WorldWideScience

Sample records for anomalous thermal expansion

  1. Anomalous thermal expansion in $\\alpha$-titanium

    OpenAIRE

    Souvatzis, P.; O. Eriksson; M. I. Katsnelson

    2007-01-01

    We provide a complete quantitative explanation for the anisotropic thermal expansion of hcp Ti at low temperature. The observed negative thermal expansion along the c-axis is reproduced theoretically by means of a parameter free theory which involves both the electron and phonon contributions to the free energy. The thermal expansion of titanium is calculated and found to be negative along the c-axis for temperatures below $\\sim$ 170 K, in good agreement with observations. We have identified ...

  2. Anomalous thermal expansion in rare-earth gallium perovskites: a comprehensive powder diffraction study

    Science.gov (United States)

    Senyshyn, A.; Trots, D. M.; Engel, J. M.; Vasylechko, L.; Ehrenberg, H.; Hansen, T.; Berkowski, M.; Fuess, H.

    2009-04-01

    Crystal structures of rare-earth gallium perovskites LaGaO3, PrGaO3, NdGaO3 and Pr1-xNdxGaO3 (x = 0.25, 0.50, 0.75) solid solutions were investigated in the temperature range 12-300 K by high-resolution powder diffraction using synchrotron or neutron radiation. The previously reported negative thermal expansion in the b direction of the PrGaO3 lattice has been found to be persistent in Pr1-xNdxGaO3 solid solutions and its magnitude has been revealed as proportional to the amount of praseodymium. Evaluation of the obtained temperature evolution of cell dimensions indicated a weak anomalous behaviour of the b lattice parameter in NdGaO3, and its origin is supposed to be the same as in PrGaO3, i.e. a coupling of the crystal electric field levels with phonon excitations of about 23-25 meV energy. The performed bond length analysis revealed an anomalous behaviour of both LnO12 (Ln—rare-earth) and GaO6 coordination polyhedra, which can be a structural manifestation of anomalous thermal expansion in the considered compounds.

  3. Anomalous thermal expansion in rare-earth gallium perovskites: a comprehensive powder diffraction study

    Energy Technology Data Exchange (ETDEWEB)

    Senyshyn, A; Trots, D M; Engel, J M; Ehrenberg, H; Fuess, H [Institute for Materials Science, Darmstadt University of Technology, D-64287 Darmstadt (Germany); Vasylechko, L [Lviv Polytechnic National University, 12 Bandera Street, 79013 Lviv (Ukraine); Hansen, T [Institut Max von Laue-Paul Langevin, 38042 Grenoble Cedex 9 (France); Berkowski, M [Institute of Physics, Polish Academy of Sciences, Aleja Lotnikow 32/46, 02-668 Warsaw (Poland)

    2009-04-08

    Crystal structures of rare-earth gallium perovskites LaGaO{sub 3}, PrGaO{sub 3}, NdGaO{sub 3} and Pr{sub 1-x}Nd{sub x}GaO{sub 3} (x = 0.25, 0.50, 0.75) solid solutions were investigated in the temperature range 12-300 K by high-resolution powder diffraction using synchrotron or neutron radiation. The previously reported negative thermal expansion in the b direction of the PrGaO{sub 3} lattice has been found to be persistent in Pr{sub 1-x}Nd{sub x}GaO{sub 3} solid solutions and its magnitude has been revealed as proportional to the amount of praseodymium. Evaluation of the obtained temperature evolution of cell dimensions indicated a weak anomalous behaviour of the b lattice parameter in NdGaO{sub 3}, and its origin is supposed to be the same as in PrGaO{sub 3}, i.e. a coupling of the crystal electric field levels with phonon excitations of about 23-25 meV energy. The performed bond length analysis revealed an anomalous behaviour of both LnO{sub 12} (Ln-rare-earth) and GaO{sub 6} coordination polyhedra, which can be a structural manifestation of anomalous thermal expansion in the considered compounds.

  4. Strong and Anomalous Thermal Expansion Precedes the Thermosalient Effect in Dynamic Molecular Crystals.

    Science.gov (United States)

    Panda, Manas K; Centore, Roberto; Causà, Mauro; Tuzi, Angela; Borbone, Fabio; Naumov, Panče

    2016-07-12

    The ability of thermosalient solids, organic analogues of inorganic martensites, to move by rapid mechanical reconfiguration or ballistic event remains visually appealing and potentially useful, yet mechanistically elusive phenomenon. Here, with a material that undergoes both thermosalient and non-thermosalient phase transitions, we demonstrate that the thermosalient effect is preceded by anomalous thermal expansion of the unit cell. The crystal explosion occurs as sudden release of the latent strain accumulated during the anisotropic, exceedingly strong expansion of the unit cell with αa = 225.9 × 10(-6) K(-1), αb = 238.8 × 10(-6) K(-1) and αc = -290.0 × 10(-6) K(-1), the latter being the largest negative thermal expansivity observed for an organic compound thus far. The results point out to the occurence of the thermosalient effect in phase transitions as means to identify new molecular materials with strong positive and/or negative thermal expansion which prior to this work could only be discovered serendipitously.

  5. Confined Water in Layered Silicates: The Origin of Anomalous Thermal Expansion Behavior in Calcium-Silicate-Hydrates.

    Science.gov (United States)

    Krishnan, N M Anoop; Wang, Bu; Falzone, Gabriel; Le Pape, Yann; Neithalath, Narayanan; Pilon, Laurent; Bauchy, Mathieu; Sant, Gaurav

    2016-12-28

    Water, under conditions of nanoscale confinement, exhibits anomalous dynamics, and enhanced thermal deformations, which may be further enhanced when such water is in contact with hydrophilic surfaces. Such heightened thermal deformations of water could control the volume stability of hydrated materials containing nanoconfined structural water. Understanding and predicting the thermal deformation coefficient (TDC, often referred to as the CTE, coefficient of thermal expansion), which represents volume changes induced in materials under conditions of changing temperature, is of critical importance for hydrated solids including: hydrogels, biological tissues, and calcium silicate hydrates, as changes in their volume can result in stress development, and cracking. By pioneering atomistic simulations, we examine the physical origin of thermal expansion in calcium-silicate-hydrates (C-S-H), the binding agent in concrete that is formed by the reaction of cement with water. We report that the TDC of C-S-H shows a sudden increase when the CaO/SiO2 (molar ratio; abbreviated as Ca/Si) exceeds 1.5. This anomalous behavior arises from a notable increase in the confinement of water contained in the C-S-H's nanostructure. We identify that confinement is dictated by the topology of the C-S-H's atomic network. Taken together, the results suggest that thermal deformations of hydrated silicates can be altered by inducing compositional changes, which in turn alter the atomic topology and the resultant volume stability of the solids.

  6. Phonons, nature of bonding, and their relation to anomalous thermal expansion behavior of M2O (M = Au, Ag, Cu)

    Science.gov (United States)

    Gupta, M. K.; Mittal, R.; Chaplot, S. L.; Rols, S.

    2014-03-01

    We report a comparative study of the dynamics of Cu2O, Ag2O, and Au2O (i.e., M2O with M = Au, Ag, and Cu) using first principle calculations based on the density functional theory. Here, for the first time, we show that the nature of chemical bonding and open space in the unit cell are directly related to the magnitude of thermal expansion coefficient. A good match between the calculated phonon density of states and that derived from inelastic neutron scattering measurements is obtained for Cu2O and Ag2O. The calculated thermal expansions of Ag2O and Cu2O are negative, in agreement with available experimental data, while it is found to be positive for Au2O. We identify the low energy phonon modes responsible for this anomalous thermal expansion. We further calculate the charge density in the three compounds and find that the magnitude of the ionic character of the Ag2O, Cu2O, and Au2O crystals is in decreasing order, with an Au-O bond of covalent nature strongly rigidifying the Au4O tetrahedral units. The nature of the chemical bonding is also found to be an important ingredient to understand the large shift of the phonon frequencies of these solids with pressure and temperature. In particular, the quartic component of the anharmonic term in the crystal potential is able to account for the temperature dependence of the phonon modes.

  7. Anomalous Thermalization in Ergodic Systems

    Science.gov (United States)

    Luitz, David J.; Bar Lev, Yevgeny

    2016-10-01

    It is commonly believed that quantum isolated systems satisfying the eigenstate thermalization hypothesis (ETH) are diffusive. We show that this assumption is too restrictive since there are systems that are asymptotically in a thermal state yet exhibit anomalous, subdiffusive thermalization. We show that such systems satisfy a modified version of the ETH ansatz and derive a general connection between the scaling of the variance of the off-diagonal matrix elements of local operators, written in the eigenbasis of the Hamiltonian, and the dynamical exponent. We find that for subdiffusively thermalizing systems the variance scales more slowly with system size than expected for diffusive systems. We corroborate our findings by numerically studying the distribution of the coefficients of the eigenfunctions and the off-diagonal matrix elements of local operators of the random field Heisenberg chain, which has anomalous transport in its thermal phase. Surprisingly, this system also has non-Gaussian distributions of the eigenfunctions, thus, directly violating Berry's conjecture.

  8. Negative thermal expansion

    Energy Technology Data Exchange (ETDEWEB)

    Barrera, G D [Departamento de QuImica, Universidad Nacional de la Patagonia SJB, Ciudad Universitaria, 9000 Comodoro Rivadavia (Argentina); Bruno, J A O [Universidad de Buenos Aires, Facultad de Ciencias Exactas y Naturales, Departamento de QuImica Inorganica, AnalItica y QuImica FIsica, Pabellon 2, Ciudad Universitaria, 1428 Buenos Aires (Argentina); Barron, T H K [School of Chemistry, University of Bristol, Cantock' s Close, Bristol BS8 1TS (United Kingdom); Allan, N L [School of Chemistry, University of Bristol, Cantock' s Close, Bristol BS8 1TS (United Kingdom)

    2005-02-02

    There has been substantial renewed interest in negative thermal expansion following the discovery that cubic ZrW{sub 2}O{sub 8} contracts over a temperature range in excess of 1000 K. Substances of many different kinds show negative thermal expansion, especially at low temperatures. In this article we review the underlying thermodynamics, emphasizing the roles of thermal stress and elasticity. We also discuss vibrational and non-vibrational mechanisms operating on the atomic scale that are responsible for negative expansion, both isotropic and anisotropic, in a wide range of materials. (topical review)

  9. Thermal Expansion "Paradox."

    Science.gov (United States)

    Fakhruddin, Hasan

    1993-01-01

    Describes a paradox in the equation for thermal expansion. If the calculations for heating a rod and subsequently cooling a rod are determined, the new length of the cool rod is shorter than expected. (PR)

  10. Thermal expansion of glassy polymers.

    Science.gov (United States)

    Davy, K W; Braden, M

    1992-01-01

    The thermal expansion of a number of glassy polymers of interest in dentistry has been studied using a quartz dilatometer. In some cases, the expansion was linear and therefore the coefficient of thermal expansion readily determined. Other polymers exhibited non-linear behaviour and values appropriate to different temperature ranges are quoted. The linear coefficient of thermal expansion was, to a first approximation, a function of both the molar volume and van der Waal's volume of the repeating unit.

  11. Isotropic Negative Thermal Expansion Metamaterials.

    Science.gov (United States)

    Wu, Lingling; Li, Bo; Zhou, Ji

    2016-07-13

    Negative thermal expansion materials are important and desirable in science and engineering applications. However, natural materials with isotropic negative thermal expansion are rare and usually unsatisfied in performance. Here, we propose a novel method to achieve two- and three-dimensional negative thermal expansion metamaterials via antichiral structures. The two-dimensional metamaterial is constructed with unit cells that combine bimaterial strips and antichiral structures, while the three-dimensional metamaterial is fabricated by a multimaterial 3D printing process. Both experimental and simulation results display isotropic negative thermal expansion property of the samples. The effective coefficient of negative thermal expansion of the proposed models is demonstrated to be dependent on the difference between the thermal expansion coefficient of the component materials, as well as on the circular node radius and the ligament length in the antichiral structures. The measured value of the linear negative thermal expansion coefficient of the three-dimensional sample is among the largest achieved in experiments to date. Our findings provide an easy and practical approach to obtaining materials with tunable negative thermal expansion on any scale.

  12. Thermal expansion anomaly regulated by entropy.

    Science.gov (United States)

    Liu, Zi-Kui; Wang, Yi; Shang, ShunLi

    2014-11-13

    Thermal expansion, defined as the temperature dependence of volume under constant pressure, is a common phenomenon in nature and originates from anharmonic lattice dynamics. However, it has been poorly understood how thermal expansion can show anomalies such as colossal positive, zero, or negative thermal expansion (CPTE, ZTE, or NTE), especially in quantitative terms. Here we show that changes in configurational entropy due to metastable micro(scopic)states can lead to quantitative prediction of these anomalies. We integrate the Maxwell relation, statistic mechanics, and first-principles calculations to demonstrate that when the entropy is increased by pressure, NTE occurs such as in Invar alloy (Fe3Pt, for example), silicon, ice, and water, and when the entropy is decreased dramatically by pressure, CPTE is expected such as in anti-Invar cerium, ice and water. Our findings provide a theoretic framework to understand and predict a broad range of anomalies in nature in addition to thermal expansion, which may include gigantic electrocaloric and electromechanical responses, anomalously reduced thermal conductivity, and spin distributions.

  13. Thermal Expansion of Polyurethane Foam

    Science.gov (United States)

    Lerch, Bradley A.; Sullivan, Roy M.

    2006-01-01

    Closed cell foams are often used for thermal insulation. In the case of the Space Shuttle, the External Tank uses several thermal protection systems to maintain the temperature of the cryogenic fuels. A few of these systems are polyurethane, closed cell foams. In an attempt to better understand the foam behavior on the tank, we are in the process of developing and improving thermal-mechanical models for the foams. These models will start at the microstructural level and progress to the overall structural behavior of the foams on the tank. One of the key properties for model characterization and verification is thermal expansion. Since the foam is not a material, but a structure, the modeling of the expansion is complex. It is also exacerbated by the anisoptropy of the material. During the spraying and foaming process, the cells become elongated in the rise direction and this imparts different properties in the rise direction than in the transverse directions. Our approach is to treat the foam as a two part structure consisting of the polymeric cell structure and the gas inside the cells. The polymeric skeleton has a thermal expansion of its own which is derived from the basic polymer chemistry. However, a major contributor to the thermal expansion is the volume change associated with the gas inside of the closed cells. As this gas expands it exerts pressure on the cell walls and changes the shape and size of the cells. The amount that this occurs depends on the elastic and viscoplastic properties of the polymer skeleton. The more compliant the polymeric skeleton, the more influence the gas pressure has on the expansion. An additional influence on the expansion process is that the polymeric skeleton begins to breakdown at elevated temperatures and releases additional gas species into the cell interiors, adding to the gas pressure. The fact that this is such a complex process makes thermal expansion ideal for testing the models. This report focuses on the thermal

  14. Low thermal expansion glass ceramics

    CERN Document Server

    1995-01-01

    This book is one of a series reporting on international research and development activities conducted by the Schott group of companies With the series, Schott aims to provide an overview of its activities for scientists, engineers, and managers from all branches of industry worldwide where glasses and glass ceramics are of interest Each volume begins with a chapter providing a general idea of the current problems, results, and trends relating to the subjects treated This volume describes the fundamental principles, the manufacturing process, and applications of low thermal expansion glass ceramics The composition, structure, and stability of polycrystalline materials having a low thermal expansion are described, and it is shown how low thermal expansion glass ceramics can be manufactured from appropriately chosen glass compositions Examples illustrate the formation of this type of glass ceramic by utilizing normal production processes together with controlled crystallization Thus glass ceramics with thermal c...

