char samples and reached a saturated sorption at 30 mg g-1 for Cu, much higher adsorption value than newly produced char at 4 mg g-1. In contrast, sorption of diuron and atrazine on newly produced char had the highest sorption capacity than the historical char samples. The historical chars also had much higher negative charge than the newly produced char, but its surface area were lower than the new char. The results indicated that change in surface functional groups through natural oxidation rather than the change of surface area may have more pronounced influences on sorption characteristics, in which the negative charge on the historical chars' surface could hinder the adsorption of diuron and atrazine while enhance the sorption to copper ion. Biological assay to test the toxicity of diuron and copper ion for both historical and new chars on rye seed were conducted and will be presented in our poster.

  18. Mechanical properties and structural of metal-ceramic tungsten heterogeneity

    International Nuclear Information System (INIS)

    Gnuchev, V.S.; Zasimchuk, E.Eh.; Kas'yan, K.N.; Kravchenko, V.S.; Rabinovich, E.M.; Kharchenko, V.K.; Sheina, I.V.

    1978-01-01

    The influence of the grain size and the structure nonuniformity of cermet tungsten has been studied on its stre--ngth properties at temperatures of 500, 1000, and 1500 deg C. It has been shown that at a high temperature, the samples having a coarse-grained structure (about 50/m) preserve a high level of strength with an elevated plasticity. In the samples having the fine-grained (about 16/m) and the coarse-grained (about 114/m) structure, an abrupt decrease in the plasticity is observed along with a decrease in the strength. By investigating the influence of the annealing conditions on the structure of tungsten, the temperature range of the secondary recrystallization (about 2000 to 2200 deg C) has been established. The rolling temperature of sintered tungsten does not exceed 1700 deg C; thus a supposition is made that the structural nonuniformity of the material is attributable to the process of primary recrystallization and the amount of admixtures present

  19. Effect of coal rank and mineral matter on gasification reactivity of coal char treated at high temperature; Netsushorishita sekitan char no gas ka tokusei ni taisuru tanshu oyobi kobutsushitsu no eikyo

    Energy Technology Data Exchange (ETDEWEB)

    Morishita, K.; Takei, H.; Harano, A.; Takarada, T. [Gunma University, Gunma (Japan). Faculty of Engineering

    1996-10-28

    In the wide range from brown coal to anthracite, an investigation was made of effects of heat treatment on physical/chemical properties and of coal rank dependence. For the experiment, 12 kinds of coal samples were used, and for heat treatment, the fluidized bed heated by the electric furnace and the infrared-ray gold image furnace were used. To examine characteristics of the heat-treated coal char, conducted were oxygen gasification, TPD measurement, XRD measurement, alkali metal measurement, and pore distribution measurement. The following were obtained from the experiment. The gasification reaction rate of the char heat-treated in the temperature range between 900{degree}C to 1700{degree}C decreases with a rise of the temperature of heat treatment, and the degree of decrease in the rate depends on coal rank. The order of gasification rate between coal ranks depends on the temperature of heat treatment, and the lower the heat treatment temperature is, the more largely the gasification rate is influenced by catalysis of mineral matters included in the coal. As causes of the decrease in gasification rate associated with the rise in temperature of heat treatment, indicated were release of alkali metal having catalysis and decrease of active sites by carbonaceous crystallinity. 6 figs.

  20. Effect of sewage sledge and their bio-char on some soil qualities

    Science.gov (United States)

    Fathi, Hamed; Movahedi Naeini, Seyed Alireza; Mirzanejad, Mojan

    2015-04-01

    Bio char (BC) application as a soil amendment has achieved much interest and has been found that considerably improves soil nutrient status and crop yields on poor soils. However, information on the effect of BC on illitic soils in temperate climates is still insufficient. The primary objective in this study was to assess the influence of biochar on the soil physical properties, nutrient status and plant production. The result may also provide a reference for the use of biochars as a solution in agricultural waste management when sludge with considerable load of pathogens are involved. Soybean was already grown one year and will be repeated one more year with same treatments. The investigated soil properties included soil water content and mechanical resistance, pH, electrical conductivity (EC), calcium- acetate-lactate (CAL)-extractable P (PCAL) and K (KCAL), C, N, and nitrogen-supplying potential (NSP). The results show soil water content, potassium uptake and plant yield were increased. Heating sludge removed all pathogens and soybean yield was increased by 6%.

  1. Structural properties of the Chinese air transportation multilayer network

    International Nuclear Information System (INIS)

    Hong, Chen; Zhang, Jun; Cao, Xian-Bin; Du, Wen-Bo

    2016-01-01

    Highlights: • We investigate the structural properties of the Chinese air transportation multilayer network (ATMN). • We compare two main types of layers corresponding to major and low-cost airlines. • It is found that small-world property and rich-club effect of the Chinese ATMN are mainly caused by major airlines. - Abstract: Recently multilayer networks are attracting great attention because the properties of many real-world systems cannot be well understood without considering their different layers. In this paper, we investigate the structural properties of the Chinese air transportation multilayer network (ATMN) by progressively merging layers together, where each commercial airline (company) defines a layer. The results show that the high clustering coefficient, short characteristic path length and large collection of reachable destinations of the Chinese ATMN can only emerge when several layers are merged together. Moreover, we compare two main types of layers corresponding to major and low-cost airlines. It is found that the small-world property and the rich-club effect of the Chinese ATMN are mainly caused by those layers corresponding to major airlines. Our work will highlight a better understanding of the Chinese air transportation network.

  2. A Novel Absorbent of Nano-Fe Loaded Biomass Char and Its Enhanced Adsorption Capacity for Phosphate in Water

    Directory of Open Access Journals (Sweden)

    Hongguang Zhou

    2013-01-01

    Full Text Available A novel composite adsorbent of Fe loaded biomass char (Fe-BC was fabricated to treat phosphorus in water. Fe-BC was prepared by a procedure including metal complex anion incorporation and precipitation with the pyrolysis char of corn straw as supporting material. The abundant porous structures of the as-prepared sample can be easily observed from its scanning electron microscopy (SEM images. Observations by X-ray diffraction (XRD and X-ray photoelectron spectroscopy (XPS analyses show that inorganic nanoiron oxides deposited in the composite could be amorphous hydrous iron oxide α-FeOOH. Adsorption of phosphate onto the Fe-BC composite and its precursor (BC from aqueous solutions were investigated and discussed. The equilibrium adsorption data of phosphate was described by Langmuir and Freundlich models, and Langmuir isotherm was found to be better fitted than Freundlich isotherm. The maximum phosphate adsorption capacity for phosphate of Fe-BC was as high as 35.43 mg/g, approximately 2.3 times of BC at 25°C. The adsorption kinetics data were better fitted by pseudo-second-order model and intraparticle diffusion model, indicating that the adsorption process was complex. The Fe-BC composite has been proved as an effective adsorbent of phosphate from aqueous solutions owing to its unique porous structures and the greater Lewis basicity of the α-FeOOH.

  3. How Are Property Investment Returns Determined? : Estimating the Micro-Structure of Asset Prices, Property Income, and Discount Rates

    OpenAIRE

    Shimizu, Chihiro

    2014-01-01

    How exactly should one estimate property investment returns? Investors in property aim to maximize capital gains from price increases and income generated by the property. How are the returns on investment in property determined based on its characteristics, and what kind of market characteristics does it have? Focusing on the Tokyo commercial property market and residential property market, the purpose of this paper was to break down and measure the micro-structure of property investment ret...

  4. Relaxation Mechanisms, Structure and Properties of Semi-Coherent Interfaces

    Directory of Open Access Journals (Sweden)

    Shuai Shao

    2015-10-01

    Full Text Available In this work, using the Cu–Ni (111 semi-coherent interface as a model system, we combine atomistic simulations and defect theory to reveal the relaxation mechanisms, structure, and properties of semi-coherent interfaces. By calculating the generalized stacking fault energy (GSFE profile of the interface, two stable structures and a high-energy structure are located. During the relaxation, the regions that possess the stable structures expand and develop into coherent regions; the regions with high-energy structure shrink into the intersection of misfit dislocations (nodes. This process reduces the interface excess potential energy but increases the core energy of the misfit dislocations and nodes. The core width is dependent on the GSFE of the interface. The high-energy structure relaxes by relative rotation and dilatation between the crystals. The relative rotation is responsible for the spiral pattern at nodes. The relative dilatation is responsible for the creation of free volume at nodes, which facilitates the nodes’ structural transformation. Several node structures have been observed and analyzed. The various structures have significant impact on the plastic deformation in terms of lattice dislocation nucleation, as well as the point defect formation energies.

  5. Structural and optical properties of Si-doped Ag clusters

    KAUST Repository

    Mokkath, Junais Habeeb

    2014-03-06

    The structural and optical properties of AgN and Ag N-1Si1 (neutral, cationic, and anionic) clusters (N = 5 to 12) are systematically investigated using the density functional based tight binding method and time-dependent density functional theory, providing insight into recent experiments. The gap between the highest occupied and lowest unoccupied molecular orbitals and therefore the optical spectrum vary significantly under Si doping, which enables flexible tuning of the chemical and optical properties of Ag clusters. © 2014 American Chemical Society.

  6. The structure and properties of fluoroplastic modified with titanium nanoparticles

    Science.gov (United States)

    Baronin, G. S.; Buznik, V. M.; Dmitriev, O. S.; Zavrazhina, C. V.; Mishchenko, S. V.; Zavrazhin, D. O.; Khudyakov, V. V.

    2017-12-01

    The results of studying the structure and properties of a mixture of polytetrafluoroethylene (PTFE) and fillers, which are composites of ultrafine polytetrafluoroethylene and titanium (TiFP) nanoparticles, are presented. These composites are obtained with pyrolytic redistribution of a powdered PTFE - (NH4)2TiF6 mixture. It has been found that the composite properties depend on the type and concentration of the inorganic filler and the composite production technology. The created composites exceed the original PTFE in a number of characteristics (deflection temperature, thermal conductivity and durability).

  7. Structural and optical properties of Si-doped Ag clusters

    KAUST Repository

    Mokkath, Junais Habeeb; Schwingenschlö gl, Udo

    2014-01-01

    The structural and optical properties of AgN and Ag N-1Si1 (neutral, cationic, and anionic) clusters (N = 5 to 12) are systematically investigated using the density functional based tight binding method and time-dependent density functional theory, providing insight into recent experiments. The gap between the highest occupied and lowest unoccupied molecular orbitals and therefore the optical spectrum vary significantly under Si doping, which enables flexible tuning of the chemical and optical properties of Ag clusters. © 2014 American Chemical Society.

  8. A short review of nanographenes: structures, properties and applications

    Science.gov (United States)

    Dai, Yafei; Liu, Yi; Ding, Kai; Yang, Jinlong

    2018-04-01

    Graphene has attracted great interest in the science and technology since it was exfoliated mechanically from the graphite in 2004. Although graphene has various potential applications, its practical applications are constrained enormously by its serious drawbacks, such as zero band gap, tendency of aggregation between layers and hydrophobicity, which mainly caused by the infinite planar hexagonal structure of graphene. Considering that the structural defects in the honeycomb lattice and the edges of graphene break the infinite structure and thus change the properties, which may improve the application efficiency, nanographene (NG) is proposed and attracts extensive attention. In this work, we review the structures of multifarious well-defined NGs synthesised in recent experiments. The effects of the shape, size, edges and substituents of NGs to the properties are discussed in detail and the regulation for various properties of NG is analysed. For the well-defined NGs, including planar and non-planar ones, the challenges and perspectives of their potential applications in nonlinear optical material, gas molecular detector and gas separation material, hydrogen storage material, and hole-transporting material in perovskite solar cells are envisioned.

  9. Stochasticity in materials structure, properties, and processing—A review

    Science.gov (United States)

    Hull, Robert; Keblinski, Pawel; Lewis, Dan; Maniatty, Antoinette; Meunier, Vincent; Oberai, Assad A.; Picu, Catalin R.; Samuel, Johnson; Shephard, Mark S.; Tomozawa, Minoru; Vashishth, Deepak; Zhang, Shengbai

    2018-03-01

    We review the concept of stochasticity—i.e., unpredictable or uncontrolled fluctuations in structure, chemistry, or kinetic processes—in materials. We first define six broad classes of stochasticity: equilibrium (thermodynamic) fluctuations; structural/compositional fluctuations; kinetic fluctuations; frustration and degeneracy; imprecision in measurements; and stochasticity in modeling and simulation. In this review, we focus on the first four classes that are inherent to materials phenomena. We next develop a mathematical framework for describing materials stochasticity and then show how it can be broadly applied to these four materials-related stochastic classes. In subsequent sections, we describe structural and compositional fluctuations at small length scales that modify material properties and behavior at larger length scales; systems with engineered fluctuations, concentrating primarily on composite materials; systems in which stochasticity is developed through nucleation and kinetic phenomena; and configurations in which constraints in a given system prevent it from attaining its ground state and cause it to attain several, equally likely (degenerate) states. We next describe how stochasticity in these processes results in variations in physical properties and how these variations are then accentuated by—or amplify—stochasticity in processing and manufacturing procedures. In summary, the origins of materials stochasticity, the degree to which it can be predicted and/or controlled, and the possibility of using stochastic descriptions of materials structure, properties, and processing as a new degree of freedom in materials design are described.

  10. FLEXIBLE, HIGH CHAR YIELD HYBRIDSIL ADHESIVE MATERIALS FOR NEXT GENERATION ABLATIVE THERMAL PROTECTION SYSTEMS, Phase I

    Data.gov (United States)

    National Aeronautics and Space Administration — NanoSonic will create and empirically validate flexible, high char yield HybridSil adhesive nanocomposites for use within current and next generation polymer based...

  11. Attrition-free pyrolysis to produce bio-oil and char.

    Science.gov (United States)

    Mauviel, Guillain; Guillain, Mauviel; Kies, Fairouz; Fairouz, Kies; René, Mar Sans; Mar, Sans Rene; Ferrer, Monique; Monique, Ferrer; Lédé, Jacques; Jacques, Lédé

    2009-12-01

    Experiments are performed on a laboratory scale setup where beech wood chips are heated by gas convection and walls radiation. This study shows that it is possible to obtain high bio-oil and char yields with relatively low external heat transfer coefficients. The main advantage of this convection/radiation heat transfer mode compared to solid-solid collisions, applied in fluidized bed or twin screw reactors, is the reduction of solid attrition (char and sand). Thus tricky gas-solid separation through hot cyclones and/or hot filters could be avoided or reduced. It should be possible to recover directly bio-oil with less char particles and char free of sand dust. These qualities would allow easier use of these bio-products in different applications.

  12. Prediction of the burnout behaviour of chars derived from coal-biomass blends

    Energy Technology Data Exchange (ETDEWEB)

    Tao Wu; Mei Gong; Edward Lester [University of Nottingham, Nottingham (United Kingdom). School of Chemical, Environmental and Mining Engineering

    2007-07-01

    Nowadays, biomass has been considered an alternative fuel to coal and is being used in power plants to replace part of coal used. This study is to investigate the potential of burning biomass with coal and its impacts on burnout levels. Daw Mill coal was selected for burnout modelling together with three biomasses, Cereal, PKE and Olive Cake. Chars were prepared (75-106 micron) and characterised using image analysis methods as in input data into the char burnout model (ChB) which was adapted to allow the prediction of char burnout of biomass-coal blends under typical pf combustion conditions. The burnout performance of four blend compositions for each biomass were modelled (5%, 10%, 20% and 30%). In practice, the low heating-value of biomass produces a lower flame temperature which can lead to lower levels of char burn-out. The effect is closely linked with the type of biomass used. 36 refs., 4 figs., 1 tab.

  13. CO2 gasification of char from lignocellulosic garden waste: Experimental and kinetic study.

    Science.gov (United States)

    Gupta, Ankita; Thengane, Sonal K; Mahajani, Sanjay

    2018-04-25

    In this study, the dry leaves litter from jackfruit, raintree, mango and eucalyptus trees, lignin, and cellulose were characterized, pyrolysed, and evaluated for their char reactivity towards CO 2 gasification using TGA. The differences in char reactivity were attributed to the difference in char morphology and the varying inorganic contents. The mineral analysis of biomass ash showed the presence of alkali minerals some of which could act as catalysts. The adverse effect of high silica content was also evident through the experimental results. The kinetic parameters for gasification reaction were determined using three different reaction models. A modified random pore model was investigated to account for the influence of inorganic content. The effect of external catalyst on CO 2 gasification was also studied by adding potassium carbonate to biomass char and pellets. The results obtained from this study can be conveniently used in the design of a gasifier for lignocellulosic garden waste. Copyright © 2018 Elsevier Ltd. All rights reserved.

  14. NO formation during oxy-fuel combustion of coal and biomass chars

    DEFF Research Database (Denmark)

    Zhao, Ke; Jensen, Anker Degn; Glarborg, Peter

    2014-01-01

    The yields of NO from combustion of bituminous coal, lignite, and biomass chars were investigated in O2/N2 and O2/CO 2 atmospheres. The experiments were performed in a laboratory-scale fixed-bed reactor in the temperature range of 850-1150 °C. To minimize thermal deactivation during char preparat......The yields of NO from combustion of bituminous coal, lignite, and biomass chars were investigated in O2/N2 and O2/CO 2 atmospheres. The experiments were performed in a laboratory-scale fixed-bed reactor in the temperature range of 850-1150 °C. To minimize thermal deactivation during char...