  15. Low Thermal Expansion Glass Ceramics

    CERN Document Server

    Bach, Hans

    2005-01-01

    This book appears in the authoritative series reporting the international research and development activities conducted by the Schott group of companies. This series provides an overview of Schott's activities for scientists, engineers, and managers from all branches of industry worldwide in which glasses and glass ceramics are of interest. Each volume begins with a chapter providing a general idea of the current problems, results, and trends relating to the subjects treated. This new extended edition describes the fundamental principles, the manufacturing process, and applications of low thermal expansion glass ceramics. The composition, structure, and stability of polycrystalline materials having a low thermal expansion are described, and it is shown how low thermal expansion glass ceramics can be manufactured from appropriately chosen glass compositions. Examples illustrate the formation of this type of glass ceramic by utilizing normal production processes together with controlled crystallization. Thus g...

  16. Contribution of thermal expansion and

    Directory of Open Access Journals (Sweden)

    O.I.Pursky

    2007-01-01

    Full Text Available A theoretical model is developed to describe the experimental results obtained for the isobaric thermal conductivity of rare gas solids (RGS. The isobaric thermal conductivity of RGS has been analysed within Debye approximation with regard to the effect of thermal expansion. The suggested model takes into consideration the fact that thermal conductivity is determined by U-processes while above the phonon mobility edge it is determined by "diffusive" modes migrating randomly from site to site. The mobility edge ω0 is determined from the condition that the phonon mean-free path restricted by the U-processes cannot be smaller than half of the phonon wavelength.

  17. Micromechanics analysis of thermal expansion and thermal pressurization of a hardened cement paste

    CERN Document Server

    Ghabezloo, Siavash

    2011-01-01

    The results of a macro-scale experimental study of the effect of heating on a fluid-saturated hardened cement paste are analysed using a multi-scale homogenization model. The analysis of the experimental results revealed that the thermal expansion coefficient of the cement paste pore fluid is anomalously higher than the one of pure bulk water. The micromechanics model is calibrated using the results of drained and undrained heating tests and permits the extrapolation of the experimentally evaluated thermal expansion and thermal pressurization parameters to cement pastes with different water-to-cement ratios. It permits also to calculate the pore volume thermal expansion coefficient f a which is difficult to evaluate experimentally. The anomalous pore fluid thermal expansion is also analysed using the micromechanics model.

  18. Thermal Expansion of Hafnium Carbide

    Science.gov (United States)

    Grisaffe, Salvatore J.

    1960-01-01

    Since hafnium carbide (HfC) has a melting point of 7029 deg. F, it may have many high-temperature applications. A literature search uncovered very little information about the properties of HfC, and so a program was initiated at the Lewis Research Center to determine some of the physical properties of this material. This note presents the results of the thermal expansion investigation. The thermal-expansion measurements were made with a Gaertner dilatation interferometer calibrated to an accuracy of +/- 1 deg. F. This device indicates expansion by the movement of fringes produced by the cancellation and reinforcement of fixed wave-length light rays which are reflected from the surfaces of two parallel quartz glass disks. The test specimens which separate these disks are three small cones, each approximately 0.20 in. high.

  19. Bearing-Mounting Concept Accommodates Thermal Expansion

    Science.gov (United States)

    Nespodzany, Robert; Davis, Toren S.

    1995-01-01

    Pins or splines allow radial expansion without slippage. Design concept for mounting rotary bearing accommodates differential thermal expansion between bearing and any structure(s) to which bearing connected. Prevents buildup of thermal stresses by allowing thermal expansion to occur freely but accommodating expansion in such way not to introduce looseness. Pin-in-slot configuration also maintains concentricity.

  20. The Thermal Expansion Of Feldspars

    Science.gov (United States)

    Hovis, G. L.; Medford, A.; Conlon, M.

    2009-12-01

    Hovis and others (1) investigated the thermal expansion of natural and synthetic AlSi3 feldspars and demonstrated that the coefficient of thermal expansion (α) decreases significantly, and linearly, with increasing room-temperature volume (VRT). In all such feldspars, therefore, chemical expansion limits thermal expansion. The scope of this work now has been broadened to include plagioclase and Ba-K feldspar crystalline solutions. X-ray powder diffraction data have been collected between room temperature and 925 °C on six plagioclase specimens ranging in composition from anorthite to oligoclase. When combined with thermal expansion data for albite (2,3,4) a steep linear trend of α as a function of VRT emerges, reflecting how small changes in composition dramatically affect expansion behavior. The thermal expansion data for five synthetic Ba-K feldspars ranging in composition from 20 to 100 mole percent celsian, combined with data for pure K-feldspar (3,4), show α-VRT relationships similar in nature to the plagioclase series, but with a slope and intercept different from the latter. Taken as a group all Al2Si2 feldspars, including anorthite and celsian from the present study along with Sr- (5) and Pb-feldspar (6) from other workers, show very limited thermal expansion that, unlike AlSi3 feldspars, has little dependence on the divalent-ion (or M-) site occupant. This apparently is due to the necessitated alternation of Al and Si in the tetrahedral sites of these minerals (7), which in turn locks the tetrahedral framework and makes the M-site occupant nearly irrelevant to expansion behavior. Indeed, in feldspar series with coupled chemical substitution it is the change away from a 1:1 Al:Si ratio that gives feldspars greater freedom to expand. Overall, the relationships among α, chemical composition, and room-temperature volume provide useful predictive tools for estimating feldspar thermal expansion and give insight into the controls of expansion behavior in

  1. Thermal Expansion of Irradiated Polytetrafluoroethylene

    OpenAIRE

    Subrahmanyam, HN; Subramanyam, SV

    1987-01-01

    The thermal expansion coefficient of gamma-irradiated Polytetrafluoroethylene (PTFE) has been measured in the temperature range 80-340 K by using a three-terminal capacitance technique. The samples are irradiated in air at room temperature with gamma rays from a $Co^{60}$ source at a dose rate of 0.26 Mrad/h. The change in crystallinity is measured by an x-ray technique. The expansion coefficient is found to increase with radiation dose below 140 K owing to the predominant effect of degradati...

  2. Thermal expansion of ceramics around room temperature

    OpenAIRE

    橋本, 忍; 安達, 信泰; 太田, 敏孝; 宮崎, 英敏; ハシモト, シノブ; アダチ, ノブヤス; オオタ, トシタカ; Hashimoto, Shinobu; Adachi, Nobuyasu; Ota, Toshitaka

    2010-01-01

    Thermal expansion of some ceramics, polymers and metals was measured by dilatometer around room temperature (from -140℃to +200℃), and compared with thermal expansion in the high temperature region. The CTE (coefficient of thermal expansion)of almost ceramics changed drastically between room temperature and high temperature region. On the other hand, the CTE ofmetals did not change between room temperature and high temperature region. The difference on thermal expansion betweenceramics and met...

  3. Thermal Expansion in YbGaGe

    OpenAIRE

    Bobev, Svilen; Williams, Darrick J.; Thompson, J.D.; Sarrao, J L

    2004-01-01

    Thermal expansion and magnetic susceptibility measurements as a function of temperature are reported for YbGaGe. Despite the fact that this material has been claimed to show zero thermal expansion over a wide temperature range, we observe thermal expansion typical of metals and Pauli paramagnetic behavior, which perhaps indicates strong sample dependence in this system.

  4. Pressurized electrolysis stack with thermal expansion capability

    Science.gov (United States)

    Bourgeois, Richard Scott

    2015-07-14

    The present techniques provide systems and methods for mounting an electrolyzer stack in an outer shell so as to allow for differential thermal expansion of the electrolyzer stack and shell. Generally, an electrolyzer stack may be formed from a material with a high coefficient of thermal expansion, while the shell may be formed from a material having a lower coefficient of thermal expansion. The differences between the coefficients of thermal expansion may lead to damage to the electrolyzer stack as the shell may restrain the thermal expansion of the electrolyzer stack. To allow for the differences in thermal expansion, the electrolyzer stack may be mounted within the shell leaving a space between the electrolyzer stack and shell. The space between the electrolyzer stack and the shell may be filled with a non-conductive fluid to further equalize pressure inside and outside of the electrolyzer stack.

  5. Novel thermal expansion of lead titanate

    Institute of Scientific and Technical Information of China (English)

    XING Xianran; DENG Jinxia; CHEN Jun; LIU Guirong

    2003-01-01

    Lattice parameters of lead titanate were precisely re-determined in the ternperature range of-150-950℃ by high precision XRPD measurements. It was clarified that there was no any evidence for a new phase transition at low temperatures. Tetragonal distortion strain decreases with temperature increasing. A novel thermal expansion was observed, positive thermal expansion from-150℃ to room temperature (RT) and above 490℃, and the negative thermal expansion in the temperature range of RT-490℃. A big jump of thermal expansion coefficient is attributed to the tetragonal-cubic phase transition. A rationalization for the negative thermal expansion of PbTiO3 is due to the decrease of anion-anion repulsion as polyhedra become more regular at heating. The mechanisms of positive and negative thermal expansions were elucidated as the same nature in the homogenous tetragonal phase at present case.

  6. Hydration and Thermal Expansion in Anatase Nanoparticles.

    Science.gov (United States)

    Zhu, He; Li, Qiang; Ren, Yang; Fan, Longlong; Chen, Jun; Deng, Jinxia; Xing, Xianran

    2016-08-01

    A tunable thermal expansion is reported in nanosized anatase by taking advantage of surface hydration. The coefficient of thermal expansion of 4 nm TiO2 along a-axis is negative with a hydrated surface and is positive without a hydrated surface. High-energy synchrotron X-ray pair distribution function analysis combined with ab initio calculations on the specific hydrated surface are carried out to reveal the local structure distortion that is responsible for the unusual negative thermal expansion.

  7. Hydration and Thermal Expansion in Anatase Nanoparticles

    Energy Technology Data Exchange (ETDEWEB)

    Zhu, He [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China; Li, Qiang [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China; Ren, Yang [Argonne National Laboratory, X-Ray Science Division, Argonne IL 60439 USA; Fan, Longlong [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China; Chen, Jun [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China; Deng, Jinxia [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China; Xing, Xianran [Department of Physical Chemistry, University of Science and Technology Beijing, Beijing 100083 China

    2016-06-06

    A tunable thermal expansion is reported in nanosized anatase by taking advantage of surface hydration. The coefficient of thermal expansion of 4 nm TiO2 along a-axis is negative with a hydrated surface and is positive without a hydrated surface. High-energy synchrotron X-ray pair distribution function analysis combined with ab initio calculations on the specific hydrated surface are carried out to reveal the local structure distortion that is responsible for the unusual negative thermal expansion.

  8. Structure and thermal expansion of liquid bismuth

    Directory of Open Access Journals (Sweden)

    Mudry S.

    2015-12-01

    Full Text Available Experimental structural data for liquid Bi were used for estimation of the main structure parameters as well as the thermal expansion coefficient both in supercooled and superheated temperature ranges. It was shown that the equilibrium melt had a positive thermal expansion coefficient within a temperature range upon melting and a negative one at higher temperatures. The former was related to structure changes upon melting, whereas the latter with topologic disordering upon further heating. It was found that the superheated melt had a negative thermal expansion coefficient. The results obtained from structural data were compared with the thermal expansion coefficient calculated from the data of density for liquid Bi.

  9. Ab initio study of the phononic origin of negative thermal expansion

    Science.gov (United States)

    Argaman, Uri; Eidelstein, Eitan; Levy, Ohad; Makov, Guy

    2016-11-01

    Negative thermal expansion is an uncommon phenomenon of theoretical interest. Multiple hypotheses regarding its microscopic origins have been suggested. In this paper, the thermal expansion of a representative semiconductor, Si, and a representative metal, Ti, are calculated ab initio using density-functional perturbation theory. The phonon modes' contributions to the thermal expansion are analyzed and the negative thermal expansion is shown to be dominated by negative mode Grüneisen parameters at specific points on the Brillouin zone boundaries. Thus, the elastic (Debye) theory for negative thermal expansion is shown to be irrelevant for these phenomena. The anomalous behavior of these modes in Ti is shown to be unaffected by an electronic topological transition as previously suggested, instead it arises from complex interplay of atomic displacements of the anomalous mode.

  10. Negative thermal expansion materials: technological key for control of thermal expansion

    OpenAIRE

    Koshi Takenaka

    2012-01-01

    Most materials expand upon heating. However, although rare, some materials contract upon heating. Such negative thermal expansion (NTE) materials have enormous industrial merit because they can control the thermal expansion of materials. Recent progress in materials research enables us to obtain materials exhibiting negative coefficients of linear thermal expansion over −30 ppm K−1. Such giant NTE is opening a new phase of control of thermal expansion in composites. Specifically examining pra...

  11. Giant negative thermal expansion in magnetic nanocrystals.

    Science.gov (United States)

    Zheng, X G; Kubozono, H; Yamada, H; Kato, K; Ishiwata, Y; Xu, C N

    2008-12-01

    Most solids expand when they are heated, but a property known as negative thermal expansion has been observed in a number of materials, including the oxide ZrW2O8 (ref. 1) and the framework material ZnxCd1-x(CN)2 (refs 2,3). This unusual behaviour can be understood in terms of low-energy phonons, while the colossal values of both positive and negative thermal expansion recently observed in another framework material, Ag3[Co(CN)6], have been explained in terms of the geometric flexibility of its metal-cyanide-metal linkages. Thermal expansion can also be stopped in some magnetic transition metal alloys below their magnetic ordering temperature, a phenomenon known as the Invar effect, and the possibility of exploiting materials with tuneable positive or negative thermal expansion in industrial applications has led to intense interest in both the Invar effect and negative thermal expansion. Here we report the results of thermal expansion experiments on three magnetic nanocrystals-CuO, MnF2 and NiO-and find evidence for negative thermal expansion in both CuO and MnF2 below their magnetic ordering temperatures, but not in NiO. Larger particles of CuO and MnF2 also show prominent magnetostriction (that is, they change shape in response to an applied magnetic field), which results in significantly reduced thermal expansion below their magnetic ordering temperatures; this behaviour is not observed in NiO. We propose that the negative thermal expansion effect in CuO (which is four times larger than that observed in ZrW2O8) and MnF2 is a general property of nanoparticles in which there is strong coupling between magnetism and the crystal lattice.