  15. Effects of Post-Pyrolysis Air Oxidation of Biomass Chars on Adsorption of Neutral and Ionizable Compounds.

    Science.gov (United States)

    Xiao, Feng; Pignatello, Joseph J

    2016-06-21

    This study was conducted to understand the effects of thermal air oxidation of biomass chars experienced during formation or production on their adsorptive properties toward various compounds, including five neutral nonpolar and polar compounds and seven weak acids and bases (pKa = 3-5.2) selected from among industrial chemicals and the triazine and phenoxyacetic acid herbicide classes. Post-pyrolysis air oxidation (PPAO) at 400 °C of anoxically prepared wood and pecan shell chars for up to 40 min enhanced the mass-normalized adsorption at pH ∼ 7.4 of all test compounds, especially the weak acids and bases, by up to 100-fold. Both general and specific effects were identified. The general effect results from "reaming" of pores by the oxidative removal of pore wall matter and/or tarry deposits generated during the pyrolysis step. Reaming creates new surface area and enlarges nanopores, which helps relieve steric hindrance to adsorption. The specific effect results from creation of new acidic functionality that provides sites for the formation of very strong, charge-assisted hydrogen bonds (CAHB) with solutes having comparable pKa. The CAHB hypothesis was supported by competition experiments and the finding that weak acid anion adsorption increased with surface carboxyl content, despite electrostatic repulsion from the growing negative charge. The results provide insight into the effects of air oxidation on pollutant retention.

  16. Measurements of Gasification Characteristics of Coal and Char in CO2-Rich Gas Flow by TG-DTA

    Directory of Open Access Journals (Sweden)

    Zhigang Li

    2013-01-01

    Full Text Available Pyrolysis, combustion, and gasification properties of pulverized coal and char in CO2-rich gas flow were investigated by using gravimetric-differential thermal analysis (TG-DTA with changing O2%, heating temperature gradient, and flow rate of CO2-rich gases provided. Together with TG-DTA, flue gas generated from the heated coal, such as CO, CO2, and hydrocarbons (HCs, was analyzed simultaneously on the heating process. The optimum O2% in CO2-rich gas for combustion and gasification of coal or char was discussed by analyzing flue gas with changing O2 from 0 to 5%. The experimental results indicate that O2% has an especially large effect on carbon oxidation at temperature less than 1100°C, and lower O2 concentration promotes gasification reaction by producing CO gas over 1100°C in temperature. The TG-DTA results with gas analyses have presented basic reference data that show the effects of O2 concentration and heating rate on coal physical and chemical behaviors for the expected technologies on coal gasification in CO2-rich gas and oxygen combustion and underground coal gasification.

  17. Atomic structures and electronic properties of phosphorene grain boundaries

    International Nuclear Information System (INIS)

    Guo, Yu; Zhou, Si; Bai, Yizhen; Zhao, Jijun; Zhang, Junfeng

    2016-01-01

    Grain boundary (GB) is one main type of defects in two-dimensional (2D) crystals, and has significant impact on the physical properties of 2D materials. Phosphorene, a recently synthesized 2D semiconductor, possesses a puckered honeycomb lattice and outstanding electronic properties. It is very interesting to know the possible GBs present in this novel material, and how their properties differ from those in the other 2D materials. Based on first-principles calculations, we explore the atomic structure, thermodynamic stability, and electronic properties of phosphorene GBs. A total of 19 GBs are predicted and found to be energetically stable with formation energies much lower than those in graphene. These GBs do not severely affect the electronic properties of phosphorene: the band gap of perfect phosphorene is preserved, and the electron mobilities are only moderately reduced in these defective systems. Our theoretical results provide vital guidance for experimental tailoring the electronic properties of phosphorene as well as the device applications using phosphorene materials. (paper)

  18. Characterization, leachability and valorization through combustion of residual chars from gasification of coals with pine.

    Science.gov (United States)

    Galhetas, Margarida; Lopes, Helena; Freire, Márcia; Abelha, Pedro; Pinto, Filomena; Gulyurtlu, Ibrahim

    2012-04-01

    This paper presents the study of the combustion of char residues produced during co-gasification of coal with pine with the aim of characterizing them for their potential use for energy. These residues are generally rich in carbon with the presence of other elements, with particular concern for heavy metals and pollutant precursors, depending on the original fuel used. The evaluation of environmental toxicity of the char residues was performed through application of different leaching tests (EN12457-2, US EPA-1311 TCLP and EA NEN 7371:2004). The results showed that the residues present quite low toxicity for some of pollutants. However, depending on the fuel used, possible presence of other pollutants may bring environmental risks. The utilization of these char residues for energy was in this study evaluated, by burning them as a first step pre-treatment prior to landfilling. The thermo-gravimetric analysis and ash fusibility studies revealed an adequate thermochemical behavior, without presenting any major operational risks. Fluidized bed combustion was applied to char residues. Above 700°C, very high carbon conversion ratios were obtained and it seemed that the thermal oxidation of char residues was easier than that of the coals. It was found that the char tendency for releasing SO(2) during its oxidation was lower than for the parent coal, while for NO(X) emissions, the trend was observed to increase NO(X) formation. However, for both pollutants the same control techniques might be applied during char combustion, as for coal. Furthermore, the leachability of ashes resulting from the combustion of char residues appeared to be lower than those produced from direct coal combustion. Copyright © 2011 Elsevier Ltd. All rights reserved.

  19. Mixed waste treatment using the ChemChar thermolytic detoxification technique

    Energy Technology Data Exchange (ETDEWEB)

    Kuchynka, D. [Mirage Systems, Sunnyvale, CA (United States)

    1995-10-01

    The diversity of mixed waste matrices contained at Department of Energy sites that require treatment preclude a single, universal treatment technology capable of handling sludges, solids, heterogeneous debris, aqueous and organic liquids and soils. This report describes the ChemChar thermolytic detoxification process. The process is a thermal, chemically reductive technology that converts the organic portion of mixed wastes to a synthesis gas, while simultaneously absorbing volatile inorganics on a carbon-based char.

  20. Controls upon biomass losses and char production from prescribed burning on UK moorland.

    Science.gov (United States)

    Worrall, Fred; Clay, Gareth D; May, Richard

    2013-05-15

    Prescribed burning is a common management technique used across many areas of the UK uplands. However, there are few data sets that assess the loss of biomass during burning and even fewer data on the effect of burning on above-ground carbon stocks and production of char. During fire the production of char occurs which represents a transfer of carbon from the short term bio-atmospheric cycle to the longer term geological cycle. However, biomass is consumed leading to the reduction in litter formation which is the principal mechanism for peat formation. This study aims to solve the problem of whether loss of biomass during a fire is ever outweighed by the production of refractory forms of carbon during the fire. This study combines both a laboratory study of char production with an assessment of biomass loss from a series of field burns from moorland in the Peak District, UK. The laboratory results show that there are significant effects due to ambient temperature but the most important control on dry mass loss is the maximum burn temperature. Burn temperature was also found to be linearly related to the production of char in the burn products. Optimisation of dry mass loss, char production and carbon content shows that the production of char from certain fires could store more carbon in the ecosystem than if there had been no fire. Field results show that approximately 75% of the biomass and carbon were lost through combustion, a figure comparable to other studies of prescribed fire in other settings. Char-C production was approximately 2.6% of the carbon consumed during the fire. This study has shown that there are conditions (fast burns at high temperatures) under which prescribed fire may increase C sequestration through char production and that these conditions are within existing management options available to practitioners. Copyright © 2013 Elsevier Ltd. All rights reserved.

  1. Pyrolysis conditions and ozone oxidation effects on ammonia adsorption in biomass generated chars.

    Science.gov (United States)

    Kastner, James R; Miller, Joby; Das, K C

    2009-05-30

    Ammonia adsorbents were generated via pyrolysis of biomass (peanut hulls and palm oil shells) over a range of temperatures and compared to a commercially available activated carbon (AC) and solid biomass residuals (wood and poultry litter fly ash). Dynamic ammonia adsorption studies (i.e., breakthrough curves) were performed using these adsorbents at 23 degrees C from 6 to 17 ppmv NH(3). Of the biomass chars, palm oil char generated at 500 degrees C had the highest NH(3) adsorption capacity (0.70 mg/g, 6 ppmv, 10% relative humidity (RH)), was similar to the AC, and contrasted to the other adsorbents (including the AC), the NH(3) adsorption capacity significantly increased if the relative humidity was increased (4 mg/g, 7 ppmv, 73% RH). Room temperature ozone treatment of the chars and activated carbon significantly increased the NH(3) adsorption capacity (10% RH); resultant adsorption capacity, q (mg/g) increased by approximately 2, 6, and 10 times for palm oil char, peanut hull char (pyrolysis only), and activated carbon, respectively. However, water vapor (73% RH at 23 degrees C) significantly reduced NH(3) adsorption capacity in the steam and ozone treated biomass, yet had no effect on the palm shell char generated at 500 degrees C. These results indicate the feasibility of using a low temperature (and thus low energy input) pyrolysis and activation process for the generation of NH(3) adsorbents from biomass residuals.

  2. Improvement of biomass char-CO{sub 2} gasification reactivity using microwave irradiation and natural catalyst

    Energy Technology Data Exchange (ETDEWEB)

    Lahijani, Pooya, E-mail: pooya.lahijani@gmail.com [Biomass and Bioenergy Laboratory, School of Mechanical Engineering, Universiti Sains Malaysia, 14300 Nibong Tebal, Pulau Pinang (Malaysia); Mohammadi, Maedeh, E-mail: m.mohammadi@nit.ac.ir [Faculty of Chemical Engineering, Babol Noushirvani University of Technology, 47148 Babol (Iran, Islamic Republic of); Zainal, Zainal Alimuddin, E-mail: mezainal@eng.usm.my [Biomass and Bioenergy Laboratory, School of Mechanical Engineering, Universiti Sains Malaysia, 14300 Nibong Tebal, Pulau Pinang (Malaysia); Mohamed, Abdul Rahman, E-mail: chrahman@usm.my [Low Carbon Economy (LCE) Research Group, School of Chemical Engineering, Engineering Campus, Universiti Sains Malaysia, 14300 Nibong Tebal, Pulau Pinang (Malaysia)

    2015-03-20

    Highlights: • We study microwave-induced gasification of EFB ash-loaded biomass char with CO{sub 2}. • Synergistic effect of microwave and catalyst resulted in CO{sub 2} conversion of 93%. • Gasification of pristine char using conventional heating gives CO{sub 2} conversion of 58%. • E{sub a} of 74 and 247 kJ/mol were obtained for microwave and conventional CO{sub 2} gasification. - Abstract: In char-CO{sub 2} gasification, the highly endothermic nature of the Boudouard reaction (CO{sub 2} (g) + C (s) ↔ 2CO (g)) dictates use of very high temperatures to shift the equilibrium towards CO production. In this study, such high temperature (750–900 °C) was provided by microwave irradiation. A microwave heating system was developed to perform the gasification tests by passing CO{sub 2} through a packed bed of oil palm shell (OPS) char. In order to speed up the microwave-induced CO{sub 2} gasification, ash of palm empty fruit bunch (EFB) was used as natural catalyst (rich in potassium) and incorporated into the skeleton of the OPS char. The synergistic effect of microwave and catalyst concluded to very encouraging results, where a CO{sub 2} conversion of 93% was achieved at 900 °C, within 60 min microwave gasification. In comparison, CO{sub 2} conversion in thermal gasification (conventional heating) of pristine OPS char was only 58% under the same operating condition.

  3. Effect of cation exchange on the subsequent reactivity of lignite chars to steam. [108 references

    Energy Technology Data Exchange (ETDEWEB)

    Hippo, E. J.; Walker, Jr., P. L.

    1977-03-01

    The purpose of this investigation is to determine the role which cations in coal play in the subsequent reactivity of chars. It is hoped that this investigation will aid in an understanding of the catalytic nature of inorganic constituents in coal during its gasification. It was found that increased heat treatment temperature decreased reactivity. The decrease in reactivity was shown to be due, at least in part, to the changes in the nature of the cation with increased heat treatment temperature. Reactivity was found to be a linear function of the amount of Ca(++) exchange on the demineralized coal. The constant utilization factor over the wide range of loadings employed indicated that below 800/sup 0/C the calcium did not markedly sinter. Potassium, sodium, and calcium-containing chars were found to be much more reactive than the iron and magnesium-containing chars. However, the iron and magnesium containing chars were more reactive than chars produced from the demineralized coal. The iron char was highly active at first but the iron phase was quickly oxidized to a comparatively unreactive ..gamma..Fe/sub 2/O/sub 3/-Fe/sub 3/O/sub 4/ phase. The state of magnesium was found to be MgO. Sodium and calcium were equally active as catalysts but not as active as potassium.

  4. Effect of filling surface-treated pyrolytic char on resistivity of rubber films

    Directory of Open Access Journals (Sweden)

    Pattraporn Yamkaya

    2015-03-01

    Full Text Available In this research, natural rubber (NR films filled with pyrolytic tire char, carbon black N234 and N330 were compared for their electrical resistivity. The filler loading was varied to be 5, 10, 15, 20 and 25% of dry rubber content. The effect of surfactant which is 2 %w/v sodium dodecyl sulfate (SDS was also investigated. In the experiments, it was necessary to disperse the pyrolytic char in ethyl alcohol while disperse carbon black (CB in ammonium hydroxide solution prior to mixing with the rubber latex and the filled NR film was prepared by casting the mixture on a plate. It was found that increasing the amount of pyrolytic char in the NR film could lower its resistivity. The surfactant, SDS, could help better dispersion of both CB and pyrolytic char, thereby decreasing the resistivity. In a separate experiment where hexane vapor was absorbed in NR film without surfactant, in the first 30 seconds, the rate of increasing resistivity of the CB-filled film was not seen as clearly as that of pyrolytic-char-filled film. For the films with surfactant, the slow increase in resistivity of the NR films filled with N330 and pyrolytic char during adsorbing hexane vapor was observed.

  5. Oxy-fuel combustion of millimeter-sized coal char: Particle temperatures and NO formation

    DEFF Research Database (Denmark)

    Brix, Jacob; Navascués, Leyre Gómez; Nielsen, Joachim Bachmann

    2013-01-01

    In this work, differences in particle temperature and NO yield during char oxidation in O2/N2 and O2/CO2 atmospheres, respectively, have been examined. A laboratory scale fixed bed reactor, operated isothermally at 1073 K, was used for combustion of millimeter-sized lignite and bituminous coal char...... increased with mass loading, by as much as 700 K above the furnace set point. The formation of NO from lignite char was not influenced by the change from N2 to CO2 whereas the NO yield from bituminous coal char was considerably lower in O2/CO2 compared O2/N2. For both chars the conversion to NO decreased...... as the O2 concentration or the particle size increased. However, for the bituminous coal char, a peak in NO yield was observed at an intermediate particle size of 0.1–0.2 g. The differences in the effect of gas atmosphere, O2 concentration, and particle mass on the NO yield from oxidation of bituminous...

  6. Review of Differences of Steel related Properties between Proposals of European Structural Codes

    DEFF Research Database (Denmark)

    Hertz, Kristian Dahl

    Differences of Steel related Properties between fire chapters of the Proposals of European Structural Codes are indicated for the same physical properties, the right properties are found and it is proposed to use these properties in all codes.......Differences of Steel related Properties between fire chapters of the Proposals of European Structural Codes are indicated for the same physical properties, the right properties are found and it is proposed to use these properties in all codes....

  7. Structure and Electronic Properties of Cerium Orthophosphate: Theory and Experiment

    Energy Technology Data Exchange (ETDEWEB)

    Adelstein, Nicole; Mun, B. Simon; Ray, Hannah; Ross Jr, Phillip; Neaton, Jeffrey; De Jonghe, Lutgard

    2010-07-27

    Structural and electronic properties of cerium orthophosphate (CePO{sub 4}) are calculated using density functional theory (DFT) with the local spin-density approximation (LSDA+U), with and without gradient corrections (GGA-(PBE)+U), and compared to X-ray diffraction and photoemission spectroscopy measurements. The density of states is found to change significantly as the Hubbard parameter U, which is applied to the Ce 4f states, is varied from 0 to 5 eV. The calculated structural properties are in good agreement with experiment and do not change significantly with U. Choosing U = 3 eV for LDSA provides the best agreement between the calculated density of states and the experimental photoemission spectra.

  8. Structure-Property Relationship in High Tg Thermosetting Polyimides

    Science.gov (United States)

    Chuang, Kathy C.; Meador, Mary Ann B.; HardyGreen, DeNise

    2000-01-01

    This viewgraph presentation gives an overview of the structure-property relationship in high glass transition temperatures (T(sub g)) thermosetting polyimides. The objectives of this work are to replace MDA in PMR-15 with 2,2-substituted benzidine and to evaluate the thermo-oxidative stability and mechanical properties of DMBZ-15 against PMR-15. Details are given on the T(sub g) of polyimide resins, the x-ray crystal structure of 2,2-Bis(trifluoro)benzidine (BFBZ), the isothermal aging of polyimide resins at 288 C under 1 atm of circulating air, the compressive strength of polyimide composites, and a gas evaluation profile of DMBZ-15 polyimide resins.

  9. Structural and physicochemical properties of polar lipids from thermophilic archaea.

    Science.gov (United States)

    Ulrih, Natasa Poklar; Gmajner, Dejan; Raspor, Peter

    2009-08-01

    The essential general features required for lipid membranes of extremophilic archaea to fulfill biological functions are that they are in the liquid crystalline phase and have extremely low permeability of solutes that is much less temperature sensitive due to a lack of lipid-phase transition and highly branched isoprenoid chains. Many accumulated data indicate that the organism's response to extremely low pH is the opposite of that to high temperature. The high temperature adaptation does not require the tetraether lipids, while the adaptation of thermophiles to acidic environment requires the tetraether polar lipids. The presence of cyclopentane rings and the role of polar heads are not so straightforward regarding the correlations between fluidity and permeability of the lipid membrane. Due to the unique lipid structures and properties of archaeal lipids, they are a valuable resource in the development of novel biotechnological processes. This microreview focuses primarily on structural and physicochemical properties of polar lipids of (hyper)thermophilic archaea.

  10. Optical properties of a multibarrier structure under intense laser fields

    Science.gov (United States)

    Ospina, D. A.; Akimov, V.; Mora-Ramos, M. E.; Morales, A. L.; Tulupenko, V.; Duque, C. A.

    2015-11-01

    Using the diagonalization method and within the effective mass and parabolic band approximations, the energy spectrum and the wave functions are investigated in biased multibarrier structure taking into account the effects of nonresonant intense laser fields. We calculated the optical properties from the susceptibility using a nonperturbative formalism recently reported. We study the changes in the intersubband optical absorption coefficients and refraction index for several values of the dressing laser parameter and for some specific values of the electric field applied along the growth direction of the heterostructure. It is concluded from our study that the peaks in the optical absorption spectrum have redshifts or blueshifts as a function of the laser parameter and the electric field. These parameters could be suitable tools for tuning the electronic and optical properties of the multibarrier structure.

  11. Correlated structure-optical properties studies of plasmonic nanoparticles

    International Nuclear Information System (INIS)

    Ringe, Emilie; Duyne, Richard P Van; Marks, Laurence D

    2014-01-01

    Interest in nanotechnology is driven by unprecedented means to tailor the physical behaviour via structure and composition. Unlike bulk materials, minute changes in size and shape can affect the optical properties of nanoparticles. Characterization, understanding, and prediction of such structure-function relationships is crucial to the development of novel applications such as plasmonic sensors, devices, and drug delivery systems. Such knowledge has been recently vastly expanded through systematic, high throughput correlated measurements, where the localized surface plasmon resonance (LSPR) is probed optically and the particle shape investigated with electron microscopy. This paper will address some of the recent experimental advances in single particle studies that provide new insight not only on the effects of size, composition, and shape on plasmonic properties but also their interrelation. Plasmon resonance frequency and decay, substrate effects, size, shape, and composition will be explored for a variety of plasmonic systems

  12. Identification of material properties of sandwich structure with piezoelectric patches

    Directory of Open Access Journals (Sweden)

    Zemčík R.

    2008-11-01

    Full Text Available The work focuses on light-weight sandwich structures made of carbon-epoxy skins and foam core which have unique bending stiffness compared to conventional materials. The skins are manufactured by vacuum autoclave technology from unidirectional prepregs and the sandwich is then glued together. The resulting material properties of the structure usually differ from those provided by manufacturer or even those obtained from experimental tests on separate materials, which makes computational models unreliable. Therefore, the properties are identified using the combination of experimental analysis of the sandwich with attached piezoelectric transducer and corresponding static and modal finite element analyses. Simple mathematical optimization with repetitive finite element solution is used. The model is then verified by transient analysis when the piezoelectric patch is excited by harmonic signals covering the first two eigen-frequencies and the induced oscillations are measured by laser sensor.

  13. Mechanical properties of Composite Engineering Structures by Multivolume Micromechanical Modelling

    Directory of Open Access Journals (Sweden)

    B. Novotný

    2000-01-01

    Full Text Available Engineering structures often consist of elements having the character of a periodically repeated composite structure. A multivolume micromechanical model based on a representative cell division into r1 × r2 × r3 subcells with different elastic material properties has been used in this paper to derive macromechanical characteristics of the composite construction response to applied load and temperature changes. The multivolume method is based on ensuring the equilibrium of the considered volume on an average basis. In the same (average way, the continuity conditions of displacements and tractions at the interfaces between subcells and between neighboring representative elements are imposed, resulting in a homogenization procedure that eliminates the discrete nature of the composite model. The details of the method are shown for the case of a concrete block pavement. A parametric study is presented illustrating the influence of joint thickness, joint filling material properties and the quality of bonding between block and filler elements.

  14. Structural, optical and thermal properties of nanoporous aluminum

    International Nuclear Information System (INIS)

    Ghrib, Taher

    2015-01-01

    Highlights: • A simple electrochemical technique is presented and used to manufacture a porous aluminum layer. • Manufactured pores of 40 nm diameter and 200 nm depth are filled by nanocrystal of silicon and graphite. • Dimensions of pores increase with the anodization current which ameliorate the optical and thermal properties. • A new thermal method is presented which permit to determine the pores density and the layer thickness. • All properties show that the manufactured material can be used with success in solar cells. - Abstract: In this work the structural, thermal and optical properties of porous aluminum thin film formed with various intensities of anodization current in sulfuric acid are highlighted. The obtained pores at the surface are filled by sprayed graphite and nanocrystalline silicon (nc-Si) thin films deposited by plasma enhancement chemical vapor deposition (PECVD) which the role is to improve its optical and thermal absorption giving a structure of an assembly of three different media such as deposited thin layer (graphite or silicon)/(porous aluminum layer filled with the deposited layer)/(Al sample). The effect of anodization current on the microstructure of porous aluminum and the effect of the deposited layer were systematically studied by atomic force microscopy (AFM), transmission electron microscopy (TEM) and Raman spectroscopy. The thermal properties such as the thermal conductivity (K) and thermal diffusivity (D) are determined by the photothermal deflection (PTD) technique which is a non destructive technique. Based on this full characterization, it is demonstrated that the thermal and optical characteristics of these films are directly correlated to their micro-structural properties

  15. Co-gasification of tire and biomass for enhancement of tire-char reactivity in CO2 gasification process.

    Science.gov (United States)

    Lahijani, Pooya; Zainal, Zainal Alimuddin; Mohamed, Abdul Rahman; Mohammadi, Maedeh

    2013-06-01

    In this investigation, palm empty fruit bunch (EFB) and almond shell (AS) were implemented as two natural catalysts rich in alkali metals, especially potassium, to enhance the reactivity of tire-char through co-gasification process. Co-gasification experiments were conducted at several blending ratios using isothermal Thermogravimetric analysis (TGA) under CO2. The pronounced effect of inherent alkali content of biomass-chars on promoting the reactivity of tire-char was proven when acid-treated biomass-chars did not exert any catalytic effect on improving the reactivity of tire-char in co-gasification experiments. In kinetic studies of the co-gasified samples in chemically-controlled regime, modified random pore model (M-RPM) was adopted to describe the reactive behavior of the tire-char/biomass-char blends. By virtue of the catalytic effect of biomass, the activation energy for tire-char gasification was lowered from 250 kJ/mol in pure form 203 to 187 kJ/mol for AS-char and EFB-char co-gasified samples, respectively. Copyright © 2013 Elsevier Ltd. All rights reserved.

  16. Bioinspired Cellular Structures: Additive Manufacturing and Mechanical Properties

    Science.gov (United States)

    Stampfl, J.; Pettermann, H. E.; Liska, R.

    Biological materials (e.g., wood, trabecular bone, marine skeletons) rely heavily on the use of cellular architecture, which provides several advantages. (1) The resulting structures can bear the variety of "real life" load spectra using a minimum of a given bulk material, featuring engineering lightweight design principles. (2) The inside of the structures is accessible to body fluids which deliver the required nutrients. (3) Furthermore, cellular architectures can grow organically by adding or removing individual struts or by changing the shape of the constituting elements. All these facts make the use of cellular architectures a reasonable choice for nature. Using additive manufacturing technologies (AMT), it is now possible to fabricate such structures for applications in engineering and biomedicine. In this chapter, we present methods that allow the 3D computational analysis of the mechanical properties of cellular structures with open porosity. Various different cellular architectures including disorder are studied. In order to quantify the influence of architecture, the apparent density is always kept constant. Furthermore, it is shown that how new advanced photopolymers can be used to tailor the mechanical and functional properties of the fabricated structures.

  17. Electronic structure properties of UO2 as a Mott insulator

    Science.gov (United States)

    Sheykhi, Samira; Payami, Mahmoud

    2018-06-01

    In this work using the density functional theory (DFT), we have studied the structural, electronic and magnetic properties of uranium dioxide with antiferromagnetic 1k-, 2k-, and 3k-order structures. Ordinary approximations in DFT, such as the local density approximation (LDA) or generalized gradient approximation (GGA), usually predict incorrect metallic behaviors for this strongly correlated electron system. Using Hubbard term correction for f-electrons, LDA+U method, as well as using the screened Heyd-Scuseria-Ernzerhof (HSE) hybrid functional for the exchange-correlation (XC), we have obtained the correct ground-state behavior as an insulator, with band gaps in good agreement with experiment.

  18. Field emission properties of an array of pyramidal structures

    Energy Technology Data Exchange (ETDEWEB)

    De Assis, Thiago A [Departamento de QuImica, Universidad Autonoma de Madrid, Cantoblanco, 28049 Madrid (Spain); Borondo, F [Departamento de QuImica, Instituto Mixto de Ciencias Matematicas CSIC-UAM-UC3M-UCM, Universidad Autonoma de Madrid, Cantoblanco, 28049 Madrid (Spain); De Castilho, C M C; Brito Mota, F [Grupo de Fisica de SuperfIcies e Materiais, Instituto de Fisica, Universidade Federal da Bahia, Campus Universitario da Federacao, 40210-340, Salvador, BA (Brazil); Benito, R M, E-mail: t.albuquerque@uam.e, E-mail: f.borondo@uam.e, E-mail: caio@ufba.b, E-mail: fbmota@ufba.b, E-mail: rosamaria.benito@upm.e [Grupo de Sistemas Complejos, Departamento de Fisica y Mecanica, Escuela Tecnica Superior de Ingenieros Agronomos, Universidad Politecnica de Madrid, Ciudad Universitaria, 28040 Madrid (Spain)

    2009-10-07

    The properties and efficiency of the emission current density produced by a metallic array of pyramidal structures are investigated. The theoretical results obtained by numerical integration of the corresponding Laplace equation using a finite differences scheme offer useful information for the optimization of field emission devices based on cathodes with this geometry. Our study shows that the inter-pyramidal distance strongly affects the current density, and even more important for this issue is the protrusion characteristics of these structures. Another relevant, although less important, parameter determining this density is the anode-cathode distance. The effect of the array characteristics on the maximum local electric field intensity is also discussed.

  19. Electric Field Structures in Thin Films: Formation and Properties

    DEFF Research Database (Denmark)

    Cassidy, Andrew; Plekan, Oksana; Balog, Richard

    2014-01-01

    A newly discovered class of molecular materials, so-called “spontelectrics”, display spontaneous electric fields. Here we show that the novel properties of spontelectrics can be used to create composite spontelectrics, illustrating how electric fields in solid films may be structured on the nanoscale...... by combining layers of different spontelectric materials. This is demonstrated using the spontelectric materials nitrous oxide, toluene, isoprene, isopentane, and CF2Cl2. These yield a variety of tailored electric field structures, with individual layers harboring fields between 107 and 108 V/m. Fields may...

  20. Metal Oxide Nano structures: Synthesis, Properties, and Applications

    International Nuclear Information System (INIS)

    Xu, L. H.; Patil, D. S.; Yang, J.; Xiao, J.

    2015-01-01

    In recent years, nano structured materials have attracted wide attention due to their fascinating optical and electrical properties, which make these materials potentially suitable for applications in electronics, optics, photonics, and sensors. Some metal oxides show a wide variety of morphologies such as nano wires, nano rods, nano tubes, nano rings, and nano belts. Synthesis and investigation of these metal-oxide nano structures are beneficial not only for understanding the fundamental phenomena in low dimensional systems, but also for developing new-generation nano devices with high performance.

  1. Structure and mechanical properties of the irradiated silicon

    International Nuclear Information System (INIS)

    Kalanov, M.U.; Khamraeva, R.N.; Ummatov, Kh.D.; Khajdarov, T.Kh.; Rustamova, V.M.

    2001-01-01

    In this work the results of study for radiation influence on phase content and mechanical properties of mono- and polycrystalline silicon are presented. Samples were irradiated at room temperature for 10 hours by X-quanta with mean energy 35 keV. Structural measurements were carried out on the DRON-UM1 with CuK α =1.542 Angstrom. Crystal internal friction was measurement by the ultrasonic resonance method at frequency 39 k Hz. Structure examinations show the impurity phase presence in the crystalline quartz form in the initial silicon mono- and polycrystals

  2. Electronic structure and optical properties of solid C60

    International Nuclear Information System (INIS)

    Mattesini, M.; Ahuja, R.; Sa, L.; Hugosson, H.W.; Johansson, B.; Eriksson, O.

    2009-01-01

    The electronic structure and the optical properties of face-centered-cubic C 60 have been investigated by using an all-electron full-potential method. Our ab initio results show that the imaginary dielectric function for high-energy values looks very similar to that of graphite, revealing close electronic structure similarities between the two systems. We have also identified the origin of different peaks in the dielectric function of fullerene by means of the calculated electronic density of states. The computed optical spectrum compares fairly well with the available experimental data for the Vis-UV absorption spectrum of solid C 60 .

  3. RaptorX-Property: a web server for protein structure property prediction.

    Science.gov (United States)

    Wang, Sheng; Li, Wei; Liu, Shiwang; Xu, Jinbo

    2016-07-08

    RaptorX Property (http://raptorx2.uchicago.edu/StructurePropertyPred/predict/) is a web server predicting structure property of a protein sequence without using any templates. It outperforms other servers, especially for proteins without close homologs in PDB or with very sparse sequence profile (i.e. carries little evolutionary information). This server employs a powerful in-house deep learning model DeepCNF (Deep Convolutional Neural Fields) to predict secondary structure (SS), solvent accessibility (ACC) and disorder regions (DISO). DeepCNF not only models complex sequence-structure relationship by a deep hierarchical architecture, but also interdependency between adjacent property labels. Our experimental results show that, tested on CASP10, CASP11 and the other benchmarks, this server can obtain ∼84% Q3 accuracy for 3-state SS, ∼72% Q8 accuracy for 8-state SS, ∼66% Q3 accuracy for 3-state solvent accessibility, and ∼0.89 area under the ROC curve (AUC) for disorder prediction. © The Author(s) 2016. Published by Oxford University Press on behalf of Nucleic Acids Research.

  4. Structural properties of silicon clusters: An empirical potential study

    International Nuclear Information System (INIS)

    Gong, X.G.; Zheng, Q.Q.; He Yizhen

    1993-09-01

    By using our newly proposed empirical interatomic potential for silicon, the structure and some dynamical properties of silicon cluster Si n (10 ≤ n ≤ 24) have been studied. It is found that the obtained results are close to those from ab-initio methods. From present results, we can gain a new insight into the understanding of the experimental data on the Si n clusters. (author). 20 refs, 6 figs

  5. Structural and electronic properties of hydrosilylated silicon surfaces

    Energy Technology Data Exchange (ETDEWEB)

    Baumer, A.

    2005-11-15

    The structural and electronic properties of alkyl-terminated Si surfaces prepared by thermallyinduced hydrosilylation have been studied in detail in the preceding chapters. Various surfaces have been used for the functionalization ranging from crystalline Si over amorphous hydrogenated Si to nanoscaled materials such as Si nanowires and nanoparticles. In each case, the alkyl-terminated surfaces have been compared to the native oxidized and H-terminated surfaces. (orig.)

  6. Emergent intelligent properties of progressively structured pattern recognition nets

    Energy Technology Data Exchange (ETDEWEB)

    Aleksander, I

    1983-07-01

    The n-tuple recognition net is seen as a building brick of a progression of network structures. The emergent intelligent properties of such systems are discussed. They include the amplification of confidence for the recognition of images that differ in small detail, a short term memory of the last seen image, sequence sensitivity, sequence sensitivity, sequence acceptance and saccadic inspection as an aid in scene analysis. 12 references.

  7. Negative binomial properties and clan structure in multiplicity distributions

    International Nuclear Information System (INIS)

    Giovannini, A.; Van Hove, L.

    1988-01-01

    We review the negative binomial properties measured recently for many multiplicity distributions of high energy hadronic, semi-leptonic reactions in selected rapidity intervals. We analyse them in terms of the ''clan'' structure which can be defined for any negative binomial distribution. By comparing reactions we exhibit a number of regularities for the average number N-bar of clans and the average charged multiplicity (n-bar) c per clan. 22 refs., 6 figs. (author)

  8. Material Properties Analysis of Structural Members in Pumpkin Balloons

    Science.gov (United States)

    Sterling, W. J.

    2003-01-01

    The efficient design, service-life qualification, and reliability predictions for lightweight aerospace structures require careful mechanical properties analysis of candidate structural materials. The demand for high-quality laboratory data is particularly acute when the candidate material or the structural design has little history. The pumpkin-shaped super-pressure balloon presents both challenges. Its design utilizes load members (tendons) extending from apex to base around the gas envelope to achieve a lightweight structure. The candidate tendon material is highly weight-efficient braided HM cord. Previous mechanical properties studies of Zylon have focused on fiber and yarn, and industrial use of the material in tensile applications is limited. For high-performance polymers, a carefully plamed and executed properties analysis scheme is required to ensure the data are relevant to the desired application. Because no directly-applicable testing standard was available, a protocol was developed based on guidelines fiom professional and industry organizations. Due to the liquid-crystalline nature of the polymer, the cord is very stiff, creeps very little, and does not yield. Therefore, the key material property for this application is the breaking strength. The pretension load and gauge length were found to have negligible effect on the measured breaking strength over the ranges investigated. Strain rate was found to have no effect on breaking strength, within the range of rates suggested by the standards organizations. However, at the lower rate more similar to ULDB operations, the strength was reduced. The breaking strength increased when the experiment temperature was decreased from ambient to 183K which is the lowest temperature ULDB is expected to experience. The measured strength under all test conditions was well below that resulting from direct scale-up of fiber strength based on the manufacturers data. This expected result is due to the effects of the

  9. Liposomes: structure, properties and methods of curative administration in organism

    Directory of Open Access Journals (Sweden)

    M. A. Kisyakova

    2010-07-01

    Full Text Available A review of data from scientific sources, devoted to problems of liposomes’ structure, properties and processes of formation was made. Advantages of liposomes used for medical purposes are shown. Methods of liposomes administration in an organism are characterised. Data on mechanisms of interaction between liposomes and cells, peculiarities of liposomes’ lipids composition and dependence of its tropism to definite organs and tissues are generalised.

  10. Structure/property relationships in multipass GMA welding of beryllium.

    Energy Technology Data Exchange (ETDEWEB)

    Hochanadel, P. W. (Patrick W.); Hults, W. L. (William L.); Thoma, D. J. (Dan J.); Dave, V. R. (Vivek R.); Kelly, A. M. (Anna Marie); Pappin, P. A. (Pallas A.); Cola, M. J. (Mark J.); Burgardt, P. (Paul)

    2001-01-01

    Beryllium is an interesting metal that has a strength to weight ratio six times that of steel. Because of its unique mechanical properties, beryllium is used in aerospace applications such as satellites. In addition, beryllium is also used in x-ray windows because it is nearly transparent to x-rays. Joining of beryllium has been studied for decades (Ref.l). Typically joining processes include braze-welding (either with gas tungsten arc or gas metal arc), soldering, brazing, and electron beam welding. Cracking which resulted from electron beam welding was recently studied to provide structure/property relationships in autogenous welds (Ref. 2). Braze-welding utilizes a welding arc to melt filler, and only a small amount of base metal is melted and incorporated into the weld pool. Very little has been done to characterize the braze-weld in terms of the structure/property relationships, especially with reference to multipass welding. Thus, this investigation was undertaken to evaluate the effects of multiple passes on microstructure, weld metal composition, and resulting material properties for beryllium welded with aluminum-silicon filler metal.