  12. Micromechanics analysis of thermal expansion and thermal pressurization of a hardened cement paste

    OpenAIRE

    Ghabezloo, Siavash

    2011-01-01

    International audience; The results of a macro-scale experimental study of the effect of heating on a fluid-saturated hardened cement paste are analysed using a multi-scale homogenization model. The analysis of the experimental results revealed that the thermal expansion coefficient of the cement paste pore fluid is anomalously higher than the one of pure bulk water. The micromechanics model is calibrated using the results of drained and undrained heating tests and permits the extrapolation o...

  13. Thermal expansion coefficient of binary semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Kumar, V.; Sastry, B.S.R. [Indian School of Mines, Dhanbad (India). Dept. of Electronics and Instrumentation

    2001-07-01

    The linear thermal expansion coefficient of tetrahedrally coordinated A{sup II}B{sup VI} and A{sup III}B{sup V} semiconductors has been calculated using plasmon energy data. A simple relation between the bond length and plasmon energy has been derived. The calculated values of thermal expansion coefficient and bond length have been compared with the experimental values and the values reported by different workers. An excellent experiment has been obtained between them. (orig.)

  14. Thermal Expansion Coefficients of Thin Crystal Films

    Institute of Scientific and Technical Information of China (English)

    2005-01-01

    The formulas for atomic displacements and Hamiltonian of a thin crystal film in phonon occupation number representation are obtained with the aid of Green's function theory. On the basis of these results, the formulas for thermal expansion coefficients of the thin crystal film are derived with the perturbation theory, and the numerical calculations are carried out. The results show that the thinner films have larger thermal expansion coefficients.

  15. Thermal expansion of doped lanthanum gallates

    Indian Academy of Sciences (India)

    K T Jacob; S Jain; V S Saji; P V K Srikanth

    2010-08-01

    Thermal expansion of several compositions of Sr and Mg-doped LaGaO3 including an -site deficient composition (La0.9Sr0.1)0.98(Ga0.8Mg0.2)O2.821 were measured in the temperature range from 298 to 1273 K. The effect of doping on thermal expansion was studied by varying the composition at one site of the perovskite structure (either or ), while keeping the composition at the other site invariant. Thermal expansion varied nonlinearly with temperature and exhibited an inflexion between 550 and 620 K, probably related to the change in crystal structure from orthorhombic to rhombohedral. The dependence of average thermal expansion coefficient (av) on the dopant concentration on either or site of the perovskite structure was found to be linear, when the composition at the other site was kept constant. Mg doping on the -site had a greater effect on the average thermal expansion coefficient than Sr doping on the -site. Cation deficiency at the -site decreases thermal expansion when compositions at both sites are held constant.

  16. Negative thermal expansion materials: technological key for control of thermal expansion.

    Science.gov (United States)

    Takenaka, Koshi

    2012-02-01

    Most materials expand upon heating. However, although rare, some materials contract upon heating. Such negative thermal expansion (NTE) materials have enormous industrial merit because they can control the thermal expansion of materials. Recent progress in materials research enables us to obtain materials exhibiting negative coefficients of linear thermal expansion over -30 ppm K(-1). Such giant NTE is opening a new phase of control of thermal expansion in composites. Specifically examining practical aspects, this review briefly summarizes materials and mechanisms of NTE as well as composites containing NTE materials, based mainly on activities of the last decade.

  17. Fuel Thermal Expansion (FTHEXP). [BWR; PWR

    Energy Technology Data Exchange (ETDEWEB)

    Reymann, G. A.

    1978-07-01

    A model is presented which deals with dimensional changes in LWR fuel pellets caused by changes in temperature. It is capable of dealing with any combination of UO/sub 2/ and PuO/sub 2/ in solid, liquid or mixed phase states, and includes expansion due to the solid-liquid phase change. The function FTHEXP models fuel thermal expansion as a function of temperature, fraction of PuO/sub 2/, and the fraction of fuel which is molten.

  18. Low-Thermal-Expansion Filled Polytetrafluoroethylene

    Science.gov (United States)

    Shapiro, Sanford S.

    1989-01-01

    PTFE made thermally compatible with aluminum without changing dielectric constant. Manufactured with fillers and pores to reduce coefficient of thermal expansion by factor of 6 to match aluminum. Material retains 2.1 dielectric constant of pure PTFE. Combines filler and micropore concepts. Particles and voids embedded in PTFE matrix function cooperatively. Particles take up compressive stress imposed by contracting PTFE, and voids take up expanding material. Increases dielectric constant, while voids reduce it.

  19. Method of assembling a thermal expansion compensator

    Science.gov (United States)

    Determan, William (Inventor); Matejczyk, Daniel Edward (Inventor)

    2012-01-01

    A thermal expansion compensator is provided and includes a first electrode structure having a first surface, a second electrode structure having a second surface facing the first surface and an elastic element bonded to the first and second surfaces and including a conductive element by which the first and second electrode structures electrically and/or thermally communicate, the conductive element having a length that is not substantially longer than a distance between the first and second surfaces.

  20. Plastic Sealed Thermal Expansion Packer for Thermal Recovery

    Institute of Scientific and Technical Information of China (English)

    Liu Li; Jiang Hua

    1995-01-01

    @@ According to the requirements of wellbore heatinsulation technique and selective zonal steaminjection technique in heavy-oil steam-injection recovery process, the Oil Recovery Technique Department of Liaohe Petroleum Exploration and Production Bureau and Shuguang Oil Recovery Plant have cooperatively designed and developed a plastic sealed thermal expansion packer for thermal recovery.

  1. Thermal Expansion of Vacuum Plasma Sprayed Coatings

    Science.gov (United States)

    Raj, S V.; Palczer, A. R.

    2010-01-01

    Metallic Cu-8%Cr, Cu-26%Cr, Cu-8%Cr-1%Al, NiAl and NiCrAlY monolithic coatings were fabricated by vacuum plasma spray deposition processes for thermal expansion property measurements between 293 and 1223 K. The corrected thermal expansion, (DL/L(sub 0) varies with the absolute temperature, T, as (DL/L(sub 0) = A(T - 293)(sup 3) + BIT - 293)(sup 2) + C(T - 293) + D, where, A, B, C and D are thermal, regression constants. Excellent reproducibility was observed for all of the coatings except for data obtained on the Cu-8%Cr and Cu-26%Cr coatings in the first heat-up cycle, which deviated from those determined in the subsequent cycles. This deviation is attributed to the presence of residual stresses developed during the spraying of the coatings, which are relieved after the first heat-up cycle. In the cases of Cu-8%Cr and NiAl, the thermal expansion data were observed to be reproducible for three specimens. The linear expansion data for Cu-8% Cr and Cu-26%Cr agree extremely well with rule of mixture (ROM) predictions. Comparison of the data for the Cu-8%Cr coating with literature data for Cr and Cu revealed that the thermal expansion behavior of this alloy is determined by the Cu-rich matrix. The data for NiAl and NiCrAlY are in excellent agreement with published results irrespective of composition and the methods used for processing the materials. The implications of these results on coating GRCop-84 copper alloy combustor liners for reusable launch vehicles are discussed.

  2. Principles of Thermal Expansion in Feldspars

    Science.gov (United States)

    Hovis, Guy; Medford, Aaron; Conlon, Maricate; Tether, Allison; Romanoski, Anthony

    2010-05-01

    Following the recent thermal expansion work of Hovis et al. (1) on AlSi3 feldspars, we have investigated the thermal expansion of plagioclase, Ba-K, and Ca-K feldspar crystalline solutions. X-ray powder diffraction data were collected between room temperature and 925 °C on six natural plagioclase specimens ranging in composition from anorthite to oligoclase, the K-exchanged equivalents of these plagioclase specimens, and five synthetic Ba-K feldspars with compositions ranging from 25 to 99 mol % BaAl2Si2O8. The resulting thermal expansion coefficients (α) for volume have been combined with earlier results for end-member Na- and K-feldspars (2,3). Unlike AlSi3 feldspars, Al2Si2 feldspars, including anorthite and celsian from the present study plus Sr- and Pb-feldspar from other workers (4,5), show essentially constant and very limited thermal expansion, regardless of divalent cation size. In the context of structures where the Lowenstein rule (6) requires Al and Si to alternate among tetrahedra, the proximity of bridging Al-O-Si oxygen ions to divalent neighbors (ranging from 0 to 2) produces short Ca-O (or Ba-O) bonds (7,8) that apparently are the result of local charge-balance requirements (9). Gibbs et al. (10) suggest that short bonds such as these have a partially covalent character. This in turn stiffens the structure. Thus, for feldspar series with coupled substitution the change away from a purely divalent M-site occupant gives the substituting (less strongly bonded) monovalent cations increasingly greater influence on thermal expansion. Overall, then, thermal expansion in the feldspar system is well represented on a plot of α against room-temperature volume, where one sees a quadrilateral bounded by data for (A) AlSi3 feldspars whose expansion behavior is controlled largely by the size of the monovalent alkali-site occupant, (B) Al2Si2 feldspars whose expansion is uniformly limited by partially-covalent bonds between divalent M-site occupants and

  3. Tunable thermal expansion in framework materials through redox intercalation.

    Science.gov (United States)

    Chen, Jun; Gao, Qilong; Sanson, Andrea; Jiang, Xingxing; Huang, Qingzhen; Carnera, Alberto; Rodriguez, Clara Guglieri; Olivi, Luca; Wang, Lei; Hu, Lei; Lin, Kun; Ren, Yang; Lin, Zheshuai; Wang, Cong; Gu, Lin; Deng, Jinxia; Attfield, J Paul; Xing, Xianran

    2017-02-09

    Thermal expansion properties of solids are of fundamental interest and control of thermal expansion is important for practical applications but can be difficult to achieve. Many framework-type materials show negative thermal expansion when internal cages are empty but positive thermal expansion when additional atoms or molecules fill internal voids present. Here we show that redox intercalation offers an effective method to control thermal expansion from positive to zero to negative by insertion of Li ions into the simple negative thermal expansion framework material ScF3, doped with 10% Fe to enable reduction. The small concentration of intercalated Li ions has a strong influence through steric hindrance of transverse fluoride ion vibrations, which directly controls the thermal expansion. Redox intercalation of guest ions is thus likely to be a general and effective method for controlling thermal expansion in the many known framework materials with phonon-driven negative thermal expansion.

  4. Preliminary thermal expansion screening data for tuffs

    Energy Technology Data Exchange (ETDEWEB)

    Lappin, A.R.

    1980-03-01

    A major variable in evaluating the potential of silicic tuffs for use in geologic disposal of heat-producing nuclear wastes is thermal expansion. Results of ambient-pressure linear expansion measurements on a group of tuffs that vary treatly in porosity and mineralogy are presente here. Thermal expansion of devitrified welded tuffs is generally linear with increasing temperature and independent of both porosity and heating rate. Mineralogic factors affecting behavior of these tuffs are limited to the presence or absence of cristobalite and altered biotite. The presence of cristobalite results in markedly nonlinear expansion above 200{sup 0}C. If biotite in biotite-hearing rocks alters even slightly to expandable clays, the behavior of these tuffs near the boiling point of water can be dominated by contraction of the expandable phase. Expansion of both high- and low-porosity tuffs containing hydrated silicic glass and/or expandable clays is complex. The behavior of these rocks appears to be completely dominated by dehydration of hydrous phases and, hence, should be critically dependent on fluid pressure. Valid extrapolation of the ambient-pressure results presented here to depths of interest for construction of a nuclear-waste repository will depend on a good understanding of the interaction of dehydration rates and fluid pressures, and of the effects of both micro- and macrofractures on the response of tuff masss.

  5. Thermal Expansion Anomaly in TTB Ferroelectrics: The Interplay between Framework Structure and Electric Polarization.

    Science.gov (United States)

    Lin, Kun; You, Li; Li, Qiang; Chen, Jun; Deng, Jinxia; Xing, Xianran

    2016-08-15

    Tetragonal tungsten bronze (TTB) makes up a large family of functional materials with fascinating dielectric, piezoelectric, or ferroelectric properties. Understanding the thermal expansion mechanisms associated with their physical properties is important for their practical applications as well as theoretical investigations. Fortunately, the appearance of anomalous thermal expansion in functional materials offers a chance to capture the physics behind them. Herein, we report an investigation of the thermal expansion anomalies in TTBs that are related to ferroelectric transitions and summarize recent progress in this field. The special role of Pb(2+) cation is elucidated. The interplay between the thermal expansion anomaly, electric polarization, and framework structure provides new insight into the structure-property relationships in functional materials.

  6. Graphite thermal expansion reference for high temperature

    Science.gov (United States)

    Gaal, P. S.

    1974-01-01

    The design requirements of the aerospace and high-temperature nuclear reactor industries necessitate reliable thermal expansion data for graphite and other carbonaceous materials. The feasibility of an acceptable reference for calibration of expansion measuring systems that operate in carbon-rich atmospheres at temperatures ranging to 2500 C is the prime subject of this work. Present-day graphite technology provides acceptable materials for stable, reproducible references, as reflected by some of the candidate materials. The repeatability for a single specimen in a given expansion measuring system was found to be plus or minus 1%, while the combined results of several tests made on a number of samples fell within a plus or minus 2.5% band.

  7. Thermal expansion in lead zirconate titanate

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The volume anomalies with temperature variations in tin-modified lead zirconate titanate ceramics are investigated. Experimental results show that the volume changes are related to the phase transitions induced with temperature. The magnitude and orientation of crystal volume changes are dependent on the particular phase transition. When antiferroelectrics is transformed to ferroelectrics or paraelectrics the volume expands. Oppositely when ferroelectrics is transformed to antiferroelectrics or paraelectrics the volume contracts. In the transition of antiferroelectric orthorhombic structure to tetragonal structure or ferroelectric low-temperature rhombohedral structure to high-tem- perature rhombohedral structure, there are also revealed apparent anomalies in the curves of thermal expansion. Among them, the volume strain caused by the transition between antiferroelectrics and ferroelectrics is the biggest in magnitude, and the linear expansion dL/L0 and the expansion coefficient (dL/L0)/dT can reach 2.810?3 and 7.5 × 10?4 K?1 respectively.

  8. Negative thermal expansion in framework compounds

    Indian Academy of Sciences (India)

    R Mittal

    2008-10-01

    We have studied negative thermal expansion (NTE) compounds with chemi- cal compositions of NX2O8 and NX2O7 (N=Zr, Hf and X=W, Mo, V) and M2O (M=Cu, Ag) using the techniques of inelastic neutron scattering and lattice dynamics. There is a large variation in the negative thermal expansion coefficients of these compounds. The inelastic neutron scattering experiments have been carried out using polycrystalline and single crystal samples at ambient pressure as well as at high pressures. Experimental data are useful to confirm the predictions made from our lattice dynamical calculations as well as to check the quality of the interatomic potentials developed by us. We have been able to successfully model the NTE behaviour of these compounds. Our studies show that unusual phonon softening of low energy modes is able to account for NTE in these compounds.

  9. Spontaneous thermal expansion of nematic elastomers

    OpenAIRE

    Tajbakhsh, A. R.; Terentjev, E.M.

    2001-01-01

    We study the monodomain (single-crystal) nematic elastomer materials, all side-chain siloxane polymers with the same mesogenic groups and crosslinking density, but differing in the type of crosslinking. Increasing the proportion of long di-functional segments of main-chain nematic polymer, acting as network crosslinking, results in dramatic changes in the uniaxial equilibrium thermal expansion on cooling from isotropic phase. At higher concentration of main chains their behaviour dominates th...

  10. Frequency dependent thermal expansion in binary viscoelasticcomposites

    Energy Technology Data Exchange (ETDEWEB)

    Berryman, James G.

    2007-12-01

    The effective thermal expansion coefficient beta* of abinary viscoelastic composite is shown to be frequency dependent even ifthe thermal expansion coefficients beta A and beta B of both constituentsare themselves frequency independent. Exact calculations for binaryviscoelastic systems show that beta* is related to constituent valuesbeta A, beta B, volume fractions, and bulk moduli KA, KB, as well as tothe overall bulk modulus K* of the composite system. Then, beta* isdetermined for isotropic systems by first bounding (or measuring) K* andtherefore beta*. For anisotropic systems with hexagonal symmetry, theprincipal values of the thermal expansion beta*perp and beta*para can bedetermined exactly when the constituents form a layered system. In allthe examples studied, it is shown explicitly that the eigenvectors of thethermoviscoelastic system possess non-negative dissipation -- despite thecomplicated analytical behavior of the frequency dependent thermalexpansivities themselves. Methods presented have a variety ofapplications from fluid-fluid mixtures to fluid-solid suspensions, andfrom fluid-saturated porous media to viscoelastic solid-solidcomposites.

  11. Thermal expansion of YBa2Cu3O7 single crystals

    Science.gov (United States)

    Aleksandrov, I. V.; Zibrov, I. P.; Stishov, S. M.

    1990-09-01

    The thermal expansion of a YBa2Cu3O7 single crystal was investigated by X-ray diffraction analysis at temperatures from 4 to 180 K. During the experiment, the crystal was glued to a beryllium plate coupled with a copper block inside the vacuum chamber of a helium cryostat. The temperature of the specimen was stabilized to within 0.01 K. The temperature was measured by using a platinum resistance thermometer. It is shown that the crystal is characterized by an anomalous behavior of the thermal expansion coefficient in the direction parallel to the Cu-O chains.

  12. 6th International Symposium on Thermal Expansion

    CERN Document Server

    1978-01-01

    This 6th International Symposium on Thermal Expansion, the first outside the USA, was held on August 29-31, 1977 at the Gull Harbour Resort on Hecla Island, Manitoba, Canada. Symposium Chairman was Ian D. Peggs, Atomic Energy of Canada Limited, and our continuing sponsor was CINDAS/Purdue University. We made considerable efforts to broaden the base this year to include more users of expansion data but with little success. We were successful, however, in establishing a session on liquids, an area which is receiving more attention as a logical extension to the high-speed thermophysical property measurements on materials at temperatures close to their melting points. The Symposium had good international representation but the overall attendance was, disappointingly, relatively low. Neverthe­ less, this enhanced the informal atmosphere throughout the meeting with a resultant frank exchange of information and ideas which all attendees appreciated. A totally new item this year was the presentation of a bursary to ...

  13. Estimation of thermal expansion properties of quasicrystalline alloys

    Institute of Scientific and Technical Information of China (English)

    齐育红; 张占平; 黑祖昆

    2004-01-01

    By investigating the thermal expansion properties of three quasicrystalline alloys Al65 Cu20 Cr15 quenched,Al65Cu20Cr15 cast and Al65Cu20Fe15 cast particles reinforced Al matrix composites from 25 ℃ to 500 ℃, the thermal expansion coefficients of three quasicrystalline alloys were theoretically estimated. The results show that the thermal expansion coefficients of the composites are much lower than that of pure Al, and the thermal expansion coefficients of the composites reinforced by Al-Cu-Cr quasicrystalline particles are lower than those of the composites reinforced by Al-Cu-Fe quasicrystalline particles. According to estimating, quasicrystalline alloys have negative thermal expansion coefficients, and the thermal expansion coefficients of Al-Cu-Cr quasicrystalline alloys are lower than those of Al-Cu-Fe quasicrystalline alloys. In the alloys, the more the qusicrystalline content, the lower the thermal expansion coefficient.

  14. Interpenetration as a mechanism for negative thermal expansion in the metal-organic framework Cu3(btb)2 (MOF-14).

    Science.gov (United States)

    Wu, Yue; Peterson, Vanessa K; Luks, Emily; Darwish, Tamim A; Kepert, Cameron J

    2014-05-12

    Metal-organic framework materials (MOFs) have recently been shown in some cases to exhibit strong negative thermal expansion (NTE) behavior, while framework interpenetration has been found to reduce NTE in many materials. Using powder and single-crystal diffraction methods we investigate the thermal expansion behavior of interpenetrated Cu3(btb)2 (MOF-14) and find that it exhibits an anomalously large NTE effect. Temperature-dependent structural analysis shows that, contrary to other interpenetrated materials, in MOF-14 the large positive thermal expansion of weak interactions that hold the interpenetrating networks together results in a low-energy contractive distortion of the overall framework structure, demonstrating a new mechanism for NTE.

  15. Thermal Expansion and Thermal Conductivity of Rare Earth Silicates

    Science.gov (United States)

    Zhu, Dongming; Lee, Kang N.; Bansal, Narottam P.

    2006-01-01

    Rare earth silicates are considered promising candidate materials for environmental barrier coatings applications at elevated temperature for ceramic matrix composites. High temperature thermophysical properties are of great importance for coating system design and development. In this study, the thermal expansion and thermal conductivity of hot-pressed rare earth silicate materials were characterized at temperatures up to 1400 C. The effects of specimen porosity, composition and microstructure on the properties were also investigated. The materials processing and testing issues affecting the measurements will also be discussed.

  16. Negative thermal expansion in functional materials: controllable thermal expansion by chemical modifications.

    Science.gov (United States)

    Chen, Jun; Hu, Lei; Deng, Jinxia; Xing, Xianran

    2015-06-07

    Negative thermal expansion (NTE) is an intriguing physical property of solids, which is a consequence of a complex interplay among the lattice, phonons, and electrons. Interestingly, a large number of NTE materials have been found in various types of functional materials. In the last two decades good progress has been achieved to discover new phenomena and mechanisms of NTE. In the present review article, NTE is reviewed in functional materials of ferroelectrics, magnetics, multiferroics, superconductors, temperature-induced electron configuration change and so on. Zero thermal expansion (ZTE) of functional materials is emphasized due to the importance for practical applications. The NTE functional materials present a general physical picture to reveal a strong coupling role between physical properties and NTE. There is a general nature of NTE for both ferroelectrics and magnetics, in which NTE is determined by either ferroelectric order or magnetic one. In NTE functional materials, a multi-way to control thermal expansion can be established through the coupling roles of ferroelectricity-NTE, magnetism-NTE, change of electron configuration-NTE, open-framework-NTE, and so on. Chemical modification has been proved to be an effective method to control thermal expansion. Finally, challenges and questions are discussed for the development of NTE materials. There remains a challenge to discover a "perfect" NTE material for each specific application for chemists. The future studies on NTE functional materials will definitely promote the development of NTE materials.

  17. Anomalous Expansion of Coronal Mass Ejections During Solar Cycle 24 and Its Space Weather Implications

    Science.gov (United States)

    Gopalswamy, Nat; Akiyama, Sachiko; Yashiro, Seiji; Xie, Hong; Makela, Pertti; Michalek, Grzegorz

    2014-01-01

    The familiar correlation between the speed and angular width of coronal mass ejections (CMEs) is also found in solar cycle 24, but the regression line has a larger slope: for a given CME speed, cycle 24 CMEs are significantly wider than those in cycle 23. The slope change indicates a significant change in the physical state of the heliosphere, due to the weak solar activity. The total pressure in the heliosphere (magnetic + plasma) is reduced by approximately 40%, which leads to the anomalous expansion of CMEs explaining the increased slope. The excess CME expansion contributes to the diminished effectiveness of CMEs in producing magnetic storms during cycle 24, both because the magnetic content of the CMEs is diluted and also because of the weaker ambient fields. The reduced magnetic field in the heliosphere may contribute to the lack of solar energetic particles accelerated to very high energies during this cycle.

  18. Thermal expansion recovery microscopy: Practical design considerations

    Energy Technology Data Exchange (ETDEWEB)

    Mingolo, N., E-mail: nmingol@fi.uba.ar; Martínez, O. E. [Facultad de Ingeniería, Universidad de Buenos Aires, Paseo Colon 850, 1063 Buenos Aires (Argentina)

    2014-01-15

    A detailed study of relevant parameters for the design and operation of a photothermal microscope technique recently introduced is presented. The technique, named thermal expansion recovery microscopy (ThERM) relies in the measurement of the defocusing introduced by a surface that expands and recovers upon the heating from a modulated source. A new two lens design is presented that can be easily adapted to commercial infinite conjugate microscopes and the sensitivity to misalignment is analyzed. The way to determine the beam size by means of a focus scan and the use of that same scan to verify if a thermoreflectance signal is overlapping with the desired ThERM mechanism are discussed. Finally, a method to cancel the thermoreflectance signal by an adequate choice of a nanometric coating is presented.

  19. Synthesis, Structure, and Rigid Unit Mode-like Anisotropic Thermal Expansion of BaIr2In9.

    Science.gov (United States)

    Calta, Nicholas P; Han, Fei; Kanatzidis, Mercouri G

    2015-09-08

    This Article reports the synthesis of large single crystals of BaIr2In9 using In flux and their characterization by variable-temperature single-crystal and synchrotron powder X-ray diffraction, resistivity, and magnetization measurements. The title compound adopts the BaFe2Al9-type structure in the space group P6/mmm with room temperature unit cell parameters a = 8.8548(6) Å and c = 4.2696(4) Å. BaIr2In9 exhibits anisotropic thermal expansion behavior with linear expansion along the c axis more than 3 times larger than expansion in the ab plane between 90 and 400 K. This anisotropic expansion originates from a rigid unit mode-like mechanism similar to the mechanism of zero and negative thermal expansion observed in many anomalous thermal expansion materials such as ZrW2O8 and ScF3.

  20. Thermal expansion as a precision actuator

    Science.gov (United States)

    Miller, Chris; Montgomery, David; Black, Martin; Schnetler, Hermine

    2016-07-01

    The UK ATC has developed a novel thermal actuator design as part of an OPTICON project focusing on the development of a Freeform Active Mirror Element (FAME). The actuator uses the well understood concept of thermal expansion to generate the required force and displacement. As heat is applied to the actuator material it expands linearly. A resistance temperature device (RTD) is embedded in the centre of the actuator and is used both as a heater and a sensor. The RTD temperature is controlled electronically by injecting a varying amount of current into the device whilst measuring the voltage across it. Temperature control of the RTD has been achieved to within 0.01°C. A 3D printed version of the actuator is currently being used at the ATC to deform a mirror but it has several advantages that may make it suitable to other applications. The actuator is cheap to produce whilst obtaining a high accuracy and repeatability. The actuator design would be suitable for applications requiring large numbers of actuators with high precision.

  1. Thermal expansion accompanying the glass-liquid transition and crystallization

    Directory of Open Access Journals (Sweden)

    M. Q. Jiang

    2015-12-01

    Full Text Available We report the linear thermal expansion behaviors of a Zr-based (Vitreloy 1 bulk metallic glass in its as-cast, annealed and crystallized states. Accompanying the glass-liquid transition, the as-cast Vitreloy 1 shows a continuous decrease in the thermal expansivity, whereas the annealed glass shows a sudden increase. The crystallized Vitreloy 1 exhibits an almost unchanged thermal expansivity prior to its melting. Furthermore, it is demonstrated that the nucleation of crystalline phases can induce a significant thermal shrinkage of the supercooled liquid, but with the growth of these nuclei, the thermal expansion again dominates. These results are explained in the framework of the potential energy landscape, advocating that the configurational and vibrational contributions to the thermal expansion of the glass depend on both, structure and temperature.

  2. Micro-architected Composite Lattices with Tunable Negative Thermal Expansions

    Science.gov (United States)

    Wang, Qiming

    Solid materials with minimum or negative thermal expansion (NTE) have broad applications, from dental fillings to thermal-sensitive precision instruments. Previous studies on NTE structures were mostly focused on theoretically design and 2D experimental demonstrations. Here, aided with multimaterial projection micro-stereolithography, we experimentally fabricate multi-material composite lattices that exhibit significant negative thermal expansion in three directions and over a large range of temperature variations. The negative thermal expansion is induced by the structural interaction of material components with distinct thermal expansion coefficients. The NTE performance can be tuned over a large range by varying the thermal expansion coefficient difference between constituent beams and geometrical arrangement. Our experimental results match qualitatively with a simple scaling law and quantitatively consistently with computational models.

  3. Anisotropic expansion of a thermal dipolar Bose gas

    CERN Document Server

    Tang, Yijun; Burdick, Nathaniel Q; DiSciacca, Jack M; Petrov, Dmitry S; Lev, Benjamin L

    2016-01-01

    We report on the anisotropic expansion of ultracold bosonic dysprosium gases at temperatures above quantum degeneracy and develop a quantitative theory to describe this behavior. The theory expresses the post-expansion aspect ratio in terms of temperature and microscopic collisional properties by incorporating Hartree-Fock mean-field interactions, hydrodynamic effects, and Bose-enhancement factors. Our results extend the utility of expansion imaging by providing accurate thermometry for dipolar thermal Bose gases, reducing error in expansion thermometry from tens of percent to only a few percent. Furthermore, we present a simple method to determine scattering lengths in dipolar gases, including near a Feshbach resonance, through observation of thermal gas expansion.