  11. (Biodegradable Ionomeric Polyurethanes Based on Xanthan: Synthesis, Properties, and Structure

    Directory of Open Access Journals (Sweden)

    T. V. Travinskaya

    2017-01-01

    Full Text Available New (biodegradable environmentally friendly film-forming ionomeric polyurethanes (IPU based on renewable biotechnological polysaccharide xanthan (Xa have been obtained. The influence of the component composition on the colloidal-chemical and physic-mechanical properties of IPU/Xa and based films, as well as the change of their properties under the influence of environmental factors, have been studied. The results of IR-, PMS-, DMA-, and X-ray scattering study indicate that incorporation of Xa into the polyurethane chain initiates the formation of a new polymer structure different from the structure of the pure IPU (matrix: an amorphous polymer-polymer microdomain has occurred as a result of the chemical interaction of Xa and IPU. It predetermines the degradation of the IPU/Xa films as a whole, unlike the mixed polymer systems, and plays a key role in the improvement of material performance. The results of acid, alkaline hydrolysis, and incubation into the soil indicate the increase of the intensity of degradation processes occurring in the IPU/Xa in comparison with the pure IPU. It has been shown that the introduction of Xa not only imparts the biodegradability property to polyurethane, but also improves the mechanical properties.

  12. Sustainable pyrolytic sludge-char preparation on improvement of closed-loop sewage sludge treatment: Characterization and combined in-situ application.

    Science.gov (United States)

    Jin, Zhengyu; Chang, Fengmin; Meng, Fanlin; Wang, Cuiping; Meng, Yao; Liu, Xiaoji; Wu, Jing; Zuo, Jiane; Wang, Kaijun

    2017-10-01

    Aiming at closed-loop sustainable sewage sludge treatment, an optimal and economical pyrolytic temperature was found at 400-450 °C considering its pyrolysis efficiency of 65%, fast cracking of hydrocarbons, proteins and lipids and development of aromatized porous structure. Fourier-transform infrared (FTIR) and X-ray diffraction (XRD) tests demonstrated the development of adsorptive functional groups and crystallographic phases of adsorptive minerals. The optimal sludge-char, with a medium specific surface area of 39.6 m 2  g -1 and an iodine number of 327 mgI 2 g -1 , performed low heavy metals lixiviation. The application of sludge-char in raw sewage could remove 30% of soluble chemical oxygen demand (SCOD), along with an acetic acid adsorption capacity of 18.0 mg g -1 . The developed mesopore and/or macropore structures, containing rich acidic and basic functional groups, led to good biofilm matrices for enhanced microbial activities and improved autotrophic nitrification in anoxic stage of an A/O reactor through adsorbed extra carbon source, and hence achieved the total nitrogen (TN) removal up to 50.3%. It is demonstrated that the closed-loop sewage sludge treatment that incorporates pyrolytic sludge-char into in-situ biological sewage treatment can be a promising sustainable strategy by further optimization. Copyright © 2017 Elsevier Ltd. All rights reserved.

  13. Structure and properties of cell membranes. Volume 3: Methodology and properties of membranes

    International Nuclear Information System (INIS)

    Benga, G.

    1985-01-01

    This book covers the topics: Quantum chemical approach to study the mechanisms of proton translocation across membranes through protein molecules; monomolecular films as biomembrane models; planar lipid bilayers in relation to biomembranes; relation of liposomes to cell membranes; reconstitution of membrane transport systems; structure-function relationships in cell membranes as revealed by X-ray techniques; structure-function relationships in cell membranes as revealed by spin labeling ESR; structure and dynamics of cell membranes as revealed by NMR techniques; the effect of dietary lipids on the composition and properties of biological membranes and index

  14. Materials science in microelectronics II the effects of structure on properties in thin films

    CERN Document Server

    Machlin, Eugene

    2005-01-01

    The subject matter of thin-films - which play a key role in microelectronics - divides naturally into two headings: the processing / structure relationship, and the structure / properties relationship. Part II of 'Materials Science in Microelectronics' focuses on the latter of these relationships, examining the effect of structure on the following: Electrical properties Magnetic properties Optical properties Mechanical properties Mass transport properties Interface and junction properties Defects and properties Captures the importance of thin films to microelectronic development Examines the cause / effect relationship of structure on thin film properties.

  15. Study on denitration technology of coal char reduction method

    Directory of Open Access Journals (Sweden)

    Wenjie FU

    2016-06-01

    Full Text Available In order to more effectively control NO emissions in coal-fired flue gas, the denitration reaction is carried out with simulated industrial boiler flue gas in a fixed bed reactor. The influence of char types, reaction conditions, the composition of flue gas and other factors on the conversion rate of NO are discussed. The result shows that the industrial semi-coke is the most suitable experimental coal in the three coals studied, and the industrial semi-coke particle size of 0.6 ~ 10 mm is relatively suitable; The conversion rate of NO increases gradually with the increase of temperature, and when the reaction temperature is 700 ℃ and the space velocity is 10 000 h-1, the conversion rate of NO can reach 99%; the conversion rate of NO decreases gradually as airspeed increases, but the airspeed change has no effect on the conversion rate of NO at 700 ℃; under anaerobic conditions,the change of NO concentration has no effect on the conversion rate of NO; at the same temperature, NO conversion rate is higher at the presence of oxygen compared with that at anaerobic situation, and the conversion rate of NO is the highest when O2 concentration is 4%; under aerobic conditions, the concentration change of SO2 and CO2 has no effect on the conversion rate of NO.

  16. Mechanical properties of LMR structural materials at high temperature

    International Nuclear Information System (INIS)

    Kim, D. W.; Kuk, I. H.; Ryu, W. S. and others

    1999-03-01

    Austenitic stainless is used for the structural material of liquid metal reactor (LMR) because of good mechanical properties at high temperature. Stainless steel having more resistant to temperature by adding minor element has been developing for operating the LMR at higher temperature. Of many elements, nitrogen is a prospective element to modify type 316L(N) stainless steel because nitrogen is the most effective element for solid solution and because nitrogen retards the precipitation of carbide at grain boundary. Ti, Nb, and V are added to improve creep properties by stabilizing the carbides through forming MC carbide. Testing techniques of tensile, fatigue, creep, and creep-fatigue at high temperature are difficult. Moreover, testing times for creep and creep-fatigue tests are very long up to several tens of thousands hours because creep and creep-fatigue phenomena are time-dependent damage mechanism. So, it is hard to acquire the material data for designing LMR systems during a limited time. In addition, the integrity of LMR structural materials at the end of LMR life has to be predicted from the laboratory data tested during the short term because there is no data tested during 40 years. Therefore, the effect of elements on mechanical properties at high temperature was reviewed in this study and many methods to predict the long-term behaviors of structural materials by simulated modelling equation is shown in this report. (author). 32 refs., 9 tabs., 38 figs

  17. Food structure: Its formation and relationships with other properties.

    Science.gov (United States)

    Joardder, Mohammad U H; Kumar, Chandan; Karim, M A

    2017-04-13

    Food materials are complex in nature as it has heterogeneous, amorphous, hygroscopic and porous properties. During processing, microstructure of food materials changes which significantly affects other properties of food. An appropriate understanding of the microstructure of the raw food material and its evolution during processing is critical in order to understand and accurately describe dehydration processes and quality anticipation. This review critically assesses the factors that influence the modification of microstructure in the course of drying of fruits and vegetables. The effect of simultaneous heat and mass transfer on microstructure in various drying methods is investigated. Effects of changes in microstructure on other functional properties of dried foods are discussed. After an extensive review of the literature, it is found that development of food structure significantly depends on fresh food properties and process parameters. Also, modification of microstructure influences the other properties of final product. An enhanced understanding of the relationships between food microstructure, drying process parameters and final product quality will facilitate the energy efficient optimum design of the food processor in order to achieve high-quality food.

  18. Composite Polymer Electrolytes: Nanoparticles Affect Structure and Properties

    Directory of Open Access Journals (Sweden)

    Wei Wang

    2016-11-01

    Full Text Available Composite polymer electrolytes (CPEs can significantly improve the performance in electrochemical devices such as lithium-ion batteries. This review summarizes property/performance relationships in the case where nanoparticles are introduced to polymer electrolytes. It is the aim of this review to provide a knowledge network that elucidates the role of nano-additives in the CPEs. Central to the discussion is the impact on the CPE performance of properties such as crystalline/amorphous structure, dielectric behavior, and interactions within the CPE. The amorphous domains of semi-crystalline polymer facilitate the ion transport, while an enhanced mobility of polymer chains contributes to high ionic conductivity. Dielectric properties reflect the relaxation behavior of polymer chains as an important factor in ion conduction. Further, the dielectric constant (ε determines the capability of the polymer to dissolve salt. The atom/ion/nanoparticle interactions within CPEs suggest ways to enhance the CPE conductivity by generating more free lithium ions. Certain properties can be improved simultaneously by nanoparticle addition in order to optimize the overall performance of the electrolyte. The effects of nano-additives on thermal and mechanical properties of CPEs are also presented in order to evaluate the electrolyte competence for lithium-ion battery applications.

  19. The thermal and mechanical properties of a low-density glass-fiber-reinforced elastomeric ablation material

    Science.gov (United States)

    Engelke, W. T.; Robertson, R. W.; Bush, A. L.; Pears, C. D.

    1974-01-01

    An evaluation of the thermal and mechanical properties was performed on a molded low-density elastomeric ablation material designated as Material B. Both the virgin and charred states were examined to provide meaningful inputs to the design of a thermal protection system. Chars representative of the flight chars formed during ablation were prepared in a laboratory furnace from 600 K to 1700 K and properties of effective thermal conductivity, heat capacity, porosity and permeability were determined on the furnace chars formed at various temperature levels within the range. This provided a boxing of the data which will enable the prediction of the transient response of the material during flight ablation.

  20. Energetic assessment of air-steam gasification of sewage sludge and of the integration of sewage sludge pyrolysis and air-steam gasification of char

    International Nuclear Information System (INIS)

    Gil-Lalaguna, N.; Sánchez, J.L.; Murillo, M.B.; Atienza-Martínez, M.; Gea, G.

    2014-01-01

    Thermo-chemical treatment of sewage sludge is an interesting option for recovering energy and/or valuable products from this waste. This work presents an energetic assessment of pyrolysis and gasification of sewage sludge, also considering the prior sewage sludge thermal drying and the gasification of the char derived from the pyrolysis stage. Experimental data obtained from pyrolysis of sewage sludge, gasification of sewage sludge and gasification of char (all of these performed in a lab-scale fluidized reactor) were used for the energetic calculations. The results show that the energy contained in the product gases from pyrolysis and char gasification is not enough to cover the high energy consumption for thermal drying of sewage sludge. Additional energy could be obtained from the calorific value of the pyrolysis liquid, but some of its properties must be improved facing towards its use as fuel. On the other hand, the energy contained in the product gas of sewage sludge gasification is enough to cover the energy demand for both the sewage sludge thermal drying and the gasification process itself. Furthermore, a theoretical study included in this work shows that the gasification efficiency is improved when the chemical equilibrium is reached in the process. - Highlights: • 4 MJ kg −1 for thermal drying of sewage sludge (SS) from 65 to 6.5 wt.% of moisture. • 0.15 MJ kg −1 for thermal decomposition of sewage sludge during fast pyrolysis. • Not enough energy in gases from SS pyrolysis and char gasification for thermal drying. • Enough energy in SS gasification gas for thermal drying and gasification process. • Gasification efficiency improves when equilibrium is reached in the process

  1. Structure and optical properties of water covered Cu(110) surfaces

    International Nuclear Information System (INIS)

    Baghbanpourasl, A.

    2014-01-01

    In this thesis structural and optical properties of the water covered Cu(110) surface is studied using density functional theory within independent particle approximation. Several stable adsorption structures are studied such as water clusters (monomer, dimer, trimer, tetramer and pentamer), different hexagonal monolayers, partially dissociated water monolayers and three different types of chains among them a chain that consists of pentagon rings. For a copper surface in contact with water vapor, the energetically stable H 2 O/OH adsorbed structures are compared thermodynamically using adsorption free energy (change of free energy due to adsorption). Several phase diagrams with respect to temperature and pressure are calculated. It is found that among the large number of energetically stable structures (i.e. structures with positive adsorption energy ) only limited number of them are thermodynamically stable. These thermodynamically stable structures are the class of almost energetically degenerate hexagonal overlayers, one type of partially dissociated water structure that contains Bjerrum defect in the hydrogen bond network and pentagon chain. Since hydrogen atoms are light weight their vibrational effects can be considerable. Zero point vibration decreases the adsorption energy up to 0.1 eV and free energy of adsorbed molecules arising from vibrational degree of freedom can go up to -0.2 eV per adsorbed molecule at 500 Kelvin. However zero point energy and vibrational free energy of adsorbed molecules do not alter relative stability of the adsorbed structures. To account for the long range van der Waals interactions, a semi-empirical scheme is applied. Reflectance Anisotropy Spectroscopy (RAS) is a fast and non destructive optical method that can be used to prob the surface in different conditions such as vacuum and electro-chemical environment. Elasto-optic coeficients of bulk are calculated from first principles and the change of the RA spectrum of the bare Cu

  2. Research on working property and early age mechanical property of self-compacting concrete used in steel-concrete structure

    International Nuclear Information System (INIS)

    Zhao Yongguang

    2013-01-01

    Background: Self-compacting concrete that has good working property is the prerequisite of steel-concrete structure. The early age mechanical property of self-compacting concrete is the important parameter when design steel-concrete structure. Purpose: This paper attempts to research the working property and early age mechanical property of self-compacting concrete. Methods: Test is used to research the working property and early age mechanical property of self-compacting concrete. Results: Self-compacting concrete that could meet the requirement of steel-concrete structure has been mixed and parameters of early age mechanical property of self-compacting concrete which is necessary for design of steel-concrete structure have been presented. Conclusions: Base on the results, this paper can guide the construction of self-compacting concrete in steel-concrete structure and the design and construction of steel-concrete structure. (author)

  3. Structure and properties of copper after large strain deformation

    Energy Technology Data Exchange (ETDEWEB)

    Rodak, Kinga; Molak, Rafal M.; Pakiela, Zbigniew

    2010-05-15

    Structure and properties of Cu in dependence on strain (from {epsilon}{proportional_to} 0.9 to {epsilon}{proportional_to} 15) during multi-axial compression processing at room temperature was investigated. The evolution of dislocation structure, misorientation distribution and crystallite size were observed by using transmission electron microscopy (TEM) and scanning electron microscopy (SEM) equipment with electron back scattered diffraction (EBSD) facility. The mechanical properties of yield strength (YS), ultimate tensile strength (UTS) and uniform elongation was performed on MTS QTest/10 machine equipped with digital image correlation method (DIC). The structure-flow stress relationship of multi-axial compression processing material at strains {epsilon}{proportional_to} 3.5 and {epsilon}{proportional_to} 5.5 is discussed. It is found that processing does not produce any drastic changes in deformation structure and the microstructural refinement is slow. These results indicate that dynamic recrystallization plays an important role during multi-axial compression process in this range of deformation (copyright 2010 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  4. Circulating Microparticles Alter Formation, Structure, and Properties of Fibrin Clots.

    Science.gov (United States)

    Zubairova, Laily D; Nabiullina, Roza M; Nagaswami, Chandrasekaran; Zuev, Yuriy F; Mustafin, Ilshat G; Litvinov, Rustem I; Weisel, John W

    2015-12-04

    Despite the importance of circulating microparticles in haemostasis and thrombosis, there is limited evidence for potential causative effects of naturally produced cell-derived microparticles on fibrin clot formation and its properties. We studied the significance of blood microparticles for fibrin formation, structure, and susceptibility to fibrinolysis by removing them from platelet-free plasma using filtration. Clots made in platelet-free and microparticle-depleted plasma samples from the same healthy donors were analyzed in parallel. Microparticles accelerate fibrin polymerisation and support formation of more compact clots that resist internal and external fibrinolysis. These variations correlate with faster thrombin generation, suggesting thrombin-mediated kinetic effects of microparticles on fibrin formation, structure, and properties. In addition, clots formed in the presence of microparticles, unlike clots from the microparticle-depleted plasma, contain 0.1-0.5-μm size granular and CD61-positive material on fibres, suggesting that platelet-derived microparticles attach to fibrin. Therefore, the blood of healthy individuals contains functional microparticles at the levels that have a procoagulant potential. They affect the structure and stability of fibrin clots indirectly through acceleration of thrombin generation and through direct physical incorporation into the fibrin network. Both mechanisms underlie a potential role of microparticles in haemostasis and thrombosis as modulators of fibrin formation, structure, and resistance to fibrinolysis.

  5. Carbon nanotube on Si(001): structural and electronic properties

    International Nuclear Information System (INIS)

    Orellana, W.; Fazzio, A.; Miwa, R.W.

    2003-01-01

    Full text: The promising nanoscale technology based on carbon nanotubes has attracted much attention due to the unique electronic, chemical and mechanical properties of the nanotubes. Single-wall carbon nanotubes (SWCNs) provide an ideal atomically uniform one dimensional (1D) conductors, having a strong electronic confinement around its circumference, which can be retained up to room temperature[1]. This interesting property may lead one to consider SWCNs as 1D conductors for the development of nanoscale electronic devices. In this work the structural and electronic properties of the contact between a metallic (6,6) SWCN adsorbed on a silicon (001) surface are studied from first-principles total-energy calculations. We consider two adsorption sites for the tube on the Si(001) surface: on the top of the Si-dimer rows and on the surface 'trench' between two consecutive dimer rows. Our results show a chemical bond between the nanotube and Si(001) when the tube is located along the 'trench', which corresponds to the only bound structure. We find a binding energy per tube length of 0.21 eV/angstrom. We also verified that the binding energy depends on the rotation of the tube. Typically, a rotation of 15 deg can reduce the binding energy up to 0.07 eV/angstrom. Our calculated electronic properties indicate that the most stable structure shows a subband associated to the tube/surface bond that cross the Fermi level. This result indicates an enhanced metallic behavior along the tube/surface contact characterizing a 1D quantum wire. The charge transfer between the Si surface and the tube is also discussed. [1] Z. Yao, C. Dekker, and P. Avouris in Carbon Nanotubes, M. S. Dresselhaus, G. Dresselhaus, and P. Avouris Eds., (Springer, Berlin 2001), p. 147. (author)

  6. Entropy, related thermodynamic properties, and structure of methylisocyanate

    International Nuclear Information System (INIS)

    Davis, Phil S.; Kilpatrick, John E.

    2013-01-01

    Highlights: ► The thermodynamic properties of methylisocyanate have been determined by isothermal calorimetry from 15 to 298.15 K. ► The third law entropy has been compared with the entropy calculated by statistical thermodynamics. ► The comparisons are consistent with selected proposed molecular structures and vibrational frequencies. -- Abstract: The entropy and related thermodynamic properties of methylisocyanate, CH 3 NCO, have been determined by isothermal calorimetry. The entropy in the ideal gas state at 298.15 K and 1 atmosphere is S m o = 284.3 ± 0.6 J/K · mol. Other thermodynamic properties determined include: the heat capacity from 15 to 300 K, the temperature of fusion (T fus = 178.461 ± 0.024 K), the enthalpy of fusion (ΔH fus = 7455.2 ± 14.0 J/mol), the enthalpy of vaporization at 298.15 K (ΔH vap = 28768 ± 54 J/mol), and the vapor pressure from fusion to 300 K. Using statistical thermodynamics, the entropy in this same state has been calculated for various assumed structures for methylisocyante which have been proposed based on several spectroscopic and ab initio results. Comparisons between the experimental and calculated entropy have led to the following conclusions concerning historical differences among problematic structural properties: (1) The CNC/CNO angles can have the paired values of 140/180° or 135/173° respectively. It is not possible to distinguish between the two by this thermodynamic analysis. (2) The methyl group functions as a free rotor or near free rotor against the NCO rigid frame. The barrier to internal rotation is less than 2100 J/mol. (3) The CNC vibrational bending frequency is consistent with the more recently observed assignments at 165 and 172 cm −1 with some degree of anharmonicity or with a pure harmonic at about 158 cm −1

  7. Topological properties of complex networks in protein structures

    Science.gov (United States)

    Kim, Kyungsik; Jung, Jae-Won; Min, Seungsik

    2014-03-01

    We study topological properties of networks in structural classification of proteins. We model the native-state protein structure as a network made of its constituent amino-acids and their interactions. We treat four structural classes of proteins composed predominantly of α helices and β sheets and consider several proteins from each of these classes whose sizes range from amino acids of the Protein Data Bank. Particularly, we simulate and analyze the network metrics such as the mean degree, the probability distribution of degree, the clustering coefficient, the characteristic path length, the local efficiency, and the cost. This work was supported by the KMAR and DP under Grant WISE project (153-3100-3133-302-350).

  8. Structural and electronic properties of L-amino acids

    Science.gov (United States)

    Tulip, P. R.; Clark, S. J.

    2005-05-01

    The structural and electronic properties of four L-amino acids alanine, leucine, isoleucine, and valine have been investigated using density functional theory (DFT) and the generalized gradient approximation. Within the crystals, it is found that the constituent molecules adopt zwitterionic configurations, in agreement with experimental work. Lattice constants are found to be in good agreement with experimentally determined values, although certain discrepancies do exist due to the description of van der Waals interactions. We find that these materials possess wide DFT band gaps in the region of 5 eV, with electrons highly localized to the constituent molecules. It is found that the main mechanisms behind crystal formation are dipolar interactions and hydrogen bonding of a primarily electrostatic character, in agreement with current biochemical understanding of these systems. The electronic structure suggests that the amine and carboxy functional groups are dominant in determining band structure.

  9. Electronic structure and optical properties of metal doped tetraphenylporphyrins

    Science.gov (United States)

    Shah, Esha V.; Roy, Debesh R.

    2018-05-01

    A density functional scrutiny on the structure, electronic and optical properties of metal doped tetraphenylporphyrins MTPP (M=Fe, Co, Ni) is performed. The structural stability of the molecules is evaluated based on the electronic parameters like HOMO-LUMO gap (HLG), chemical hardness (η) and binding energy of the central metal atom to the molecular frame etc. The computed UltraViolet-Visible (UV-Vis) optical absorption spectra for all the compounds are also compared. The molecular structures reported are the lowest energy configurations. The entire calculations are carried out with a widely reliable functional, viz. B3LYP with a popular basis set which includes a scaler relativistic effect, viz. LANL2DZ.

  10. Structural and electronic properties of carbon nanotubes under hydrostatic pressures

    International Nuclear Information System (INIS)

    Zhang Ying; Cao Juexian; Yang Wei

    2008-01-01

    We studied the structural and electronic properties of carbon nanotubes under hydrostatic pressures based on molecular dynamics simulations and first principles band structure calculations. It is found that carbon nanotubes experience a hard-to-soft transition as external pressure increases. The bulk modulus of soft phase is two orders of magnitude smaller than that of hard phase. The band structure calculations show that band gap of (10, 0) nanotube increases with the increase of pressure at low pressures. Above a critical pressure (5.70GPa), band gap of (10, 0) nanotube drops rapidly and becomes zero at 6.62GPa. Moreover, the calculated charge density shows that a large pressure can induce an sp 2 -to-sp 3 bonding transition, which is confirmed by recent experiments on deformed carbon nanotubes

  11. Crystal structures and second-order NLO properties of borogermanates

    International Nuclear Information System (INIS)

    Zhang, Jian-Han; Kong, Fang; Xu, Xiang; Mao, Jiang-Gao

    2012-01-01

    Borogermanates are a class of very important compounds in materials chemistry. In this paper, the syntheses, structures, and properties of metal borogermanates are reviewed. Organically templated borogermanates with zeolite-like open-frameworks show potential applications as microporous materials. Many compounds in alkali or alkaline-earth borogermanate systems are structurally acentric or polar, some of which exhibit excellent Second Harmonic Generation (SHG) coefficients, wide transparency regions, and high optical-damage thresholds as well as excellent thermal stability. Most of the lanthanide borogermanates are structurally centrosymmetric and not SHG active; however, they are able to emit strong luminescence in visible or near-IR region. In the B-rich compounds, BO 3 and BO 4 groups can be polymerized into a variety of discrete polynuclear anionic cluster units or extended architectures via B–O–B bridges; whereas in the Ge-rich compounds, GeO 4 and GeO 6 polyhedra can also be polymerized. The combinations of borate and germinate afforded rich structural and topological types. - Graphical abstract: Borogermanates are a class of very important compounds in materials chemistry. Both BO x (x=3, 4) and GeO y (y=4, 6) polyhedra can be polymerized into a variety of discrete polynuclear anionic cluster units or extended architectures. The combinations of borate and germanate groups in the same oxide framework not only give rise to a rich structural chemistry, but also afford many polar compounds with good SHG properties. Highlights: ► Borogermanates are a class of new materials. ► They feature to be the combination of B and Ge atoms into the same oxide framework. ► They can form a large number of novel 2D and 3D framework structures. ► Some of them are acentric or polar with moderate strong SHG responses.

  12. Atomic-level structure and structure-property relationship in metallic glass

    Science.gov (United States)

    Cheng, Yongqiang

    One of the key tasks in material science is to understand the structure and structure-property relationship. The recently emerging bulk metallic glasses (BMGs) have demonstrated unique properties, especially intriguing mechanical properties such as their high strength and high propensity to localize deformation in shear bands. However, a comprehensive understanding of the structure of BMGs has been hindered by the complexity of these amorphous materials. Even more challenging is the structure-property correlation, which has been well established in crystals but has been seriously lacking for BMGs. This thesis presents a systematic study of the atomic-level structures of two representative BMGs, Cu-Zr and Cu-Zr-Al. The interpenetrating Cu-centered icosahedral clusters have been identified to be the primary structural feature. The fraction of icosahedra increases with increasing Cu or Al contents, and with decreasing cooling rate. The effect of Al in improving the icosahedral order is two-fold: the geometric effect due to the atomic-size mismatch and the chemical effect originated from the Cu-Al bond shortening. The resolved structure is used to study the structure-property relationship. The full icosahedra are found to be responsible for the dynamical slowdown of the supercooled liquid, which underlies the non-Arrhenius behavior, and explains the composition dependence of glass transition temperature, glass forming ability, and the room temperature strength. By simulated deformation, the initiation of plasticity and tendency for strain localization are also investigated. The full icosahedra are found to be the most rigid and resistant cluster with solid-like character, while the unstable clusters with liquid-like character serve as the fertile sites for initiating shear transformations. In addition, the elastic moduli are calculated and analyzed, and the origins of the different configurational dependence of shear modulus (G) and bulk modulus ( B) are explained. The

  13. Structural phase transition and electronic properties in samarium chalcogenides

    Energy Technology Data Exchange (ETDEWEB)

    Panwar, Y. S., E-mail: yspanwar2011@gmail.com [Department of Physics, Govt. New Science College Dewas-455001 (India); Aynyas, Mahendra [Department of Physics, C.S.A. Govt. P.G. College, Sehore, 466001 (India); Pataiya, J.; Sanyal, Sankar P. [Department of Physics, Barkatullah University, Bhopal, 462026 (India)

    2016-05-06

    The electronic structure and high pressure properties of samarium monochalcogenides SmS, SmSe and SmTe have been reported by using tight binding linear muffin-tin-orbital (TB-LMTO) method within the local density approximation (LDA). The total energy as a function of volume is evaluated. It is found that these monochalcogenides are stable in NaCl-type structure under ambient pressure. We predict a structural phase transition from NaCl-type (B{sub 1}-phase) structure to CsCl-type (B{sub 2}-type) structure for these compounds. Phase transition pressures were found to be 1.7, 4.4 and 6.6 GPa, for SmS, SmSe and SmTe respectively. Apart from this, the lattice parameter (a{sub 0}), bulk modulus (B{sub 0}), band structure (BS) and density of states (DOS) are calculated. From energy band diagram we observed that these compounds exhibit metallic character. The calculated values of equilibrium lattice parameter and phase transition pressure are in general good agreement with available data.

  14. Structure-topology-property correlations of sodium phosphosilicate glasses.

    Science.gov (United States)

    Hermansen, Christian; Guo, Xiaoju; Youngman, Randall E; Mauro, John C; Smedskjaer, Morten M; Yue, Yuanzheng

    2015-08-14

    In this work, we investigate the correlations among structure, topology, and properties in a series of sodium phosphosilicate glasses with [SiO2]/[SiO2 + P2O5] ranging from 0 to 1. The network structure is characterized by (29)Si and (31)P magic-angle spinning nuclear magnetic resonance and Raman spectroscopy. The results show the formation of six-fold coordinated silicon species in phosphorous-rich glasses. Based on the structural data, we propose a formation mechanism of the six-fold coordinated silicon, which is used to develop a quantitative structural model for predicting the speciation of the network forming units as a function of chemical composition. The structural model is then used to establish a temperature-dependent constraint description of phosphosilicate glass topology that enables prediction of glass transition temperature, liquid fragility, and indentation hardness. The topological constraint model provides insight into structural origin of the mixed network former effect in phosphosilicate glasses.

  15. Improvement in photoconductor film properties by changing dielectric layer structures

    International Nuclear Information System (INIS)

    Kim, S; Oh, K; Lee, Y; Jung, J; Cho, G; Jang, G; Cha, B; Nam, S; Park, J

    2011-01-01

    In recent times, digital X-ray detectors have been actively applied to the medical field; for example, digital radiography offers the potential of improved image quality and provides opportunities for advances in medical image management, computer-aided diagnosis and teleradiology. In this study, two candidate materials (HgI 2 and PbI 2 ) have been employed to study the influence of the dielectric structure on the performance of fabricated X-ray photoconducting films. Parylene C with high permittivity was deposited as a dielectric layer using a parylene deposition system (PDS 2060). The structural and morphological properties of the samples were evaluated field emission scanning electron microscopy and X-ray diffraction. Further, to investigate improvements in the electrical characteristics, a dark current in the dark room and sensitivity to X-ray exposure in the energy range of general radiography diagnosis were measured across the range of the operating voltage. The electric signals varied with the dielectric layer structure of the X-ray films. The PbI 2 film with a bottom dielectric layer showed optimized electric properties. On the other hand, in the case of HgI 2 , the film with a top dielectric layer showed superior electric characteristics. Further, although the sensitivity of the film decreased, the total electrical efficiency of the film improved as a result of the decrease in dark current. When a dielectric layer is deposited on a photoconductor, the properties of the photoconductor, such as hole-electron mobility, should be considered to improve the image quality in digital medical imaging application. In this study, we have thus demonstrated that the use of dielectric layer structures improves the performance of photoconductors.

  16. Conversion of char nitrogen to N2 under incomplete combustion conditions; Fukanzen nensho jokenka ni okeru char chuchisso no N2 eno tenka

    Energy Technology Data Exchange (ETDEWEB)

    Zhuang, Q.; Yamauchi, A.; Oshima, Y.; Wu, Z.; Otsuka, Y. [Tohoku University, Sendai (Japan). Institute for Chemical Reaction Science

    1996-10-28

    The effect of combustion conditions on conversion of char nitrogen to N2 was studied in the combustion experiment of char obtained by pyrolysis of coal. Char specimen was prepared by holding ZN coal of Chinese lignite in Ar atmosphere at 1123K for one hour. A batch scale quartz-made fluidized bed reactor was used for combustion experiment. After the specimen was fluidized in reaction gas, it was rapidly heated to start combustion reaction. CO, CO2 and N2 in produced gases were online measured by gas chromatography (GC). As the experimental result, under the incomplete combustion condition where a large amount of CO was produced by consuming almost all of O2, no NOx and N2O produced from char were found, and almost all of N-containing gas was N2. At the final stage of combustion, pyridinic-N disappeared completely, and pyrrolic-N decreased, while O-containing nitrogen complexes became a main component. It was thus suggested that O-containing nitrogen complexes are playing the role of intermediate product in combustion reaction. 7 refs., 4 figs., 1 tab.

  17. Modelling structure and properties of amorphous silicon boron nitride ceramics

    Directory of Open Access Journals (Sweden)

    Johann Christian Schön

    2011-06-01

    Full Text Available Silicon boron nitride is the parent compound of a new class of high-temperature stable amorphous ceramics constituted of silicon, boron, nitrogen, and carbon, featuring a set of properties that is without precedent, and represents a prototypical random network based on chemical bonds of predominantly covalent character. In contrast to many other amorphous materials of technological interest, a-Si3B3N7 is not produced via glass formation, i.e. by quenching from a melt, the reason being that the binary components, BN and Si3N4, melt incongruently under standard conditions. Neither has it been possible to employ sintering of μm-size powders consisting of binary nitrides BN and Si3N4. Instead, one employs the so-called sol-gel route starting from single component precursors such as TADB ((SiCl3NH(BCl2. In order to determine the atomic structure of this material, it has proven necessary to simulate the actual synthesis route.Many of the exciting properties of these ceramics are closely connected to the details of their amorphous structure. To clarify this structure, it is necessary to employ not only experimental probes on many length scales (X-ray, neutron- and electron scattering; complex NMR experiments; IR- and Raman scattering, but also theoretical approaches. These address the actual synthesis route to a-Si3B3N7, the structural properties, the elastic and vibrational properties, aging and coarsening behaviour, thermal conductivity and the metastable phase diagram both for a-Si3B3N7 and possible silicon boron nitride phases with compositions different from Si3N4: BN = 1 : 3. Here, we present a short comprehensive overview over the insights gained using molecular dynamics and Monte Carlo simulations to explore the energy landscape of a-Si3B3N7, model the actual synthesis route and compute static and transport properties of a-Si3BN7.

  18. Bismuth Silver Oxysulfide for Photoconversion Applications: Structural and Optoelectronic Properties

    KAUST Repository

    Baqais, Amal Ali Abdulallh; Curutchet, Antton; Ziani, Ahmed; Ait Ahsaine, Hassan; Sautet, Philippe; Takanabe, Kazuhiro; Le Bahers, Tangui

    2017-01-01

    Single-phase bismuth silver oxysulfide, BiAgOS, was prepared by a hydrothermal method. Its structural, morphological and optoelectronic properties were investigated and compared with bismuth copper oxysulfide (BiCuOS). Rietveld refinement of the powder X-ray diffraction (XRD) measurements revealed that the BiAgOS and BiCuOS crystals have the same structure as ZrSiCuAs: the tetragonal space group P4/nmm. X-ray photoelectron spectroscopy (XPS) analyses confirmed that the BiAgOS has a high purity, in contrast with BiCuOS, which tends to have Cu vacancies. The Ag has a monovalent oxidation state, whereas Cu is present in the oxidation states of +1 and +2 in the BiCuOS system. Combined with experimental measurements, density functional theory calculations employing the range-separated hybrid HSE06 exchange-correlation functional with spin-orbit coupling quantitatively elucidated photophysical properties such as ab-sorption coefficients, effective masses and dielectric constants. BiCuOS and BiAgOS were found to have indirect bandgaps of 1.1 and 1.5 eV, respectively. Both possess high dielectric constants and low electron and hole effective masses. Therefore, these materials are expected to have high exciton dissociation capabilities and excellent carrier diffusion properties. This study reveals that BiAgOS is a promising candidate for photoconversion applications.