  4. Probing the physical determinants of thermal expansion of folded proteins.

    Science.gov (United States)

    Dellarole, Mariano; Kobayashi, Kei; Rouget, Jean-Baptiste; Caro, José Alfredo; Roche, Julien; Islam, Mohammad M; Garcia-Moreno E, Bertrand; Kuroda, Yutaka; Royer, Catherine A

    2013-10-24

    The magnitude and sign of the volume change upon protein unfolding are strongly dependent on temperature. This temperature dependence reflects differences in the thermal expansivity of the folded and unfolded states. The factors that determine protein molar expansivities and the large differences in thermal expansivity for proteins of similar molar volume are not well understood. Model compound studies have suggested that a major contribution is made by differences in the molar volume of water molecules as they transfer from the protein surface to the bulk upon heating. The expansion of internal solvent-excluded voids upon heating is another possible contributing factor. Here, the contribution from hydration density to the molar thermal expansivity of a protein was examined by comparing bovine pancreatic trypsin inhibitor and variants with alanine substitutions at or near the protein-water interface. Variants of two of these proteins with an additional mutation that unfolded them under native conditions were also examined. A modest decrease in thermal expansivity was observed in both the folded and unfolded states for the alanine variants compared with the parent protein, revealing that large changes can be made to the external polarity of a protein without causing large ensuing changes in thermal expansivity. This modest effect is not surprising, given the small molar volume of the alanine residue. Contributions of the expansion of the internal void volume were probed by measuring the thermal expansion for cavity-containing variants of a highly stable form of staphylococcal nuclease. Significantly larger (2-3-fold) molar expansivities were found for these cavity-containing proteins relative to the reference protein. Taken together, these results suggest that a key determinant of the thermal expansivities of folded proteins lies in the expansion of internal solvent-excluded voids.

  5. Metal-Ion Additives Reduce Thermal Expansion Of Polyimides

    Science.gov (United States)

    Stoakley, Diane M.; St. Clair, Anne K.; Emerson, Burt R., Jr.; Willis, George L.

    1994-01-01

    Polyimides widely used as high-performance polymers because of their excellent thermal stability and toughness. However, their coefficients of thermal expansion (CTE's) greater than those of metals, ceramics, and glasses. Decreasing CTE's of polyimides increase usefulness for aerospace and electronics applications in which dimensional stability required. Additives containing metal ions reduce coefficients of thermal expansion of polyimides. Reductions range from 11 to over 100 percent.

  6. Advanced anomalous pixel correction algorithms for hyperspectral thermal infrared data: The TASI-600 case study

    NARCIS (Netherlands)

    Santini, F.; Palombo, A.; Dekker, R.J.; Pignatti, S.; Pascucci, S.; Schwering, P.B.W.

    2014-01-01

    Anomalous pixel responses often seriously affect remote sensing applications, especially in the thermal spectral range. In this paper, a new method to identify and correct anomalous pixel responses is presented. The method was specifically developed to handle with hyperspectral data and is based on

  7. Measuring thermal expansion using X-band persistent scatterer interferometry

    Science.gov (United States)

    Crosetto, Michele; Monserrat, Oriol; Cuevas-González, María; Devanthéry, Núria; Luzi, Guido; Crippa, Bruno

    2015-02-01

    This paper is focused on the estimation of the thermal expansion of buildings and infrastructures using X-band Persistent Scatterer Interferometry (PSI) observations. For this purpose an extended PSI model is used, which allows separating the thermal expansion from the total observed deformation thus generating a new PSI product: the map of the thermal expansion parameter, named thermal map. The core of the paper is devoted to the exploitation of the information contained in the thermal maps: three examples are discussed in detail, which concern a viaduct, a set of industrial buildings and two skyscrapers. The thermal maps can be used to derive the thermal expansion coefficient of the observed objects and information on their static structure. In addition, the paper illustrates the distortions in the PSI deformation products that occur if the thermal expansion is not explicitly modelled. Finally, an inter-comparison exercise is described, where the thermal expansion coefficients estimated by PSI are compared with those derived by a Ku-band ground-based SAR campaign.

  8. Design of materials with extreme thermal expansion using a three-phase topology optimization method

    DEFF Research Database (Denmark)

    Sigmund, Ole; Torquato, S.

    1997-01-01

    Composites with extremal or unusual thermal expansion coefficients are designed using a three-phase topology optimization method. The composites are made of two different material phases and a void phase. The topology optimization method consists in finding the distribution of material phases...... materials having maximum directional thermal expansion (thermal actuators), zero isotropic thermal expansion, and negative isotropic thermal expansion. It is shown that materials with effective negative thermal expansion coefficients can be obtained by mixing two phases with positive thermal expansion...

  9. Negative thermal expansion induced by intermetallic charge transfer.

    Science.gov (United States)

    Azuma, Masaki; Oka, Kengo; Nabetani, Koichiro

    2015-06-01

    Suppression of thermal expansion is of great importance for industry. Negative thermal expansion (NTE) materials which shrink on heating and expand on cooling are therefore attracting keen attention. Here we provide a brief overview of NTE induced by intermetallic charge transfer in A-site ordered double perovskites SaCu3Fe4O12 and LaCu3Fe4-x Mn x O12, as well as in Bi or Ni substituted BiNiO3. The last compound shows a colossal dilatometric linear thermal expansion coefficient exceeding -70 × 10(-6) K(-1) near room temperature, in the temperature range which can be controlled by substitution.

  10. Controlling Thermal Expansion: A Metal-Organic Frameworks Route.

    Science.gov (United States)

    Balestra, Salvador R G; Bueno-Perez, Rocio; Hamad, Said; Dubbeldam, David; Ruiz-Salvador, A Rabdel; Calero, Sofia

    2016-11-22

    Controlling thermal expansion is an important, not yet resolved, and challenging problem in materials research. A conceptual design is introduced here, for the first time, for the use of metal-organic frameworks (MOFs) as platforms for controlling thermal expansion devices that can operate in the negative, zero, and positive expansion regimes. A detailed computer simulation study, based on molecular dynamics, is presented to support the targeted application. MOF-5 has been selected as model material, along with three molecules of similar size and known differences in terms of the nature of host-guest interactions. It has been shown that adsorbate molecules can control, in a colligative way, the thermal expansion of the solid, so that changing the adsorbate molecules induces the solid to display positive, zero, or negative thermal expansion. We analyze in depth the distortion mechanisms, beyond the ligand metal junction, to cover the ligand distortions, and the energetic and entropic effect on the thermo-structural behavior. We provide an unprecedented atomistic insight on the effect of adsorbates on the thermal expansion of MOFs as a basic tool toward controlling the thermal expansion.

  11. Seal assembly for materials with different coefficients of thermal expansion

    Science.gov (United States)

    Minford, Eric

    2009-09-01

    Seal assembly comprising (a) two or more seal elements, each element having having a coefficient of thermal expansion; and (b) a clamping element having a first segment, a second segment, and a connecting segment between and attached to the first and second segments, wherein the two or more seal elements are disposed between the first and second segments of the clamping element. The connecting segment has a central portion extending between the first segment of the clamping element and the second segment of the clamping element, and the connecting segment is made of a material having a coefficient of thermal expansion. The coefficient of thermal expansion of the material of the connecting segment is intermediate the largest and smallest of the coefficients of thermal expansion of the materials of the two or more seal elements.

  12. Heat capacity and thermal expansion of water and helium

    Science.gov (United States)

    Putintsev, N. M.; Putintsev, D. N.

    2017-04-01

    Original expressions for heat capacity CV and its components, vibrational and configurational components of thermal expansion coefficient were established. The values of CV, Cvib, Cconf, αvib and αconf for water and helium 4He were calculated.

  13. Laboratory Procedures in Thermal Expansion and Viscosity of Liquids

    Science.gov (United States)

    Dawson, Paul Dow

    1974-01-01

    Describes the laboratory procedures for the measurement of thermal expansion and viscosity of liquids. These experiments require inexpensive equipment and are suitable for secondary school physical science classes. (JR)

  14. Colossal negative thermal expansion in reduced layered ruthenate

    Science.gov (United States)

    Takenaka, Koshi; Okamoto, Yoshihiko; Shinoda, Tsubasa; Katayama, Naoyuki; Sakai, Yuki

    2017-01-01

    Large negative thermal expansion (NTE) has been discovered during the last decade in materials of various kinds, particularly materials associated with a magnetic, ferroelectric or charge-transfer phase transition. Such NTE materials have attracted considerable attention for use as thermal-expansion compensators. Here, we report the discovery of giant NTE for reduced layered ruthenate. The total volume change related to NTE reaches 6.7% in dilatometry, a value twice as large as the largest volume change reported to date. We observed a giant negative coefficient of linear thermal expansion α=-115 × 10-6 K-1 over 200 K interval below 345 K. This dilatometric NTE is too large to be attributable to the crystallographic unit-cell volume variation with temperature. The highly anisotropic thermal expansion of the crystal grains might underlie giant bulk NTE via microstructural effects consuming open spaces in the sintered body on heating.

  15. Lightweight Mechanical Metamaterials with Tunable Negative Thermal Expansion.

    Science.gov (United States)

    Wang, Qiming; Jackson, Julie A; Ge, Qi; Hopkins, Jonathan B; Spadaccini, Christopher M; Fang, Nicholas X

    2016-10-21

    Ice floating on water is a great manifestation of negative thermal expansion (NTE) in nature. The limited examples of natural materials possessing NTE have stimulated research on engineered structures. Previous studies on NTE structures were mostly focused on theoretical design with limited experimental demonstration in two-dimensional planar geometries. In this work, aided with multimaterial projection microstereolithography, we experimentally fabricate lightweight multimaterial lattices that exhibit significant negative thermal expansion in three directions and over a temperature range of 170 degrees. Such NTE is induced by the structural interaction of material components with distinct thermal expansion coefficients. The NTE can be tuned over a large range by varying the thermal expansion coefficient difference between constituent beams and geometrical arrangements. Our experimental results match qualitatively with a simple scaling law and quantitatively with computational models.

  16. Lightweight Mechanical Metamaterials with Tunable Negative Thermal Expansion

    Science.gov (United States)

    Wang, Qiming; Jackson, Julie A.; Ge, Qi; Hopkins, Jonathan B.; Spadaccini, Christopher M.; Fang, Nicholas X.

    2016-10-01

    Ice floating on water is a great manifestation of negative thermal expansion (NTE) in nature. The limited examples of natural materials possessing NTE have stimulated research on engineered structures. Previous studies on NTE structures were mostly focused on theoretical design with limited experimental demonstration in two-dimensional planar geometries. In this work, aided with multimaterial projection microstereolithography, we experimentally fabricate lightweight multimaterial lattices that exhibit significant negative thermal expansion in three directions and over a temperature range of 170 degrees. Such NTE is induced by the structural interaction of material components with distinct thermal expansion coefficients. The NTE can be tuned over a large range by varying the thermal expansion coefficient difference between constituent beams and geometrical arrangements. Our experimental results match qualitatively with a simple scaling law and quantitatively with computational models.

  17. Impact of size and temperature on thermal expansion of nanomaterials

    Indian Academy of Sciences (India)

    Madan Singh; Mahipal Singh

    2015-04-01

    A theoretical method has been discussed to study the size dependency of thermal expansion of nanomaterials at higher temperature by considering the surface effect. A thermodynamical analysis of the equation of state (EoS) is studied from the knowledge of thermal expansion of nano-materials based on theoretical thermodynamical relations. It is observed that thermal expansion coefficient increases with decrease in grain size whereas, /0 increases with increase in temperature for nanomaterials of different grain sizes. We have studied the size and temperature dependence of thermal expansion of Cu, Ag, Ni, Sn, Se and Zn nanomaterials in different shapes (spherical, nanowire and nanofilm). The available experimental data confirm these theoretical predictions that demonstrate the validity of our work.

  18. Thermal expansion of spinel-type Si3N4

    DEFF Research Database (Denmark)

    Paszkowics, W.; Minkikayev, R.; Piszora, P.

    2004-01-01

    The lattice parameter and thermal expansion coefficient (TEC) for the spinel-type Si3N4 phase prepared under high-pressure and high-temperature conditions are determined for 14 K......The lattice parameter and thermal expansion coefficient (TEC) for the spinel-type Si3N4 phase prepared under high-pressure and high-temperature conditions are determined for 14 K...

  19. Method of minimizing liner expansion issues in horizontal thermal applications

    Energy Technology Data Exchange (ETDEWEB)

    Schultz, R.; Cavender, T. [Halliburton, Houston, TX (United States)

    2009-07-01

    This study reviewed well casing and liner applications used in a variety of thermal recovery operations such as steam-assisted gravity drainage (SAGD), cyclic steam stimulation (CSS), steam flooding, multilateral injection, and steam enhanced oil recovery (EOR) in depleted cold heavy-oil production with sand (CHOPS) recovery methods. Completion casing and liners are typically deployed at relatively low downhole temperature conditions. Subsequent steam injection then causes downhole temperatures to increase, causing thermal expansion in downhole tubulars and other components. The thermal stresses can result in tubular buckling and parting. Providing room for expansion when downhole components are heated can reduce the risk of failures. This study discussed a temperature-activated travel joint designed to function as a static pup joint or casing collar. The device transmits full torque and tensile strength when temperatures remain below a predetermined value. When steam or other thermal fluids are introduced into the well, thermal expansion devices are activated in order to allow the thermal expansion of adjacent components without associated thermal expansion-related stresses. Tests conducted to validate the design showed that the technology can be used with slotted liner and sand screen applications as well as with concentric tubing configurations. 9 refs., 14 figs.

  20. Anisotropic Expansion of a Thermal Dipolar Bose Gas

    Science.gov (United States)

    Tang, Y.; Sykes, A. G.; Burdick, N. Q.; DiSciacca, J. M.; Petrov, D. S.; Lev, B. L.

    2016-10-01

    We report on the anisotropic expansion of ultracold bosonic dysprosium gases at temperatures above quantum degeneracy and develop a quantitative theory to describe this behavior. The theory expresses the postexpansion aspect ratio in terms of temperature and microscopic collisional properties by incorporating Hartree-Fock mean-field interactions, hydrodynamic effects, and Bose-enhancement factors. Our results extend the utility of expansion imaging by providing accurate thermometry for dipolar thermal Bose gases. Furthermore, we present a simple method to determine scattering lengths in dipolar gases, including near a Feshbach resonance, through observation of thermal gas expansion.