  19. Bismuth Silver Oxysulfide for Photoconversion Applications: Structural and Optoelectronic Properties

    KAUST Repository

    Baqais, Amal Ali Abdulallh

    2017-09-18

    Single-phase bismuth silver oxysulfide, BiAgOS, was prepared by a hydrothermal method. Its structural, morphological and optoelectronic properties were investigated and compared with bismuth copper oxysulfide (BiCuOS). Rietveld refinement of the powder X-ray diffraction (XRD) measurements revealed that the BiAgOS and BiCuOS crystals have the same structure as ZrSiCuAs: the tetragonal space group P4/nmm. X-ray photoelectron spectroscopy (XPS) analyses confirmed that the BiAgOS has a high purity, in contrast with BiCuOS, which tends to have Cu vacancies. The Ag has a monovalent oxidation state, whereas Cu is present in the oxidation states of +1 and +2 in the BiCuOS system. Combined with experimental measurements, density functional theory calculations employing the range-separated hybrid HSE06 exchange-correlation functional with spin-orbit coupling quantitatively elucidated photophysical properties such as ab-sorption coefficients, effective masses and dielectric constants. BiCuOS and BiAgOS were found to have indirect bandgaps of 1.1 and 1.5 eV, respectively. Both possess high dielectric constants and low electron and hole effective masses. Therefore, these materials are expected to have high exciton dissociation capabilities and excellent carrier diffusion properties. This study reveals that BiAgOS is a promising candidate for photoconversion applications.

  20. Structural and magnetic properties of hcp and fcc Ni nanoparticles

    International Nuclear Information System (INIS)

    Gong, J.; Wang, L.L.; Liu, Y.; Yang, J.H.; Zong, Z.G.

    2008-01-01

    The face-centered-cubic (fcc) and hexagonal-close-packed (hcp) Ni nanoparticles were synthesized with citrate by sol-gel method and heat-treating technique. The structure, morphology and magnetic properties of the samples were characterized using X-ray diffraction (XRD), transmission electron microscopy (TEM), and vibrating sample magnetometer (VSM). Our XRD and TEM results suggested that hcp Ni nanoparticles were successfully synthesized when the heating temperature reaches 300 deg. C. With a further increase in temperature to 400 deg. C, a temperature-induced phase transformation of hcp to fcc was observed. Moreover, the VSM results demonstrated the existence of ferromagnetic behavior in the synthesized fcc and hcp Ni nanoparticles. Nevertheless, the magnetic measurement suggested that the magnetic properties in hcp nanoparticles is probably the sum of two contributions: superparamagnetic and ferromagnetic one. The unsaturated magnetization is much smaller than 47.6 emu/g for the fcc nanoparticles obtained at 400 deg. C and 55 emu/g for the bulk material. It was also found that changes of the stress, grain size and crystal structure during heat-treating have significant influences on the magnetic properties of the Ni nanoparticles

  1. Polycaprolactone/starch composite: Fabrication, structure, properties, and applications.

    Science.gov (United States)

    Ali Akbari Ghavimi, Soheila; Ebrahimzadeh, Mohammad H; Solati-Hashjin, Mehran; Abu Osman, Noor Azuan

    2015-07-01

    Interests in the use of biodegradable polymers as biomaterials have grown. Among the different polymeric composites currently available, the blend of starch and polycaprolactone (PCL) has received the most attention since the 1980s. Novamont is the first company that manufactured a PCL/starch (SPCL) composite under the trademark Mater-Bi®. The properties of PCL (a synthetic, hydrophobic, flexible, expensive polymer with a low degradation rate) and starch (a natural, hydrophilic, stiff, abundant polymer with a high degradation rate) blends are interesting because of the composite components have completely different structures and characteristics. PCL can adjust humidity sensitivity of starch as a biomaterial; while starch can enhance the low biodegradation rate of PCL. Thus, by appropriate blending, SPCL can overcome important limitations of both PCL and starch components and promote controllable behavior in terms of mechanical properties and degradation which make it suitable for many biomedical applications. This article reviewed the different fabrication and modification methods of the SPCL composite; different properties such as structural, physical, and chemical as well as degradation behavior; and different applications as biomaterials. © 2014 Wiley Periodicals, Inc.

  2. Properties, structure and machnining capabilities sintered corundum abrasives

    Directory of Open Access Journals (Sweden)

    Cz.J. Niżankowski

    2010-07-01

    Full Text Available The diversity of sintered corundum abrasives used in both bonded and in the embankment of abrasive tools currently poses substantialproblems for their choice of technology to specific tasks. Therefore performed a comparative study of ownership structures and capacitiesof elected representatives machnining sintered corundum abrasives of different generations, and this is normal sintered alumina,submicrocrystalline alumina sintered and nanocrystalline alumina sintered. Were studied some properties of a set of abrasive particles,physicochemical properties and structural and mechanical and technological properties. The studies used the method of microscopicmeasurement to determine the shape of abrasive particles, the pycnometer to determine the density of abrasive, a spectrometer todetermine the chemical composition of the magnetic analyzer for determining the magnetic fraction, scanning electron microscope toanalysis of abrasive grains and a special position to designate the machining capacity abrasive grains. The results showed a significantincrease in machining capacity sintered corundum abrasives with increasing degree of fragmentation of the crystallites sintered corundum abrasives and distinctive bands in the emerging microchip. The originality of the development provides a comparative summary ofproperties of sintered corundum abrasives of different generations and functions obtained by the author making the change in value indexof machininhcapacity grit from cutting speeds for different generations of sintered corundum.

  3. Influence of isothermal thermomechanical treatment on structure and properties of structural steels

    International Nuclear Information System (INIS)

    Smirnov, M.A.; Kaletin, A.Yu.; Schastlivthev, V.M.; Kaletina, Yu.V.

    1997-01-01

    A study is made into the structure and mechanical properties of steel 35KhGSA and 37KhN3A after isothermal hardening resulting in bainitic structure formation as well as after low-temperature thermomechanical treatment (LTTMT) combining the plastic deformation at the temperature of bainitic transformation and subsequent isothermal hardening. It is shown that LTTMT permits and essential enhancement of strength properties in steel 35KhGSA, high plasticity and impact strength being reserved. This is associated with bainitic structure refinement. In steel 37KhN3A the process of carbide formation takes place along with bainitic transformation, and LTTMT results in lesser strengthening. LTTMT is fount to not practically affect the tendency of structural steels to bainitic brittleness. This treatment promotes some shift of brittleness manifestation to lower temperatures

  4. Study on the submicron and micron morphology and the properties of poor bituminous coal burnout

    Energy Technology Data Exchange (ETDEWEB)

    Pei-Fang Fu; Huai-Chun Zhou; Qing-Yan Fang; Hai Yao; Jianrong Qiu; Minghou Xu [Huazhong University of Science and Technology, Wuhan (China). State Key Laboratory of Coal Combustion

    2007-05-15

    Carbon burnout and its reaction mechanism have been widely focused on in the past decades. The properties of burnout, submicron and micron morphology and the reaction mechanism of poor bituminous coal/char (PBC) in a W-shaped power plant boiler was studied and was compared with those in DTF and in TGA, which showed that the degree of PBC burnout in TGA at 1450{sup o}C was greater than or approximately equal to that in a W-shaped boiler, and that the complexity of the reactions among residual char, oxygen and SiO{sub 2} did not seem to result in mass loss in TGA, although the weight percentage of the residual char in ash decreased from 33% ad (air dry basis) at 900{sup o}C to 9% and at 1450{sup o}C. According to the distribution of pores and the properties of the char burnout, the char can be simply categorized into three classes: char burnout easy, char burnout difficult and char burnout very difficult. The differences of the reaction mechanism must be considered while predicting the burning rate and degree of char burnout in a full-scale boiler by making use of experimental results from TGA and DTF. A different char particle contains markedly different amount of carbons, but for a special char particle, the ratio of carbon to ash is generally constant, and an ash shell does not exist on the char surface. The fusion mineral matter composing of C-O-Si-Al is amorphous, not in the form of Al{sub 2}O{sub 3} and SiO{sub 2} above 1450{sup o}C.

  5. Structural characterization and mechanical properties of polypropylene reinforced natural fibers

    Science.gov (United States)

    Karim, M. A. A.; Zaman, I.; Rozlan, S. A. M.; Berhanuddin, N. I. C.; Manshoor, B.; Mustapha, M. S.; Khalid, A.; Chan, S. W.

    2017-10-01

    Recently the development of natural fiber composite instead of synthetics fiber has lead to eco-friendly product manufacturing to meet various applications in the field of automotive, construction and manufacturing. The use of natural fibers offer an alternative to the reinforcing fibers because of their good mechanical properties, low density, renewability, and biodegradability. In this present research, the effects of maleic anhydride polypropylene (MAPP) on the mechanical properties and material characterization behaviour of kenaf fiber and coir fiber reinforced polypropylene were investigated. Different fractions of composites with 10wt%, 20wt% and 30wt% fiber content were prepared by using brabender mixer at 190°C. The 3wt% MAPP was added during the mixing. The composites were subsequently molded with injection molding to prepare the test specimens. The mechanical properties of the samples were investigated according to ISO 527 to determine the tensile strength and modulus. These results were also confirmed by the SEM machine observations of fracture surface of composites and FTIR analysis of the chemical structure. As the results, the presence of MAPP helps increasing the mechanical properties of both fibers and 30wt% kenaf fiber with 3wt% MAPP gives the best result compare to others.

  6. Structure and properties of tempo-oxidized cotton fibers

    Directory of Open Access Journals (Sweden)

    Milanovic Jovana

    2012-01-01

    Full Text Available In this paper, the influence of the catalytic oxidation using water soluble and stable nitroxyl radical 2,2´,6,6´-tetramethylpiperidine-1-oxyl (TEMPO on structure and properties of cotton fibers was studied. In particular, the selective TEMPO-mediated oxidation has become very interesting way for introduction of functional groups into cellulose fibers with the aim to obtain oxycellulose fibers with specific properties. Unmodified and modified fibers were characterized in terms of weight loss values, introduced functional groups and crystallinity index. Also, oxidized fibers were characterized in terms of the sorption, morphological, and physico-mechanical properties. The TEMPO-oxidized cotton fibers show a minimum increase of fineness (from 1.32 to 1.28 dtex and increase of crystallinity index (up to 91.9%, while the tensile strength of fibers decreases (up to 10.82 cN/tex. By the TEMPO-mediated oxidation of cotton fibers significant amount of carboxyl groups (up to 0.795 mmol/g cell can be introduced into cellulose fibers. Introduced hydrophilic carboxyl groups increases the sorption properties of oxidized fibers, that can be used directly or for further chemical modification.

  7. Advances in CO_2 gasification reactivity of biomass char through utilization of radio frequency irradiation

    International Nuclear Information System (INIS)

    Lahijani, Pooya; Mohammadi, Maedeh; Zainal, Zainal Alimuddin; Mohamed, Abdul Rahman

    2015-01-01

    A straightforward and well-known reaction for CO_2 activation is the “Boudouard reaction”, wherein, CO_2 is reacted with carbon (char) to produce CO. In this study, a RF (radio frequency) heating system was developed to perform the Boudouard reaction by passing CO_2 through a packed bed of PNS (pistachio nut shell) char. High CO_2 conversion of 84% was achieved at 850 °C. When similar experiments were performed in thermal electric furnace, the conversion was only 38%. For further expanding the knowledge on RF-induced gasification, sodium (Na) was incorporated into char skeleton and gasified with CO_2 under RF irradiation. RF gasification of Na-catalyzed char pronouncedly improved in the reaction, where sustainable CO_2 conversion of 99% was attained at 850 °C. The predominance of RF over thermal heating was highly reflected in kinetic studies, where the activation energies of 26.7, 46.9 and 183.9 kJ/mol were obtained for catalytic and non-catalytic RF and thermal gasification, respectively. In RF gasification studies, it was attempted to improve the quality of mix gases, simulating air and steam gasification gas compositions, through the Boudouard reaction. The heating value of the gases simulating air and steam gasification improved from 6.4 to 8.0 MJ/m"3 and 7.6–10.4 MJ/m"3, respectively. - Highlights: • We study radio frequency-induced CO_2 gasification of pistachio nut shell char. • We achieve very high CO_2 conversion of 99% in RF gasification of Na-catalyzed char. • E_a of 47 and 184 kJ/mol obtained for RF-assisted and conventional CO_2 gasification. • Heating value of synthesis gas improved via RF-induced char-CO_2 gasification.

  8. Intrinsic reaction kinetics of coal char combustion by direct measurement of ignition temperature

    International Nuclear Information System (INIS)

    Kim, Ryang-Gyoon; Jeon, Chung-Hwan

    2014-01-01

    A wire heating reactor that can use a synchronized experimental method was developed to obtain the intrinsic kinetics of large coal char particles ranging in size from 0.4 to 1 mm. This synchronization system consists of three parts: a thermocouple wire for both heating and direct measurement of the particle temperature, a photodetector sensor for determining ignition/burnout points by measuring the intensity of luminous emission from burning particles, and a high-speed camera–long-distance microscope for observing and recording the movement of luminous zone directly. Coal char ignition was found to begin at a spot on the particle's external surface and then moved across the entire particle. Moreover, the ignition point determined according to the minimum of dT/dt is a spot point and not a full growth point. The ignition temperature of the spot point rises as the particle diameter increases. A spot ignition model, which describes the ignition in terms of the internal conduction and external/internal oxygen diffusion, was then developed to evaluate the intrinsic kinetics and predict the ignition temperature of the coal char. Internal conduction was found to be important in large coal char particles because its effect becomes greater than that of oxygen diffusion as the particle diameter increases. In addition, the intrinsic kinetics of coal char obtained from the spot ignition model for two types of coal does not differ significantly from the results of previous investigators. -- Highlights: • A novel technique was used to measure the coal char particle temperature. • The ignition point determined from a dT/dt minimum is a spot ignition point. • A spot ignition model was suggested to analyze the intrinsic reaction kinetics of coal char. • Internal conduction has to be considered in order to evaluate the intrinsic kinetics for larger particle (above 1 mm)

  9. Char characterization and DTF assays as tools to predict burnout of coal blends in power plants

    Energy Technology Data Exchange (ETDEWEB)

    C. Ulloa; A.G. Borrego; S. Helle; A.L. Gordon; X. Garcia [Universidad de Concepcion, Concepcion (Chile). Departamento de Ingenieria Quimica

    2005-02-01

    The aim of this study is to predict efficiency deviations in the combustion of coal blends in power plants. Combustion of blends, as compared to its single coals, shows that for some blends the behavior is non-additive in nature. Samples of coal feed and fly ashes from combustion of blends at two power plants, plus chars of the parent coals generated in a drop-tube furnace (DTF) at temperatures and heating rates similar to those found in the industrial boilers were used. Intrinsic kinetic parameters, burning profiles and petrographic characteristics of these chars correlated well with the burnout in power plants and DTF experiments. The blend combustion in a DTF reproduces both positive and negative burnout deviations from the expected weighted average. These burnout deviations have been previously attributed to parallel or parallel-series pathways of competition for oxygen. No deviations were found for blends of low rank coals of similar characteristics yielding chars close in morphology, optical texture and reactivity. Negative deviations were found for blends of coals differing moderately in rank and were interpreted as associated with long periods of competition. In this case, fly-ashes were enriched in material derived from the least reactive char, but also unburnt material attributed to the most reactive char was identified. Improved burnout compared to the weighted average was observed for blends of coals very different in rank, and interpreted as the result of a short interaction period, followed by a period where the less reactive char burns under conditions that are more favorable to its combustion. In this case, only unburned material from the least reactive char was identified in the fly-ashes. 20 refs., 9 figs., 5 tabs.

  10. Dynamic molecular structure of plant biomass-derived black carbon (biochar)

    Energy Technology Data Exchange (ETDEWEB)

    Keiluweit, M.; Nico, P.S.; Johnson, M.G.; Kleber, M.

    2009-11-15

    Char black carbon (BC), the solid residue of incomplete combustion, is continuously being added to soils and sediments due to natural vegetation fires, anthropogenic pollution, and new strategies for carbon sequestration ('biochar'). Here we present a molecular-level assessment of the physical organization and chemical complexity of biomass-derived chars and, specifically, that of aromatic carbon in char structures. BET-N{sub 2} surface area, X-ray diffraction (XRD), synchrotron-based Near-edge X-ray Absorption Fine Structure (NEXAFS), and Fourier transform infrared (FT-IR) spectroscopy are used to show how two plant materials (wood and grass) undergo analogous, but quantitatively different physical-chemical transitions as charring temperature increases from 100 to 700 C. These changes suggest the existence of four distinct categories of char consisting of a unique mixture of chemical phases and physical states: (i) in transition chars the crystalline character of the precursor materials is preserved, (ii) in amorphous chars the heat-altered molecules and incipient aromatic polycondensates are randomly mixed, (iii) composite chars consist of poorly ordered graphene stacks embedded in amorphous phases, and (iv) turbostratic chars are dominated by disordered graphitic crystallites. The molecular variations among the different char categories translate into differences in their ability to persist in the environment and function as environmental sorbents.

  11. Crystal structure and thermal property of polyethylene glycol octadecyl ether

    International Nuclear Information System (INIS)

    Meng, Jie-yun; Tang, Xiao-fen; Li, Wei; Shi, Hai-feng; Zhang, Xing-xiang

    2013-01-01

    Highlights: ► The crystal structure of C18En for n ≥ 20 is a monoclinic system. ► Polyethylene glycol octadecyl ether crystallizes perfectly. ► The number of repeat units has significant effect on the melting, crystallizing temperature and enthalpy. ► The thermal stable temperature increases rapidly with increasing the number of repeat unit. - Abstract: The crystal structure, phase change property and thermal stable temperature (T d ) of polyethylene glycol octadecyl ether [HO(CH 2 CH 2 O) n C 18 H 37 , C18En] with various numbers of repeat units (n = 2, 10, 20 and 100) as phase change materials (PCMs) were investigated using temperature variable Fourier transformed infrared spectroscopy (FTIR), wide-angle X-ray diffraction (XRD), differential scanning calorimetry (DSC), and thermogravimetric analysis (TG). C18En crystallizes perfectly at 0 °C; and the crystal structure for n ≥ 20 is a monoclinic system. The number of repeat units has great effect on the phase change properties of C18En. The thermal stable temperature increases rapidly with increasing the number of repeat units. They approach to that of PEG-2000 as the number of repeat units is more than 10. T d increases rapidly with increasing the number of repeat units. C18En are a series of promising polymeric PCMs

  12. Modeling process-structure-property relationships for additive manufacturing

    Science.gov (United States)

    Yan, Wentao; Lin, Stephen; Kafka, Orion L.; Yu, Cheng; Liu, Zeliang; Lian, Yanping; Wolff, Sarah; Cao, Jian; Wagner, Gregory J.; Liu, Wing Kam

    2018-02-01

    This paper presents our latest work on comprehensive modeling of process-structure-property relationships for additive manufacturing (AM) materials, including using data-mining techniques to close the cycle of design-predict-optimize. To illustrate the processstructure relationship, the multi-scale multi-physics process modeling starts from the micro-scale to establish a mechanistic heat source model, to the meso-scale models of individual powder particle evolution, and finally to the macro-scale model to simulate the fabrication process of a complex product. To link structure and properties, a highefficiency mechanistic model, self-consistent clustering analyses, is developed to capture a variety of material response. The model incorporates factors such as voids, phase composition, inclusions, and grain structures, which are the differentiating features of AM metals. Furthermore, we propose data-mining as an effective solution for novel rapid design and optimization, which is motivated by the numerous influencing factors in the AM process. We believe this paper will provide a roadmap to advance AM fundamental understanding and guide the monitoring and advanced diagnostics of AM processing.

  13. Structural characterization and magnetic properties of steels subjected to fatigue

    International Nuclear Information System (INIS)

    Lo, C.C.H.; Tang, F.; Biner, S.B.; Jiles, D.C.

    2000-01-01

    Studies have been made on the effects of residual stress and microstructure on the variations of magnetic properties of steels during fatigue. Strain-controlled fatigue tests have been conducted on 0.2wt% C steel samples which were (1) cold-worked (2) cold-worked and annealed at 500 deg. C to relieve residual stress, and (3) annealed at 905 deg. C to produce a ferrite/pearlite structure. The changes of surface microstructure were studied by SEM replica technique. The dislocation structures of samples fatigued for different numbers of cycle were studied by TEM. In the initial stage of fatigue coercivity was found to behave differently for samples which have different residual stress levels. In the intermediate stage the magnetic hysteresis parameters became stable as the dislocation cell structure developed in the samples. In the final stage the magnetic parameters decreased dramatically. The decrease rate is related to the propagation rate of fatigue cracks observed in the SEM study, which was found to be dependent on the sample microstructure. The present results indicate that the magnetic inspection technique is able to differentiate the residual stress effects from the fatigue damage induced by cyclic loading, and therefore it is possible to detect the onset of fatigue failure in steel components via measurements of the changes in magnetic properties.--This work was sponsored by the National Science Foundation, under grant number CMS-9532056

  14. Geometry, electronic structures and optical properties of phosphorus nanotubes

    International Nuclear Information System (INIS)

    Hu, Tao; Hashmi, Arqum; Hong, Jisang

    2015-01-01

    Using a first principles approach, we investigated the geometry, electronic structures, and optical properties of phosphorus nanotubes (PNTs). Two possible 1D configurations, the so-called α-PNTs and β-PNTs, are proposed, which are structurally related to blue and black phosphorus monolayers, respectively. Hereby, we predict that both armchair and zigzag geometries can be synthesized in α-PNTs, but the zigzag form of β-PNT is highly unfavorable because of large strain and conformation energies. The band gap of α-PNTs is expected to be ∼2.67 eV, and this is insensitive to the chirality when the tube’s inner diameter is larger than 1.3 nm, while the armchair β-PNTs have a much smaller band gap. Interestingly, we find nearly flat band structures in the zigzag α-PNT system. This may indicate that an excited particle–hole pair has a huge effective mass. We also find asymmetric optical properties with respect to the polarization direction. The armchair α-PNT for parallel polarization shows a large refractive index of 2.6 near the ultraviolet wavelength, and also we find that the refractive index can be even smaller than 1 in certain frequency ranges. The zigzag tubes show very weak reflectivity for parallel polarization, while the armchair tube displays high reflectivity. (paper)

  15. Structure-property relations in amorphous carbon for photovoltaics

    International Nuclear Information System (INIS)

    Risplendi, Francesca; Cicero, Giancarlo; Bernardi, Marco; Grossman, Jeffrey C.

    2014-01-01

    Carbon is emerging as a material with great potential for photovoltaics (PV). However, the amorphous form (a-C) has not been studied in detail as a PV material, even though it holds similarities with amorphous Silicon (a-Si) that is widely employed in efficient solar cells. In this work, we correlate the structure, bonding, stoichiometry, and hydrogen content of a-C with properties linked to PV performance such as the electronic structure and optical absorption. We employ first-principles molecular dynamics and density functional theory calculations to generate and analyze a set of a-C structures with a range of densities and hydrogen concentrations. We demonstrate that optical and electronic properties of interest in PV can be widely tuned by varying the density and hydrogen content. For example, sunlight absorption in a-C films can significantly exceed that of a same thickness of a-Si for a range of densities and H contents in a-C. Our results highlight promising features of a-C as the active layer material of thin-film solar cells.

  16. About the optical properties of oxidized black silicon structures

    Science.gov (United States)

    Pincik, E.; Brunner, R.; Kobayashi, H.; Mikula, M.; Kučera, M.; Švec, P.; Greguš, J.; Vojtek, P.; Zábudlá, Z.; Imamura, K.; Zahoran, M.

    2017-02-01

    The paper deals with the optical and morphological properties of thermally oxidized black silicon (OBSi) nano-crystalline specimens produced by the surface structure chemical transfer method (SSCT). This method can produce a nano-crystalline Si black color layer on c-Si with a range of thickness of ∼50 nm to ∼300 nm by the contact of c-Si immersed in chemical solutions HF + H2O2 with a catalytic mesh. We present and discuss mainly the photoluminescence properties of both polished c-Si and OBSi structures, respectively. The similar photoluminescence (PL) behaviors recorded at liquid helium (6 K) and room temperatures on both polished crystalline Si and OBSi samples, respectively, indicate the similar origin of recorded luminescence light. As the positions of PL maxima of OBSi structures are mainly related to the size of Si nanocrystallites and SiO(x), we therefore suppose that the size of the dominant parts of the luminated OBSi nanostructure is pre-determined by the used polishing Si procedure, and/or the distribution function of the number of formed crystallites on their size is very similar. The blue shift of both PL spectra reaching almost value of 0.40 eV observed after the decrease of the sample temperature to 6 K we relate also with the change of the semiconductor band gap width.

  17. Electronic structure and magnetic properties of zigzag blue phosphorene nanoribbons

    Energy Technology Data Exchange (ETDEWEB)

    Hu, Tao; Hong, Jisang, E-mail: hongj@pknu.ac.kr [Department of Physics, Pukyong National University, Busan 608-737 (Korea, Republic of)

    2015-08-07

    We investigated the electronic structure and magnetism of zigzag blue phosphorene nanoribbons (ZBPNRs) using first principles density functional theory calculations by changing the widths of ZBPNRs from 1.5 to 5 nm. In addition, the effect of H and O passivation was explored as well. The ZBPNRs displayed intra-edge antiferromagnetic ground state with a semiconducting band gap of ∼0.35 eV; and this was insensitive to the edge structure relaxation effect. However, the edge magnetism of ZBPNRs disappeared with H-passivation. Moreover, the band gap of H-passivated ZBPNRs was greatly enhanced because the calculated band gap was ∼1.77 eV, and this was almost the same as that of two-dimensional blue phosphorene layer. For O-passivated ZBPNRs, we also found an intra-edge antiferromagnetic state. Besides, both unpassivated and O-passivated ZBPNRs preserved almost the same band gap. We predict that the electronic band structure and magnetic properties can be controlled by means of passivation. Moreover, the edge magnetism can be also modulated by the strain. Nonetheless, the intrinsic physical properties are size independent. This feature can be an advantage for device applications because it may not be necessary to precisely control the width of the nanoribbon.

  18. Structure-property relations in amorphous carbon for photovoltaics

    Energy Technology Data Exchange (ETDEWEB)

    Risplendi, Francesca; Cicero, Giancarlo [Dipartimento di Scienza Applicata e Tecnologia, Politecnico di Torino, 10129 Torino (Italy); Bernardi, Marco [Department of Physics, University of California, Berkeley, California 94720 (United States); Grossman, Jeffrey C., E-mail: jcg@mit.edu [Department of Materials Science and Engineering, Massachusetts Institute of Technology, Cambridge, Massachusetts 02139 (United States)

    2014-07-28

    Carbon is emerging as a material with great potential for photovoltaics (PV). However, the amorphous form (a-C) has not been studied in detail as a PV material, even though it holds similarities with amorphous Silicon (a-Si) that is widely employed in efficient solar cells. In this work, we correlate the structure, bonding, stoichiometry, and hydrogen content of a-C with properties linked to PV performance such as the electronic structure and optical absorption. We employ first-principles molecular dynamics and density functional theory calculations to generate and analyze a set of a-C structures with a range of densities and hydrogen concentrations. We demonstrate that optical and electronic properties of interest in PV can be widely tuned by varying the density and hydrogen content. For example, sunlight absorption in a-C films can significantly exceed that of a same thickness of a-Si for a range of densities and H contents in a-C. Our results highlight promising features of a-C as the active layer material of thin-film solar cells.

  19. Microphase separated structure and surface properties of fluorinated polyurethane resin

    International Nuclear Information System (INIS)

    Sudaryanto; Nishino, T.; Hori, Y.; Nakamae, K.

    2000-01-01

    The effect of fluorination on microphase separation and surface properties of segmented polyurethane (PU) resin were investigated. A series of fluorinated polyurethane resin (FPU) was synthesized by reacting a fluorinated diol with aromatic diisocyanate. The microphase separated structure of FPU was studied by thermal analysis, and small angle X-ray scattering (SAXS) as well as wide angle X-ray diffraction (WAXD). The surface structure and properties were characterized by X-ray photoelectron spectroscopy (XPS) and dynamic contact angle measurement. The incorporation of fluorine into hard segment brings the FPU to have a higher hard domain cohesion and increase the phase separation, however localization of fluorine on the surface could not be observed. On the other hands, localization of fluorine on the surface could be achieved for soft segment fluorinated PU without any significant change in microphase separated structure. The result from this study give an important basic information for designing PU coating material with a low surface energy and strong adhesion as well as for development of release film on pressure sensitive adhesive tape. (author)

  20. FINEMET type alloy without Si: Structural and magnetic properties

    International Nuclear Information System (INIS)

    Muraca, D.; Cremaschi, V.; Moya, J.; Sirkin, H.

    2008-01-01

    Magnetic and structural properties of a Finemet type alloy (Fe 73.5 Ge 15.5 Nb 3 B 7 Cu 1 ) without Si and high Ge content were studied. Amorphous material was obtained by the melt spinning technique and was heat treated at different temperatures for 1 h under high vacuum to induce the nanocrystallization of the sample. The softest magnetic properties were obtained between 673 and 873 K. The role of Ge on the ferromagnetic paramagnetic transition of the as-quenched alloys and its influence on the crystallization process were studied using a calorimetric technique. Moessbauer spectroscopy was employed in the nanocrystallized alloy annealed at 823 K to obtain the composition of the nanocrystals and the amorphous phase fraction. Using this data and magnetic measurements of the as-quenched alloy, the magnetic contribution of nanocrystals to the alloy annealed at 823 K was estimated via a linear model

  1. Structural and elastic properties of InN nanowires

    Energy Technology Data Exchange (ETDEWEB)

    Quddus, Ehtesham B.; Wilson, Alina; Liu, Jie; Cai, Zhihua; Veereddy, Deepak; Tao, Xinyong; Li, Xiaodong; Koley, Goutam [Department of Electrical Engineering, University of South Carolina, Columbia, SC 29208 (United States); Webb, Richard A. [Department of Physics and Astronomy and USC Nanocenter, University of South Carolina, Columbia, SC 29208 (United States)

    2012-04-15

    Structural and elastic properties of InN nanowires (NWs) have been investigated. It was observed that the NWs bend spontaneously or upon meeting an obstacle in their growth path at angles that are multiples of 30 . Lithographically patterned trenches and barriers were found to influence the growth direction of the NWs, which depending on the angle of incidence, grew along the barrier or got deflected from it. Young's modulus of InN NWs, measured by three point bending method using a NW suspended across a trench, was found to be 266 GPa, which is in between the moduli of bulk and thin film InN. Overall, the InN NW properties were found to be very suitable for applications in nanoelectromechanical systems (NEMS) and sensors. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  2. Microscopical Studies of Structural and Electronic Properties of Semiconductors

    CERN Multimedia

    2002-01-01

    The electronic and structural properties of point defects in semiconductors, e.g. radiation defects, impurities or passivating defects can excellently be studied by the hyperfine technique of Perturbed Angular Correlation (PAC). The serious limitation of this method, the small number of chemically different radioactive PAC probe atoms can be widely overcome by means of ISOLDE. Providing shortliving isotopes, which represent common dopants as well as suitable PAC probe atoms, the ISOLDE facility enables a much broader application of PAC to problems in semiconductor physics.\\\\ Using the probe atom $^{111m}$ Cd , the whole class of III-V compounds becomes accessible for PAC investigations. First successful experiments in GaAs, InP and GaP have been performed, concerning impurity complex formation and plasma induced defects. In Si and Ge, the electronic properties~-~especially their influence on acceptor-donor interaction~-~could be exemplarily st...

  3. Structural and optical properties of furfurylidenemalononitrile thin films

    Science.gov (United States)

    Ali, H. A. M.

    2013-03-01

    Thin films of furfurylidenemalononitrile (FMN) were deposited on different substrates at room temperature by thermal evaporation technique under a high vacuum. The structure of the powder was confirmed by Fourier transformation infrared (FTIR) technique. The unit cell dimensions were determined from X-ray diffraction (XRD) studies. The optical properties were investigated using spectrophotometric measurements of the transmittance and reflectance at normal incidence of light in the wavelength range from 200 to 2500 nm. The refractive index (n), the absorption index (k) and the absorption coefficient (α) were calculated. The analysis of the spectral behavior of the absorption coefficient in the absorption region revealed an indirect allowed transition. The refractive index dispersion was analyzed using the single oscillator model. Some dispersion parameters were estimated. Complex dielectric function and optical conductivity were determined. The influence of the irradiation with high-energy X-rays (6 MeV) on the studied properties was also investigated.

  4. Nanocomposites: synthesis, structure, properties and new application opportunities

    Directory of Open Access Journals (Sweden)

    Pedro Henrique Cury Camargo

    2009-03-01

    Full Text Available Nanocomposites, a high performance material exhibit unusual property combinations and unique design possibilities. With an estimated annual growth rate of about 25% and fastest demand to be in engineering plastics and elastomers, their potential is so striking that they are useful in several areas ranging from packaging to biomedical applications. In this unified overview the three types of matrix nanocomposites are presented underlining the need for these materials, their processing methods and some recent results on structure, properties and potential applications, perspectives including need for such materials in future space mission and other interesting applications together with market and safety aspects. Possible uses of natural materials such as clay based minerals, chrysotile and lignocellulosic fibers are highlighted. Being environmentally friendly, applications of nanocomposites offer new technology and business opportunities for several sectors of the aerospace, automotive, electronics and biotechnology industries.

  5. Diffusive, Structural, Optical, and Electrical Properties of Defects in Semiconductors

    CERN Multimedia

    Wagner, F E

    2002-01-01

    Electronic properties of semiconductors are extremely sensitive to defects and impurities that have localized electronic states with energy levels in the band gap of the semiconductor. Spectroscopic techniques like photoluminescence (PL), deep level transient spectroscopy (DLTS), or Hall effect, that are able to detect and characterize band gap states do not reveal direct information about their microscopic origin. To overcome this chemical "blindness", the present approach is to use radioactive isotopes as a tracer. Moreover, the recoil energies involved in $\\beta$ and $\\gamma$-decays can be used to create intrinsic isolated point defects (interstitials, vacancies) in a controlled way. A microscopic insight into the structure and the thermodynamic properties of complexes formed by interacting defects can be gained by detecting the hyperfine interaction between the nuclear moments of radioactive dopants and the electromagnetic fields present at the site of the radioactive nucleus. The understanding and the co...

  6. Properties of 40N3M powder structural steel

    International Nuclear Information System (INIS)

    Moskvina, T.P.; Gulyaev, A.P.; Gulyaev, I.A.; Byakov, S.V.; Melent'ev, I.V.; Morgun, G.N.

    1984-01-01

    Effect of the fabrication technique of compact slabs made of the 40N3M powder structural steel on mechanical properties with determination of a cold brittleness threshold was studied. It is established that after a thermal treatment at a density close to 100% a powder steel is sufficiently close to steel, rolled of an ingot, but is second in reference to steel in its ductility and impact strength. Properties of powder steel obtained by the method of dynamic hot forming (DHF) and hot extrusion are practically equal, but the first method has definite advantages as it allows to obtain details with a definitive form. The above investigation permits to recommend an application of the 40N3M powder steel fabricated by the DHF methods. The optimum thermal treatment course is: quenching+high annealing

  7. Structural and electronic properties of GaAsBi

    International Nuclear Information System (INIS)

    Achour, H.; Louhibi, S.; Amrani, B.; Tebboune, A.; Sekkal, N.