  1. Anisotropic Expansion of a Thermal Dipolar Bose Gas.

    Science.gov (United States)

    Tang, Y; Sykes, A G; Burdick, N Q; DiSciacca, J M; Petrov, D S; Lev, B L

    2016-10-07

    We report on the anisotropic expansion of ultracold bosonic dysprosium gases at temperatures above quantum degeneracy and develop a quantitative theory to describe this behavior. The theory expresses the postexpansion aspect ratio in terms of temperature and microscopic collisional properties by incorporating Hartree-Fock mean-field interactions, hydrodynamic effects, and Bose-enhancement factors. Our results extend the utility of expansion imaging by providing accurate thermometry for dipolar thermal Bose gases. Furthermore, we present a simple method to determine scattering lengths in dipolar gases, including near a Feshbach resonance, through observation of thermal gas expansion.

  2. Glass transition and thermal expansivity of polystyrene thin films

    Energy Technology Data Exchange (ETDEWEB)

    Inoue, R. [Institute for Chemical Research, Kyoto University, Uji, Kyoto-fu 611-0011 (Japan); Kanaya, T. [Institute for Chemical Research, Kyoto University, Uji, Kyoto-fu 611-0011 (Japan)]. E-mail: kanaya@scl.kyoto-u.ac.jp; Miyazaki, T. [Nitto Denko Corporation, 1-1-2 Shimohozumi, Ibaraki, Osaka-fu 567-8680 (Japan); Nishida, K. [Institute for Chemical Research, Kyoto University, Uji, Kyoto-fu 611-0011 (Japan); Tsukushi, I. [Chiba Institute of Technology, Narashino, Chiba-ken 275-0023 (Japan); Shibata, K. [Japan Atomic Energy Research Institute, Tokai, Ibaraki-ken 319-1195 (Japan)

    2006-12-20

    We have studied glass transition temperature and thermal expansivity of polystyrene thin films supported on silicon substrate using X-ray reflectivity and inelastic neutron scattering techniques. In annealing experiments, we have found that the reported apparent negative expansivity of polymer thin films is caused by unrelaxed structure due to insufficient annealing. Using well-annealed films, we have evaluated glass transition temperature T {sub g} and thermal expansivity as a function of film thickness. The glass transition temperature decreases with film thickness and is constant below about 10 nm, suggesting the surface glass transition temperature of 355 K, which is lower than that in bulk. We have also found that the thermal expansivity in the glassy state decreases with film thickness even after annealing. The decrease has been attributed to hardening of harmonic force constant arising from chain confinement in a thin film. This idea has been confirmed in the inelastic neutron scattering measurements.

  3. Strong anisotropic thermal expansion in cristobalite-type BPO 4

    Science.gov (United States)

    Achary, S. N.; Tyagi, A. K.

    2004-11-01

    In this communication, the thermal expansion behavior of cristobalite-type BPO 4, determined from high-temperature X-ray diffraction studies, is being reported. BPO 4 crystallizes in tetragonal lattice, with space group I-4 (No. 82) at room temperature, with unit cell parameters: a=4.3447(2), c=6.6415(5) Å and V=125.37(1) Å 3. The tetragonal unit cell parameters at 900 °C are: a=4.3939(2), c=6.6539(6) Å and V=128.46(1) Å 3. The results show a very strong anisotropic expansion in the lattice, with the typical thermal expansion coefficients along a- and c-axis 12.9×10 -6 and 2.1×10 -6/°C, respectively. The volume thermal expansion coefficient of the lattice is 28.2×10 -6/°C in the temperature range of 25-900 °C. The variation of the crystal structure with temperature and the thermal expansion behavior are explained in this manuscript. The role of inter-polyhedral angle on the thermal expansion behavior has also been established.

  4. Ab-initio study of thermal expansion in pure graphene

    Science.gov (United States)

    Mann, Sarita; Rani, Pooja; Kumar, Ranjan; Jindal, V. K.

    2016-05-01

    Graphene is a zero band gap semiconductor with exceptionally high thermal conductivity. The electronic properties having been studied, therole of phonon in contributing to thermal expansion, thermal conductivity and other thermodynamic properties, is required to be investigated. This paper focuses more on thermal expansion. Some others results like phonon dispersion, Grüneisenparameters and bulk modulus,which are essential to estimation of thermal expansion, are also presented. The dynamical matrix was calculated using VASP code using both DFT and DFPTand the phonon frequencies were calculated using phonopy code under harmonic approximation. The linear thermal expansion coefficient of graphene is found to be strongly dependent on temperature but remains negative upto 470 K and positive thereafter, with a room temperature value of -1.44×10-6. The negative expansion coefficient is very interesting and is found to be in conformity with experimental as well as with recent theoretical estimates. There is only qualitative agreement of our results with experimental data and motivates further investigation, primarily on the high negative values of Grüneisen parameters.

  5. Negative thermal expansion and anomalies of heat capacity of LuB50 at low temperatures.

    Science.gov (United States)

    Novikov, V V; Zhemoedov, N A; Matovnikov, A V; Mitroshenkov, N V; Kuznetsov, S V; Bud'ko, S L

    2015-09-28

    Heat capacity and thermal expansion of LuB50 boride were experimentally studied in the 2-300 K temperature range. The data reveal an anomalous contribution to the heat capacity at low temperatures. The value of this contribution is proportional to the first degree of temperature. It was identified that this anomaly in heat capacity is caused by the effect of disorder in the LuB50 crystalline structure and it can be described in the soft atomic potential model (SAP). The parameters of the approximation were determined. The temperature dependence of LuB50 heat capacity in the whole temperature range was approximated by the sum of SAP contribution, Debye and two Einstein components. The parameters of SAP contribution for LuB50 were compared to the corresponding values for LuB66, which was studied earlier. Negative thermal expansion at low temperatures was experimentally observed for LuB50. The analysis of the experimental temperature dependence for the Gruneisen parameter of LuB50 suggested that the low-frequency oscillations, described in SAP mode, are responsible for the negative thermal expansion. Thus, the glasslike character of the behavior of LuB50 thermal characteristics at low temperatures was confirmed.

  6. Thermal Expansion Behavior of Hot-Pressed Engineered Matrices

    Science.gov (United States)

    Raj, S. V.

    2016-01-01

    Advanced engineered matrix composites (EMCs) require that the coefficient of thermal expansion (CTE) of the engineered matrix (EM) matches those of the fiber reinforcements as closely as possible in order to reduce thermal compatibility strains during heating and cooling of the composites. The present paper proposes a general concept for designing suitable matrices for long fiber reinforced composites using a rule of mixtures (ROM) approach to minimize the global differences in the thermal expansion mismatches between the fibers and the engineered matrix. Proof-of-concept studies were conducted to demonstrate the validity of the concept.

  7. Zirconium titanate: stability and thermal expansion; Titanato de circonio: estabilidad termodinamica y expansion termica

    Energy Technology Data Exchange (ETDEWEB)

    Lopez-Lopez, E.; Moreno, R.; Baudin, C.

    2011-07-01

    Zirconium titanate is a well known compound in the field of electro ceramics, although it has also been used in catalyst and sensors applications. The crystallographic thermal expansion anisotropy of this compound makes it a potential candidate as constituent of structural components. In general, to assure the structural integrity and microstructural homogeneity of a ceramic piece, relatively low cooling rates from the fabrication temperature are required. This requirement is essential for zirconium titanate because thermal expansion as well as phase distribution is affected by small variations in the composition and cooling rate. This work reviews the available data on the phase equilibrium relationships in the systems ZrO{sub 2}-TiO{sub 2} and ZrO{sub 2}-TiO{sub 2}-Y{sub 2}O{sub 3}. The main discrepancies as well as the possible origins of them are discussed. Additionally, the crystallographic thermal expansion data in the current literature are reviewed. (Author) 56 refs.

  8. Thermomechanics of monolayer graphene: Rippling, thermal expansion and elasticity

    Science.gov (United States)

    Gao, Wei; Huang, Rui

    2014-05-01

    Thermomechanical properties of monolayer graphene with thermal fluctuation are studied by both statistical mechanics analysis and molecular dynamics (MD) simulations. While the statistical mechanics analysis in the present study is limited by a harmonic approximation, significant anharmonic effects are revealed by MD simulations. The amplitude of out-of-plane thermal fluctuation is calculated for graphene membranes under both zero stress and zero strain conditions. It is found that the fluctuation amplitude follows a power-law scaling with respect to the linear dimension of the membrane, but the roughness exponents are different for the two conditions due to anharmonic interactions between bending and stretching modes. Such thermal fluctuation or rippling is found to be responsible for the effectively negative in-plane thermal expansion of graphene at relatively low temperatures, while a transition to positive thermal expansion is predicted as the anharmonic interactions suppress the rippling effect at high temperatures. Subject to equi-biaxial tension, the amplitude of thermal rippling decreases nonlinearly, and the in-plane stress-strain relation of graphene becomes nonlinear even at infinitesimal strain, in contrast with classical theory of linear elasticity. It is found that the tangent biaxial modulus of graphene depends on strain non-monotonically, decreases with increasing temperature, and depends on membrane size. Both statistical mechanics and MD simulations suggest considerable entropic contribution to the thermomechanical properties of graphene, and as a result thermal rippling is intricately coupled with thermal expansion and thermoelasticity for monolayer graphene membranes.

  9. Elastic and thermal expansion asymmetry in dense molecular materials

    Science.gov (United States)

    Burg, Joseph A.; Dauskardt, Reinhold H.

    2016-09-01

    The elastic modulus and coefficient of thermal expansion are fundamental properties of elastically stiff molecular materials and are assumed to be the same (symmetric) under both tension and compression loading. We show that molecular materials can have a marked asymmetric elastic modulus and coefficient of thermal expansion that are inherently related to terminal chemical groups that limit molecular network connectivity. In compression, terminal groups sterically interact to stiffen the network, whereas in tension they interact less and disconnect the network. The existence of asymmetric elastic and thermal expansion behaviour has fundamental implications for computational approaches to molecular materials modelling and practical implications on the thermomechanical strains and associated elastic stresses. We develop a design space to control the degree of elastic asymmetry in molecular materials, a vital step towards understanding their integration into device technologies.

  10. Elastic and thermal expansion asymmetry in dense molecular materials.

    Science.gov (United States)

    Burg, Joseph A; Dauskardt, Reinhold H

    2016-09-01

    The elastic modulus and coefficient of thermal expansion are fundamental properties of elastically stiff molecular materials and are assumed to be the same (symmetric) under both tension and compression loading. We show that molecular materials can have a marked asymmetric elastic modulus and coefficient of thermal expansion that are inherently related to terminal chemical groups that limit molecular network connectivity. In compression, terminal groups sterically interact to stiffen the network, whereas in tension they interact less and disconnect the network. The existence of asymmetric elastic and thermal expansion behaviour has fundamental implications for computational approaches to molecular materials modelling and practical implications on the thermomechanical strains and associated elastic stresses. We develop a design space to control the degree of elastic asymmetry in molecular materials, a vital step towards understanding their integration into device technologies.

  11. Design of materials with extreme thermal expansion using a three-phase topology optimization method

    DEFF Research Database (Denmark)

    Sigmund, Ole; Torquato, S.

    1997-01-01

    We show how composites with extremal or unusual thermal expansion coefficients can be designed using a numerical topology optimization method. The composites are composed of two different material phases and void. The optimization method is illustrated by designing materials having maximum thermal...... expansion, zero thermal expansion, and negative thermal expansion. Assuming linear elasticity, it is shown that materials with effective negative thermal expansion coefficients can be obtained by mixing two phases with positive thermal expansion coefficients and void. We also show...... that there is no mechanistic relationship between negative thermal expansion and negative Poisson's ratio....

  12. Thermal expansion behaviour of barium and strontium zirconium phosphates

    Indian Academy of Sciences (India)

    P Srikari Tantri; K Geetha; A M Umarji; Sheela K Ramasesha

    2000-12-01

    Ba1.5–SrZr4P5SiO24 compounds with = 0, 0.25, 0.5, 0.75, 1.0, 1.25 and 1.5, belonging to the low thermal expansion NZP family were synthesized by the solid state reaction method. The XRD pattern could be completely indexed with respect to R$\\bar{3}$ space group indicating the ordering of vacancy at the divalent cation octahedral sites. The microstructure and bulk thermal expansion coefficient from room temperature to 800°C of the sintered samples have been studied. All the samples show very low coefficient of thermal expansion (CTE), with = 0 samples showing negative expansion. A small substitution of strontium in the pure barium compound changes the sign of CTE. Similarly, = 1.5 sample (pure strontium) shows a positive CTE and a small substitution of barium changes its sign. = 1.0 and 1.25 samples have almost constant CTE over the entire temperature range. The low thermal expansion of these samples can be attributed to the ordering of the ions in the crystal structure of these materials.

  13. Thermal expansion of d10 dicyanometallate-based coordination polymers

    OpenAIRE

    Korcok, Jasmine Lynn

    2010-01-01

    The thermal expansion of several new d10, dicyanometallate-based coordination polymers was examined by powder and single-crystal X-ray diffraction. In isostructural KNi[Au(CN)2]3, KCd[M(CN)2]3, and In[M(CN)2]3 (M=Ag(I), Au(I)), extremely large positive and negative thermal expansion (PTE/NTE) coefficients were discovered. Weaker metallophilic interactions promote larger PTE and NTE. Similarly, the M[Au(CN)2]2 series (M=Mn, Fe, Co, Zn, Hg) showed sizeable PTE and NTE effects. HgCN(NO3) exhibit...

  14. Thin films with ultra-low thermal expansion.

    Science.gov (United States)

    Yamamoto, Namiko; Gdoutos, Eleftherios; Toda, Risaku; White, Victor; Manohara, Harish; Daraio, Chiara

    2014-05-21

    Ultra-low coefficient of thermal expansion (CTE) is an elusive property, and narrow temperature ranges of operation and poor mechanical properties limit the use of conventional materials with low CTE. We structured a periodic micro-array of bi-metallic cells to demonstrate ultra-low effective CTE with a wide temperature range. These engineered tunable CTE thin film can be applied to minimize thermal fatigue and failure of optics, semiconductors, biomedical sensors, and solar energy applications.

  15. Low temperature thermal expansion measurements on optical materials.

    Science.gov (United States)

    Browder, J S; Ballard, S S

    1969-04-01

    A three-terminal capacitance type dilatometer has been developed for investigating the thermal expansion of optical materials at low temperatures. The method is applicable when only small sample lengths (13 mm or less) are available. The thermal expansion coefficients of six polycrystalline materials (the Irtrans) and of one nonoxide glass have been determined in the range from room temperature down to about 60 K. Minute changes of the length of a sample produce a change of the spacing of a parallel plate capacitor with guard ring; the resulting change of capacitance is measured on a highly sensitive bridge. The expansion coefficients are then determined by relating the change of capacitance to the change of dimensions of the sample.

  16. Structure and thermal expansion of NbC complex carbides

    Energy Technology Data Exchange (ETDEWEB)

    Khatsinskaya, I.M.; Chaporova, I.N.; Cheburaeva, R.F.; Samojlov, A.I.; Logunov, A.V.; Ignatova, I.A.; Dodonova, L.P.

    1983-11-01

    Alloying dependences of the crystal lattice parameters at indoor temperature and coefficient of thermal linear expansion within a 373-1273 K range are determined for complex NbC-base carbides by the method of mathematical experimental design. It is shown that temperature changes in the linear expansion coefficient of certain complex carbides as distinct from NbC have an anomaly (minimum) within 773-973 K caused by occurring reversible phase transformations. An increase in the coefficient of thermal linear expansion and a decrease in hardness of NbC-base tungsten-, molybdenum-, vanadium- and hafnium-alloyed carbides show a weakening of a total chemical bond in the complex carbides during alloying.

  17. Determination of effective thermal expansion coefficients of unidirectional fibrous nanocomposites

    Science.gov (United States)

    Dai, Ming; Schiavone, Peter; Gao, Cun-Fa

    2016-10-01

    We present an efficient numerical scheme (based on complex variable techniques) to calculate the effective thermal expansion coefficients of a composite containing unidirectional periodic fibers. Moreover, the mechanical behavior of the fibers incorporates interface effects allowing the ensuing analytical model of the composite to accommodate deformations at the nanoscale. The resulting `nanocomposite' is subjected to a uniform temperature variation which leads to periodic deformations within the plane perpendicular to the fibers and uniform deformations along the direction of the fibers. These deformation fields are determined by analyzing a representative unit cell of the composite subsequently leading to the corresponding effective thermal expansion coefficients. Numerical results are illustrated via several physical examples. We find that the influence of interface effects on the effective thermal expansion coefficients (in particular that corresponding to the transverse direction in the plane perpendicular to the fibers) decays rapidly as the fibers become harder. In addition, by comparing the results obtained here with those from effective medium theories, we show that the latter may induce significant errors in the determination of the effective transverse thermal expansion coefficient when the fibers are much softer than the matrix and the fiber volume fraction is relatively high.

  18. COMPACT ATHERMAL OPTICAL WAVEGUIDE USING THERMAL EXPANSION AMPLIFICATION

    DEFF Research Database (Denmark)

    2001-01-01

    A method of temperature stabilising optical waveguides having positive thermal optical path length expansion, in particular fiber Bragg gratings or optical fiber DFB lasers or optical fiber DBR lasers, comprising affixing the optical waveguide to at least two points of a negative expanding fixture...

  19. DSLM Instructional Approach to Conceptual Change Involving Thermal Expansion.

    Science.gov (United States)

    She, Hsiao-Ching

    2003-01-01

    Examines the process of student conceptual change regarding thermal expansion using the Dual Situated Learning Model (DSLM) as an instructional approach. Indicates that DSLM promotes conceptual change and holds great potential to facilitate the process through classroom instruction at all levels. (Contains 38 references.) (Author/NB)

  20. Measurement of thermal expansion coefficient of nonuniform temperature specimen

    Institute of Scientific and Technical Information of China (English)

    Jingmin Dai; Chunsuo Kin; Xiaowa He

    2008-01-01

    A new technique is developed to measure the longitudinal thermal expansion coefficient of C/C composite material at high temperature. The measuring principle and components of the apparatus are described in detail. The calculation method is derived from the temperature dependence of the thermal expansion coefficient. The apparatus mainly consists of a high temperature environmental chamber, a power circuit of heating, two high-speed pyrometers, and a laser scanning system. A long solid specimen is resistively heated to a steady high-temperature state by a steady electrical current. The temperature profile of the specimen surface is not uniform because of the thermal conduction and radiation. The temperature profile and the total expansion are measured with a high-speed scanning pyrometer and a laser slit scanning measuring system, respectively. The thermal expansion coefficient in a wide temperature range (1000 - 3800 K) of the specimen can therefore be obtained. The perfect consistency between the present and previous results justifies the validity of this technique.

  1. The Origin of High Thermal Conductivity and Ultralow Thermal Expansion in Copper-Graphite Composites.

    Science.gov (United States)

    Firkowska, Izabela; Boden, André; Boerner, Benji; Reich, Stephanie

    2015-07-08

    We developed a nanocomposite with highly aligned graphite platelets in a copper matrix. Spark plasma sintering ensured an excellent copper-graphite interface for transmitting heat and stress. The resulting composite has superior thermal conductivity (500 W m(-1) K(-1), 140% of copper), which is in excellent agreement with modeling based on the effective medium approximation. The thermal expansion perpendicular to the graphite platelets drops dramatically from ∼20 ppm K(-1) for graphite and copper separately to 2 ppm K(-1) for the combined structure. We show that this originates from the layered, highly anisotropic structure of graphite combined with residual stress under ambient conditions, that is, strain-engineering of the thermal expansion. Combining excellent thermal conductivity with ultralow thermal expansion results in ideal materials for heat sinks and other devices for thermal management.

  2. Anisotropic thermal expansion in a metal-organic framework.

    Science.gov (United States)

    Madsen, Solveig Røgild; Lock, Nina; Overgaard, Jacob; Iversen, Bo Brummerstedt

    2014-06-01

    Ionothermal reaction between Mn(II)(acetate)2·4H2O and 1,3,5-benzenetricarboxylic acid (H3BTC) in either of the two ionic liquids 1-ethyl-3-methylimidazolium bromide (EMIMBr) and 1-ethyl-3-methylimidazolium tosylate (EMIMOTs) resulted in the formation of the new metal-organic framework (MOF) EMIM[Mn(II)BTC] (BTC = 1,3,5-benzenetricarboxylate). The compound crystallizes in the orthorhombic space group Pbca with unit-cell parameters of a = 14.66658 (12), b = 12.39497 (9), c = 16.63509 (14) Å at 100 K. Multi-temperature single-crystal (15-340 K) and powder X-ray diffraction studies (100-400 K) reveal strongly anisotropic thermal expansion properties. The linear thermal expansion coefficients, αL(l), attain maximum values at 400 K along the a- and b-axis, with αL(a) = 115 × 10(-6) K(-1) and αL(b) = 75 × 10(-6) K(-1). At 400 K a negative thermal expansion coefficient of -40 × 10(-6) K(-1) is observed along the c-axis. The thermal expansion is coupled to a continuous deformation of the framework, which causes the structure to expand in two directions. Due to the rigidity of the linker, the expansion in the ab plane causes the network to contract along the c-axis. Hirshfeld surface analysis has been used to describe the interaction between the framework structure and the EMIM cation that resides within the channel. This reveals a number of rather weak interactions and one governing hydrogen-bonding interactions.

  3. Compressibility and thermal expansion of cubic silicon nitride

    DEFF Research Database (Denmark)

    Jiang, Jianzhong; Lindelov, H.; Gerward, Leif

    2002-01-01

    The compressibility and thermal expansion of the cubic silicon nitride (c-Si3N4) phase have been investigated by performing in situ x-ray powder-diffraction measurements using synchrotron radiation, complemented with computer simulations by means of first-principles calculations. The bulk...... compressibility of the c-Si3N4 phase originates from the average of both Si-N tetrahedral and octahedral compressibilities where the octahedral polyhedra are less compressible than the tetrahedral ones. The origin of the unit cell expansion is revealed to be due to the increase of the octahedral Si-N and N-N bond...

  4. On the thermal expansion of nanohole free volume in perfluoropolyethers.

    Science.gov (United States)

    Consolati, G

    2005-05-26

    To determine the free volume in polymers, positron annihilation lifetime spectroscopy data are transformed into nanohole volumes by modeling the cavities as spheres or, more generally, using geometries assuming an isotropic thermal expansion. However, this guess could be unrealistic owing to the irregular shape of nanoholes and constrained movements of the macromolecules. In this work, it is shown that a comparison of hole-lattice theory with positron and dilatometric data for a homologous series of perfluoropolyethers supplies information on the anisotropic expansion of nanoholes; the relation between volume and typical unconstrained size of the cavities can be expressed by a power law with noninteger exponents.

  5. Thermal expansion of an epoxy-glass microsphere composite

    Science.gov (United States)

    Price, H. L.; Burks, H. D.

    1977-01-01

    The thermal expansion of a composite of epoxy (diglycidyl ether of bisphenol A) and solid glass microspheres was investigated. The microspheres had surfaces which were either untreated or treated with a silicone release agent, an epoxy coupling agent, or a general purpose silane coupling agent. Both room temperature (about 300 K) and elevated temperature (about 475 K) cures were used for the epoxy. Two microsphere size ranges were used, about 50 microns, which is applicable in filled moldings, and about 125 microns, which is applicable as bond line spacers. The thermal expansion of the composites was measured from 300 to 350 K or from 300 to 500 K, depending on the epoxy cure temperature. Measurements were made on composites containing up to .6 volume fraction microspheres. Two predictive models, which required only the values of thermal expansion of the polymer and glass and their specific gravities, were tested against the experimental data. A finite element analysis was made of the thermal strain of a composite cell containing a single microsphere surrounded by a finite-thickness interface.

  6. Controlled Thermal Expansion Coat for Thermal Barrier Coatings

    Science.gov (United States)

    Brindley, William J. (Inventor); Miller, Robert A. (Inventor); Aikin, Beverly J. M. (Inventor)

    1999-01-01

    A improved thermal barrier coating and method for producing and applying such is disclosed herein. The thermal barrier coating includes a high temperature substrate, a first bond coat layer applied to the substrate of MCrAlX, and a second bond coat layer of MCrAlX with particles of a particulate dispersed throughout the MCrAlX and the preferred particulate is Al2O3. The particles of the particulate dispersed throughout the second bond coat layer preferably have a diameter of less then the height of the peaks of the second bond coat layer, or a diameter of less than 5 microns. The method of producing the second bond coat layer may either include the steps of mechanical alloying of particles throughout the second bond coat layer, attrition milling the particles of the particulate throughout the second bond coat layer, or using electrophoresis to disperse the particles throughout the second bond coat layer. In the preferred embodiment of the invention, the first bond coat layer is applied to the substrate, and then the second bond coat layer is thermally sprayed onto the first bond coat layer. Further, in a preferred embodiment of die invention, a ceramic insulating layer covers the second bond coat layer.

  7. Lunar Eclipse Observations Reveal Anomalous Thermal Performance of Apollo Reflectors

    CERN Document Server

    Murphy, T W; Johnson, N H; Goodrow, S D

    2013-01-01

    Laser ranging measurements during the total lunar eclipse on 2010 December 21 verify previously suspected thermal lensing in the retroreflectors left on the lunar surface by the Apollo astronauts. Signal levels during the eclipse far exceeded those historically seen at full moon, and varied over an order of magnitude as the eclipse progressed. These variations can be understood via a straightforward thermal scenario involving solar absorption by a ~50% covering of dust that has accumulated on the front surfaces of the reflectors. The same mechanism can explain the long-term degradation of signal from the reflectors as well as the acute signal deficit observed near full moon.

  8. Network and guest dependent thermal stability and thermal expansion in a trigonal host

    Indian Academy of Sciences (India)

    Viswanadha G Saraswatula; Mukhtar Ahmad Bhat; Suman Bhattacharya; Binoy K Saha

    2014-09-01

    Thermal stability and thermal expansion of bromo trimer synthon mediated hexagonal inclusion compounds of 2,4,6-tris(4-bromophenoxy)-1,3,5-triazine (BrPOT) with dichloromethane (DCM), tetrahydrofuran (THF) and hexamethyl benzene (HMB) and also the guest-free form of BrPOT are reported. Each of these three guests produced two concomitant inclusion compounds with BrPOT. The thermal stability of the solvate lattice increases with decreasing cavity size. The channel network of the DCM inclusion compound is stable only for a few seconds at room temperature outside the mother liquor, whereas the cage network of the DCM solvate is stable for months under similar conditions. Thermal expansions of the lattices depend upon the network, guest content as well as the type of guest molecules. The guest-free form exhibits the least thermal expansion in this series of systems.

  9. DSLM Instructional Approach to Conceptual Change Involving Thermal Expansion

    Science.gov (United States)

    She, Hsiao-Ching

    2003-01-01

    This article examines the process of students' conceptual change involving thermal expansion as a result of employing the Dual Situated Learning Model (DSLM) (She, 2001, 2002) as a classroom instructional approach. The dual situated learning events of this model are designed according to the students' ontological viewpoint of the science concepts as well as the nature of these concepts. Moreover, these events serve two functions in creating dissonance with the pre-existing knowledge and providing new schema for constructing a more scientific view of the concept. DSLM has been shown to promote students' conceptual change using one-to-one instructional procedure (She, 2002). This study further demonstrates that DSLM holds great potential to facilitate the conceptual change process involving thermal expansion through classroom instruction, even the difficult concept or higher hierarchical level one.

  10. Proposal for a material with negative thermal expansion

    Science.gov (United States)

    Abdullah, Mikrajuddin

    2016-09-01

    I propose a model of a material that exhibits negative thermal expansion (NTE) properties and criteria for the occurrence of linear and volumetric NTE. I derived the criteria for an arbitrary force between rigid units in the material. These criteria are also discussed specifically for the Lennard-Jones (6-12) potential and in more detail for metal-organic framework (MOF) materials comprising rigid units connected by organic linkers. Qualitatively, the model predictions can explain some observed results. Surprisingly, the model can produce equations for the transition temperature from NTE to positive thermal expansion (PTE), Tc ≈ T0 - 50 K, which is exactly the same as the temperature at which the glass transition begins to occur in most polymers, i.e., Tc ≈ Tg - 50 K.

  11. Measurement of Thermal Expansion Coefficients with Holographic Technique

    Institute of Scientific and Technical Information of China (English)

    ZhifengZhang

    1995-01-01

    A simplified mathematical model was created for measurement of thermal expansion coefficients of thin sheet materials with holographic technique.Experimental set-ups corresponding to the mathematical model were designed and built for both tests above room temperature and at low temperatures.A fringe control technique was introduced for low temperature measurements to compensate rigid body movement,THin sheet specimens of silicon and aluminum alloy(7075) were tested with the developed technique.The tested results are in good agreement with reported data and thus verify the validity of the developed technique.The Thermal expansion coefficients of the tested materials ranged from 2.5×10-60C-1 to 23.6×10-6oC-1.