    2008-05-01

    The structural and electronic properties of the GaAs 1-x Bi x ternary alloy are investigated by means of two first principles and full potential methods, the linear augmented plane waves (FPLAPW) method and a recent version of the full potential linear muffin-tin orbitals method (FPLMTO) which enables an accurate treatment of the interstitial regions. In particular, we have found that the maximal GaBi mole fraction x for which GaBixAs 1-x remains a semiconductor is probably around x = 0.5. The electronic properties of (GaAs) m /(GaBi) n quantum well superlattices (SLs) have also been calculated and it is found that such SLs are semiconductors when m is larger or equal to n. (author)

  8. Mechanical properties and structure of magnesium alloy AS31

    Directory of Open Access Journals (Sweden)

    A. Hanus

    2008-07-01

    Full Text Available Contemporary materials should possess high mechanical properties, physical and chemical, as well as technological ones, to ensure long and reliable use. The non-ferrous metals alloys used nowadays, including the magnesium alloys, meet the above-mentioned requirements and expectations regarding the contemporary materials.Magnesium alloys are primarily used in aeronautical and automobile industry in wide variety of structural characteristics because of their favorable combination of tensile strength (160 to 365 MPa, elastic modulus (45 GPa, and low density (1 740 kg/m3, which is two-thirds that of aluminum. Magnesium alloys have high strength-to-weight ratio (tensile strength/density, comparable to those of other structural metals. [1-6]Knowledge of the relaxation properties of metal materials at high temperatures is necessary for the verification of susceptibility of castings to the creation of defects during the production process. Temperature limits of materials where highest tension values are generated may be detected with tensile tests under high temperatures. The generated tensions in the casting are a cause of the creation and development of defects. At acoustic emission (hereinafter called the "AE" use, tensile tests at high temperatures may, among other things, be used for analysis of the AE signal sources and set, in more detail, the temperature limit of elastic-plastic deformations existence in the material under examination. The results of the temperature drop where tension at casting cooling is generated or its release at heating are basic data for controlled cooling mode (and temperature of casting knocking out of the form as well as necessary for the thermal mode for the casting tension reduction. [7-9]Knowledge of elastic-plastic properties at elevated temperatures is often important for complex evaluation of magnesium alloys. Objective of the work was focused on determination of changes of elastic-plastic properties of magnesium

  9. Structural phase transition and elastic properties of mercury chalcogenides

    Energy Technology Data Exchange (ETDEWEB)

    Varshney, Dinesh, E-mail: vdinesh33@rediffmail.com [School of Physics, Vigyan Bhavan, Devi Ahilya University, Khandwa Road Campus, Indore 452001 (India); Shriya, S. [School of Physics, Vigyan Bhavan, Devi Ahilya University, Khandwa Road Campus, Indore 452001 (India); Khenata, R. [Laboratoire de Physique Quantique et de Modelisation Mathematique (LPQ3M), Departement de Technologie, Universite de Mascara, 29000 Mascara (Algeria)

    2012-08-15

    Pressure induced structural transition and elastic properties of ZnS-type (B3) to NaCl-type (B1) structure in mercury chalcogenides (HgX; X = S, Se and Te) are presented. An effective interionic interaction potential (EIOP) with long-range Coulomb, as well charge transfer interactions, Hafemeister and Flygare type short-range overlap repulsion extended up to the second neighbor ions and van der Waals interactions are considered. Emphasis is on the evaluation of the pressure dependent Poisson's ratio {nu}, the ratio R{sub BT/G} of B (bulk modulus) over G (shear modulus), anisotropy parameter, Shear and Young's modulus, Lame constant, Kleinman parameter, elastic wave velocity and thermodynamical property as Debye temperature. The Poisson's ratio behavior infers that Mercury chalcogenides are brittle in nature. To our knowledge this is the first quantitative theoretical prediction of the pressure dependence of elastic and thermodynamical properties explicitly the ductile (brittle) nature of HgX and still awaits experimental confirmations. Highlights: Black-Right-Pointing-Pointer Vast volume discontinuity in phase diagram infers transition from ZnS to NaCl structure. Black-Right-Pointing-Pointer The shear elastic constant C{sub 44} is nonzero confirms the mechanical stability. Black-Right-Pointing-Pointer Pressure dependence of {theta}{sub D} infers the softening of lattice with increasing pressure. Black-Right-Pointing-Pointer Estimated bulk, shear and tetragonal moduli satisfied elastic stability criteria. Black-Right-Pointing-Pointer In both B3 and B1 phases, C{sub 11} and C{sub 12} increase linearly with pressure.

  10. Structural and magnetic properties of nanocrystalline stannic substituted cobalt ferrite

    Energy Technology Data Exchange (ETDEWEB)

    Abbas, Y.M., E-mail: ymabbas@live.com [Physics Department, Faculty of Science, Suez Canal University, Ismailia (Egypt); Mansour, S.A. [Physics Department, Faculty of Science, Suez Canal University, Ismailia (Egypt); Physics Department, Faculty of Science, King AbdulAziz University, Rabegh (Saudi Arabia); Ibrahim, M.H. [Physics Department, Faculty of Science, Suez Canal University, Ismailia (Egypt); Physics Department, Faculty of Science, King AbdulAziz University (Saudi Arabia); Ali, Shehab. E., E-mail: shehab_ali@science.suez.edu.eg [Physics Department, Faculty of Science, Suez Canal University, Ismailia (Egypt)

    2012-09-15

    The structural and magnetic properties of the spinel ferrite system Co{sub 1+x}Fe{sub 2-2x}Sn{sub x}O{sub 4} (x=0.0-1.0) have been studied. Samples in the series were prepared by the ceramic technique. The structural and microstructural evolutions of the nanophase have been studied using X-ray powder diffraction and the Rietveld method. The refinement result showed that the type of the cationic distribution over the tetrahedral and octahedral sites in the nanocrystalline lattice is partially an inverse spinel. Far infrared absorption spectra show two significant absorption bands, around 600 cm{sup -1} and 425 cm{sup -1}, which are respectively attributed to tetrahedral (A) and octahedral [B] vibrations of the spinel. Scanning Electron Microscopy (SEM) was used to study surface morphology. SEM images reveal particles in the nanosize range. The transmission electronic microscope (TEM) reveals that the grains are spherical in shape. TEM analysis confirmed the X-ray results. The magnetic properties of the prepared samples were characterized by using a vibrating sample magnetometer. - Highlights: Black-Right-Pointing-Pointer The spinel ferrite system has been formed at 1000 Degree-Sign C by using ceramic techniques. Black-Right-Pointing-Pointer Structural and microstructural evolutions have been studied using XRD and the Rietveld method. Black-Right-Pointing-Pointer The refinement result showed cationic distribution in the lattice is partially an inverse spinel. Black-Right-Pointing-Pointer The transmission electronic microscope analysis confirmed the X-ray results. Black-Right-Pointing-Pointer Magnetic properties of the samples were characterized by using a vibrating sample magnetometer.

  11. Structural and magnetic properties of nanocrystalline stannic substituted cobalt ferrite

    International Nuclear Information System (INIS)

    Abbas, Y.M.; Mansour, S.A.; Ibrahim, M.H.; Ali, Shehab. E.

    2012-01-01

    The structural and magnetic properties of the spinel ferrite system Co 1+x Fe 2−2x Sn x O 4 (x=0.0–1.0) have been studied. Samples in the series were prepared by the ceramic technique. The structural and microstructural evolutions of the nanophase have been studied using X-ray powder diffraction and the Rietveld method. The refinement result showed that the type of the cationic distribution over the tetrahedral and octahedral sites in the nanocrystalline lattice is partially an inverse spinel. Far infrared absorption spectra show two significant absorption bands, around 600 cm −1 and 425 cm −1 , which are respectively attributed to tetrahedral (A) and octahedral [B] vibrations of the spinel. Scanning Electron Microscopy (SEM) was used to study surface morphology. SEM images reveal particles in the nanosize range. The transmission electronic microscope (TEM) reveals that the grains are spherical in shape. TEM analysis confirmed the X-ray results. The magnetic properties of the prepared samples were characterized by using a vibrating sample magnetometer. - Highlights: ► The spinel ferrite system has been formed at 1000 °C by using ceramic techniques. ► Structural and microstructural evolutions have been studied using XRD and the Rietveld method. ► The refinement result showed cationic distribution in the lattice is partially an inverse spinel. ► The transmission electronic microscope analysis confirmed the X-ray results. ► Magnetic properties of the samples were characterized by using a vibrating sample magnetometer.

  12. Structure and properties of intermetallic ternary rare earth compounds

    International Nuclear Information System (INIS)

    Casper, Frederick

    2008-01-01

    The so called material science is an always growing field in modern research. For the development of new materials not only the experimental characterization but also theoretical calculation of the electronic structure plays an important role. A class of compounds that has attracted a great deal of attention in recent years is known as REME compounds. These compounds are often referred to with RE designating rare earth, actinide or an element from group 1-4, M representing a late transition metal from groups 8-12, and E belonging to groups 13-15. There are more than 2000 compounds with 1:1:1 stoichiometry belonging to this class of compounds and they offer a broad variety of different structure types. Although many REME compounds are know to exist, mainly only structure and magnetism has been determined for these compounds. In particular, in the field of electronic and transport properties relatively few efforts have been made. The main focus in this study is on compounds crystallizing in MgAgAs and LiGaGe structure. Both structures can only be found among 18 valence electron compounds. The f electrons are localized and therefor not count as valence electrons. A special focus here was also on the magnetoresistance effects and spintronic properties found among the REME compounds. An examination of the following compounds was made: GdAuE (E=In,Cd,Mg), GdPdSb, GdNiSb, REAuSn (RE=Gd,Er,Tm) and RENiBi (RE=Pr,Sm,Gd-Tm,Lu). The experimental results were compared with theoretic band structure calculations. The first half metallic ferromagnet with LiGaGe structure (GdPdSb) was found. All semiconducting REME compounds with MgAgAs structure show giant magnetoresistance (GMR) at low temperatures. The GMR is related to a metal-insulator transition, and the value of the GMR depends on the value of the spin-orbit coupling. Inhomogeneous DyNiBi samples show a small positive MR at low temperature that depends on the amount of metallic impurities. At higher fields the samples show a

  13. Structure and properties of intermetallic ternary rare earth compounds

    Energy Technology Data Exchange (ETDEWEB)

    Casper, Frederick

    2008-12-17

    The so called material science is an always growing field in modern research. For the development of new materials not only the experimental characterization but also theoretical calculation of the electronic structure plays an important role. A class of compounds that has attracted a great deal of attention in recent years is known as REME compounds. These compounds are often referred to with RE designating rare earth, actinide or an element from group 1-4, M representing a late transition metal from groups 8-12, and E belonging to groups 13-15. There are more than 2000 compounds with 1:1:1 stoichiometry belonging to this class of compounds and they offer a broad variety of different structure types. Although many REME compounds are know to exist, mainly only structure and magnetism has been determined for these compounds. In particular, in the field of electronic and transport properties relatively few efforts have been made. The main focus in this study is on compounds crystallizing in MgAgAs and LiGaGe structure. Both structures can only be found among 18 valence electron compounds. The f electrons are localized and therefor not count as valence electrons. A special focus here was also on the magnetoresistance effects and spintronic properties found among the REME compounds. An examination of the following compounds was made: GdAuE (E=In,Cd,Mg), GdPdSb, GdNiSb, REAuSn (RE=Gd,Er,Tm) and RENiBi (RE=Pr,Sm,Gd-Tm,Lu). The experimental results were compared with theoretic band structure calculations. The first half metallic ferromagnet with LiGaGe structure (GdPdSb) was found. All semiconducting REME compounds with MgAgAs structure show giant magnetoresistance (GMR) at low temperatures. The GMR is related to a metal-insulator transition, and the value of the GMR depends on the value of the spin-orbit coupling. Inhomogeneous DyNiBi samples show a small positive MR at low temperature that depends on the amount of metallic impurities. At higher fields the samples show a

  14. Synergistic effect on co-gasification reactivity of biomass-petroleum coke blended char.

    Science.gov (United States)

    Wei, Juntao; Guo, Qinghua; Gong, Yan; Ding, Lu; Yu, Guangsuo

    2017-06-01

    In this work, effects of gasification temperature (900°C-1100°C) and blended ratio (3:1, 1:1, 1:3) on reactivity of petroleum coke and biomass co-gasification were studied in TGA. Quantification analysis of active AAEM transformation and in situ investigation of morphological structure variations in gasification were conducted respectively using inductively coupled plasma optical emission spectrometer and heating stage microscope to explore synergistic effect on co-gasification reactivity. The results indicated that char gasification reactivity was enhanced with increasing biomass proportion and gasification temperature. Synergistic effect on co-gasification reactivity was presented after complete generation of biomass ash, and gradually weakened with increasing temperature from 1000°C to 1100°C after reaching the most significant value at 1000°C. This phenomenon was well related with the appearance of molten biomass ash rich in glassy state potassium and the weakest inhibition effect on active potassium transformation during co-gasification at the temperature higher than 1000°C. Copyright © 2017 Elsevier Ltd. All rights reserved.

  15. Mechanical and structural properties of sputtered Ni/Ti multilayers

    Energy Technology Data Exchange (ETDEWEB)

    Senthil Kumar, M.; Boeni, P.; Tixier, S.; Clemens, D.; Horisberger, M. [Paul Scherrer Inst. (PSI), Villigen (Switzerland)

    1997-09-01

    Ni/Ti bilayers have been prepared by dc-magnetron sputtering in order to study their mechanical and structural properties. A remarkable reduction of stress is observed when the Ni layers are sputtered reactively in argon with a high partial pressure of air. The high angle x-ray diffraction studies show a tendency towards amorphisation of the Ni layers with increasing air flow. The low angle measurements indicate a substantial reduction of interdiffusion resulting in smoother interfaces with increasing air content. (author) 2 figs., 2 refs.

  16. Structural, electronic and optical properties of carbon nitride

    Energy Technology Data Exchange (ETDEWEB)

    Cohen, M L [California Univ., Berkeley (United States). Dept. of Physics

    1996-05-01

    Carbon nitride was proposed as a superhard material and a structural prototype, {beta}-C{sub 3}N{sub 4}, was examined using several theoretical models. Some reports claiming experimental verifications have been made recently. The current status of the theory and experiment is reviewed, and a detailed discussion is presented of calculations of the electronic and optical properties of this material. These calculations predict that {beta}-C{sub 3}N{sub 4} will have a minimum gap which is indirect at 6.4{+-}0.5 eV. A discussion of the possibility of carbon nitride nanotubes is also presented. (orig.)

  17. Optical constants and structural properties of thin gold films

    DEFF Research Database (Denmark)

    Yakubovsky, Dmitry I.; Arsenin, Aleksey V.; Stebunov, Yury V.

    2017-01-01

    We report a comprehensive experimental study of optical and electrical properties of thin polycrystalline gold films in a wide range of film thicknesses (from 20 to 200 nm). Our experimental results are supported by theoretical calculations based on the measured morphology of the fabricated gold...... rules for thin-film plasmonic and nanophotonic devices....... films. We demonstrate that the dielectric function of the metal is determined by its structural morphology. Although the fabrication process can be absolutely the same for different films, the dielectric function can strongly depend on the film thickness. Our studies show that the imaginary part...

  18. Alkyltributylphosphonium chloride ionic liquids: synthesis, physicochemical properties and crystal structure.

    Science.gov (United States)

    Adamová, Gabriela; Gardas, Ramesh L; Nieuwenhuyzen, Mark; Puga, Alberto V; Rebelo, Luís Paulo N; Robertson, Allan J; Seddon, Kenneth R

    2012-07-21

    A series of alkyltributylphosphonium chloride ionic liquids, prepared from tributylphosphine and the respective 1-chloroalkane, C(n)H(2n+1)Cl (where n = 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 12 or 14), is reported. This work is a continuation of an extended series of tetraalkylphosphonium ionic liquids, where the focus is on the variability of n and its impact on the physical properties, such as melting points/glass transitions, thermal stability, density and viscosity. Experimental density and viscosity data were interpreted using QPSR and group contribution methods and the crystal structure of propyl(tributyl)phosphonium chloride is detailed.

  19. Characterization, Microstructure, and Dielectric properties of cubic pyrochlore structural ceramics

    KAUST Repository

    Li, Yangyang

    2013-05-01

    The (BMN) bulk materials were sintered at 1050°C, 1100°C, 1150°C, 1200°C by the conventional ceramic process, and their microstructure and dielectric properties were investigated by Scanning electron microscopy (SEM), X-ray diffraction (XRD), Raman spectroscopy, Transmission electron microscopy (TEM) (including the X-ray energy dispersive spectrometry EDS and high resolution transmission electron microscopy HRTEM) and dielectric impedance analyzer. We systematically investigated the structure, dielectric properties and voltage tunable property of the ceramics prepared at different sintering temperatures. The XRD patterns demonstrated that the synthesized BMN solid solutions had cubic phase pyrochlore-type structure when sintered at 1050°C or higher, and the lattice parameter (a) of the unit cell in BMN solid solution was calculated to be about 10.56Å. The vibrational peaks observed in the Raman spectra of BMN solid solutions also confirmed the cubic phase pyrochlore-type structure of the synthesized BMN. According to the Scanning Electron Microscope (SEM) images, the grain size increased with increasing sintering temperature. Additionally, it was shown that the densities of the BMN ceramic tablets vary with sintering temperature. The calculated theoretical density for the BMN ceramic tablets sintered at different temperatures is about 6.7521 . The density of the respective measured tablets is usually amounting more than 91% and 5 approaching a maximum value of 96.5% for sintering temperature of 1150°C. The microstructure was investigated by using Scanning Transmission Electron Microscope (STEM), X-ray diffraction (XRD). Combined with the results obtained from the STEM and XRD, the impact of sintering temperature on the macroscopic and microscopic structure was discussed. The relative dielectric constant ( ) and dielectric loss ( ) of the BMN solid solutions were measured to be 161-200 and (at room temperature and 100Hz-1MHz), respectively. The BMN solid

  20. Effect of Structure on Physical Properties of Polymers.

    Science.gov (United States)

    1979-12-31

    PORT NUMBE . J ! 2. GOVT ACCESSION NO. 3. RECIPIENT’S CATALOG NUMBER OSRT R’.-8 00 7 5 0 4_7_5_ Effecc of Structure on Physical Properties of -Final...Compatibility of Fluorosubstituted Styrene Polymers with PPO and PS. R. Vukovic , F.E. Karasz, W.J. MacKnight, (in press). (6) Compatibility of Ortho- and Para...fluorostyrene Copolymers with PPO and PS. R. Vukovic , F.E. Karasz, W.J. MacKnight, (in press). (7) Partial Miscibility in the System Poly (para