  12. Thermal expansion of the earth and the speed of neutrinos

    CERN Document Server

    Unnikrishnan, C S

    2011-01-01

    It is pointed out that one of the systematic effects that can affect the measurement of the speed of neutrinos significantly is the variability of the unaveraged measurement of the distance between two points on the earth due to thermal expansion. Possible difference between estimates done with surface GPS apparatus and the true underground baseline can change substantially the statistical significance of the result of superluminal speed of neutrinos, reported recently.

  13. Zero thermal expansion in NaZn13-type La(Fe,Si)13 compounds.

    Science.gov (United States)

    Wang, Wei; Huang, Rongjin; Li, Wen; Tan, Jie; Zhao, Yuqiang; Li, Shaopeng; Huang, Chuanjun; Li, Laifeng

    2015-01-28

    A zero thermal expansion material in a pure form of NaZn13-type La(Fe,Si)13 was fabricated. Through optimizing the chemical composition, an isotropic zero thermal expansion material is achieved. The obtained materials exhibit a low expansion of |α| thermal expansion) over a broad temperature range (15-150 K). The present study indicates that the thermal expansion behavior of the NaZn13-type La(Fe,Si)13 compounds depends mainly on the content of Si element. This new material is desirable in many fields of industry as a reliable and low-cost zero thermal expansion material.

  14. Quantum elasticity of graphene: Thermal expansion coefficient and specific heat

    Science.gov (United States)

    Burmistrov, I. S.; Gornyi, I. V.; Kachorovskii, V. Yu.; Katsnelson, M. I.; Mirlin, A. D.

    2016-11-01

    We explore thermodynamics of a quantum membrane, with a particular application to suspended graphene membrane and with a particular focus on the thermal expansion coefficient. We show that an interplay between quantum and classical anharmonicity-controlled fluctuations leads to unusual elastic properties of the membrane. The effect of quantum fluctuations is governed by the dimensionless coupling constant, g0≪1 , which vanishes in the classical limit (ℏ →0 ) and is equal to ≃0.05 for graphene. We demonstrate that the thermal expansion coefficient αT of the membrane is negative and remains nearly constant down to extremely low temperatures, T0∝exp(-2 /g0) . We also find that αT diverges in the classical limit: αT∝-ln(1 /g0) for g0→0 . For graphene parameters, we estimate the value of the thermal expansion coefficient as αT≃-0.23 eV-1 , which applies below the temperature Tuv˜g0ϰ0˜500 K (where ϰ0˜1 eV is the bending rigidity) down to T0˜10-14 K. For T specific heat of the membrane and investigate the behavior of the Grüneisen parameter.

  15. Phonon anharmonicity and negative thermal expansion in SnSe

    Science.gov (United States)

    Bansal, Dipanshu; Hong, Jiawang; Li, Chen W.; May, Andrew F.; Porter, Wallace; Hu, Michael Y.; Abernathy, Douglas L.; Delaire, Olivier

    2016-08-01

    The anharmonic phonon properties of SnSe in the P n m a phase were investigated with a combination of experiments and first-principles simulations. Using inelastic neutron scattering (INS) and nuclear resonant inelastic X-ray scattering (NRIXS), we have measured the phonon dispersions and density of states (DOS) and their temperature dependence, which revealed a strong, inhomogeneous shift and broadening of the spectrum on warming. First-principles simulations were performed to rationalize these measurements, and to explain the previously reported anisotropic thermal expansion, in particular the negative thermal expansion within the Sn-Se bilayers. Including the anisotropic strain dependence of the phonon free energy, in addition to the electronic ground state energy, is essential to reproduce the negative thermal expansion. From the phonon DOS obtained with INS and additional calorimetry measurements, we quantify the harmonic, dilational, and anharmonic components of the phonon entropy, heat capacity, and free energy. The origin of the anharmonic phonon thermodynamics is linked to the electronic structure.

  16. The spectrum of the anomalous dimensions of the composite operators in the $\\varepsilon$- expansion in the scalar $\\phi^{4}$ - field theory

    CERN Document Server

    Derkachov, S E

    1995-01-01

    The spectrum of the anomalous dimensions of the composite operators (with arbitrary number of fields n and derivatives l) in the scalar \\phi^4 - theory in the first order of the \\epsilon -expansion is investigated. The exact solution for the operators with number of fields \\leq 4 is presented. The behaviour of the anomalous dimensions in the large l limit has been analyzed. It is given the qualitative description of the structure of the spectrum for the arbitrary n.

  17. Widespread range expansions shape latitudinal variation in insect thermal limits

    Science.gov (United States)

    Lancaster, Lesley T.

    2016-06-01

    Current anthropogenic impacts, including habitat modification and climate change, may contribute to a sixth mass extinction. To mitigate these impacts and slow further losses of biodiversity, we need to understand which species are most at risk and identify the factors contributing to current and future declines. Such information is often obtained through large-scale, comparative and biogeographic analysis of lineages or traits that are potentially sensitive to ongoing anthropogenic change--for instance to predict which regions are most susceptible to climate change-induced biodiversity loss. However, for this approach to be generally successful, the underlying causes of identified geographical trends need to be carefully considered. Here, I augment and reanalyse a global data set of insect thermal tolerances, evaluating the contribution of recent and contemporary range expansions to latitudinal variation in thermal niche breadth. Previous indications that high-latitude ectotherms exhibit broad thermal niches and high warming tolerances held only for species undergoing range expansions or invasions. In contrast, species with stable or declining geographic ranges exhibit latitudinally decreasing absolute thermal tolerances and no latitudinal variation in tolerance breadths. Thus, non-range-expanding species, particularly insular or endemic species, which are often of highest conservation priority, are unlikely to tolerate future climatic warming at high latitudes.

  18. Thermal expansion and magnetostriction studies on iron pnictides

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Liran

    2010-09-19

    In this work, a 3-terminal capacitance dilatometer was set up and used for measurements of the thermal expansion and magnetostriction of novel superconducting iron pinictides and related materials. In particular, RFeAsO with R = La, Ce, Pr, Sm, Gd, LaFeASO{sub 1-x}F{sub x} and Ca(F{sub 1-c}Co{sub x}){sub 2}As{sub 2} have been investigated. The data on polycrystalline LaFeAsO{sub 1-x} are the first published thermal expansion data on this material. The lattice effects at the structural and the magnetic phase transition have been investigated and the phase diagram upon F-doping has been studied. A main result is the observation of a previously unknown fluctuation regime for the doping level x ≤ 0.04 over a large T range above the structural transition temperature T{sub S}. The absence of any structural anomalies in the normal state of the superconducting LaFeAlO{sub 1-x}F{sub x} samples with x ≥ 0.05 corroborates the discontinuous character of the phase boundary not only for the magnetism but also for the structural degrees of freedom. Similarly, the presence of high-temperature fluctuations is found for all RFeAsO undoped materials under study. The discussion of the probable origin of the fluctuations as well as the definition of the structural transition temperature T{sub S} are done. The low temperature features shown by the thermal expansion data for RFeAsO are caused by the onset of long range magnetic order of the 4f-moments and their different configurations. In particular, PrFeAsO, which has a very pronounced anomaly associated with Pr-ordering exhibits a large magnetostriction at low temperatures. By discussing this effect along with the magnetization, resistivity and other measurements, it is found that this large magneto-elastic effect may originate from the correlations between the momentum from Fe{sup 3+} and Pr{sup 3+}. Last, the thermal expansion of Ca(Fe{sub 1-x}Co{sub x}){sub 2}As{sub 2} 122 single crystals is investigated. Ca(Fe{sub 1-x}Co{sub x

  19. Linear thermal expansion, thermal diffusivity and melting temperature of Am-MOX and Np-MOX

    Energy Technology Data Exchange (ETDEWEB)

    Prieur, D., E-mail: damien.prieur@ec.europa.eu [European Commission, Joint Research Centre (JRC), Institute for Transuranium Elements (ITU), Postfach 2340, 76125 Karlsruhe (Germany); Belin, R.C. [CEA, DEN, DEC/SPUA/LMPC, F-13108 Saint-Paul-lez Durance (France); Manara, D.; Staicu, D. [European Commission, Joint Research Centre (JRC), Institute for Transuranium Elements (ITU), Postfach 2340, 76125 Karlsruhe (Germany); Richaud, J.-C. [CEA, DEN, DEC/SPUA/LMPC, F-13108 Saint-Paul-lez Durance (France); Vigier, J.-F. [European Commission, Joint Research Centre (JRC), Institute for Transuranium Elements (ITU), Postfach 2340, 76125 Karlsruhe (Germany); Scheinost, A.C. [Helmholtz-Zentrum Dresden-Rossendorf, Institute of Resource Ecology, D-01314 Dresden (Germany); Somers, J. [European Commission, Joint Research Centre (JRC), Institute for Transuranium Elements (ITU), Postfach 2340, 76125 Karlsruhe (Germany); Martin, P. [CEA, DEN, DEC/SESC/LLCC, 13108 Saint-Paul-lez-Durance cedex (France)

    2015-07-15

    Highlights: • The thermal properties of Np- and Am-MOX solid solutions were investigated. • Np- and Am-MOX solid solutions exhibit the same linear thermal expansion. • The thermal conductivity of Am-MOX is about 10% higher than that of Np-MOX. • The melting temperatures of Np-MOX and Am-MOX are 3020 ± 30 K and 3005 ± 30 K, respectively. - Abstract: The thermal properties of Np- and Am-MOX solid solution materials were investigated. Their linear thermal expansion, determined using high temperature X-ray diffraction from room temperature to 1973 K showed no significant difference between the Np and the Am doped MOX. The thermal conductivity of the Am-MOX is about 10% higher than that of Np-MOX. The melting temperatures of Np-MOX and Am-MOX, measured using a laser heating self crucible arrangement were 3020 ± 30 K and 3005 ± 30 K, respectively.

  20. HAZARDS OF THERMAL EXPANSION FOR RADIOLOGICAL CONTAINER ENGULFED IN FIRE

    Energy Technology Data Exchange (ETDEWEB)

    Donna Post Guillen

    2013-05-01

    Fire accidents pose a serious threat to nuclear facilities. It is imperative that transport casks or shielded containers designed to transport/contain radiological materials have the ability to withstand a hypothetical fire. A numerical simulation was performed for a shielded container constructed of stainless steel and lead engulfed in a hypothetical fire as outlined by 10 CFR §71.73. The purpose of this analysis was to determine the thermal response of the container during and after the fire. The thermal model shows that after 30 minutes of fire, the stainless steel will maintain its integrity and not melt. However, the lead shielding will melt since its temperature exceeds the melting point. Due to the method of construction of the container under consideration, ample void space must be provided to allow for thermal expansion of the lead upon heating and melting, so as to not overstress the weldment.

  1. Copper-based conductive composites with tailored thermal expansion.

    Science.gov (United States)

    Della Gaspera, Enrico; Tucker, Ryan; Star, Kurt; Lan, Esther H; Ju, Yongho Sungtaek; Dunn, Bruce

    2013-11-13

    We have devised a moderate temperature hot-pressing route for preparing metal-matrix composites which possess tunable thermal expansion coefficients in combination with high electrical and thermal conductivities. The composites are based on incorporating ZrW2O8, a material with a negative coefficient of thermal expansion (CTE), within a continuous copper matrix. The ZrW2O8 enables us to tune the CTE in a predictable manner, while the copper phase is responsible for the electrical and thermal conductivity properties. An important consideration in the processing of these materials is to avoid the decomposition of the ZrW2O8 phase. This is accomplished by using relatively mild hot-pressing conditions of 500 °C for 1 h at 40 MPa. To ensure that these conditions enable sintering of the copper, we developed a synthesis route for the preparation of Cu nanoparticles (NPs) based on the reduction of a common copper salt in aqueous solution in the presence of a size control agent. Upon hot pressing these nanoparticles at 500 °C, we are able to achieve 92-93% of the theoretical density of copper. The resulting materials exhibit a CTE which can be tuned between the value of pure copper (16.5 ppm/°C) and less than 1 ppm/°C. Thus, by adjusting the relative amount of the two components, the properties of the composite can be designed so that a material with high electrical conductivity and a CTE that matches the relatively low CTE values of semiconductor or thermoelectric materials can be achieved. This unique combination of electrical and thermal properties enables these Cu-based metal-matrix composites to be used as electrical contacts to a variety of semiconductor and thermoelectric devices which offer stable operation under thermal cycling conditions.

  2. The Effect of Homogenization Heat Treatment on Thermal Expansion Coefficient and Dimensional Stability of Low Thermal Expansion Cast Irons

    Science.gov (United States)

    Chen, Li-Hao; Liu, Zong-Pei; Pan, Yung-Ning

    2016-08-01

    In this paper, the effect of homogenization heat treatment on α value [coefficient of thermal expansion (10-6 K-1)] of low thermal expansion cast irons was studied. In addition, constrained thermal cyclic tests were conducted to evaluate the dimensional stability of the low thermal expansion cast irons with various heat treatment conditions. The results indicate that when the alloys were homogenized at a relatively low temperature, e.g., 1023 K (750 °C), the elimination of Ni segregation was not very effective, but the C concentration in the matrix was moderately reduced. On the other hand, if the alloys were homogenized at a relatively high temperature, e.g., 1473 K (1200 °C), opposite results were obtained. Consequently, not much improvement (reduction) in α value was achieved in both cases. Therefore, a compound homogenization heat treatment procedure was designed, namely 1473 K (1200 °C)/4 hours/FC/1023 K (750 °C)/2 hours/WQ, in which a relatively high homogenization temperature of 1473 K (1200 °C) can effectively eliminate the Ni segregation, and a subsequent holding stage at 1023.15 K (750 °C) can reduce the C content in the matrix. As a result, very low α values of around (1 to 2) × 10-6 K-1 were obtained. Regarding the constrained thermal cyclic testing in 303 K to 473 K (30 °C to 200 °C), the results indicate that regardless of heat treatment condition, low thermal expansion cast irons exhibit exceedingly higher dimensional stability than either the regular ductile cast iron or the 304 stainless steel. Furthermore, positive correlation exists between the α 303.15 K to 473.15 K value and the amount of shape change after the thermal cyclic testing. Among the alloys investigated, Heat I-T3B (1473 K (1200 °C)/4 hours/FC/1023 K (750 °C)/2 hours/WQ) exhibits the lowest α 303 K to 473 K value (1.72 × 10-6 K-1), and hence has the least shape change (7.41 μm) or the best dimensional stability.

  3. Thermal expansion behavior of fluor-chlorapatite crystalline solutions

    Science.gov (United States)

    Hovis, G.; Harlov, D.; Gottschalk, M.; Hudacek, W.; Wildermuth, S.

    2009-04-01

    Apatite Ca5(PO4)3(F,Cl,OH,CO3) occurs widely as an accessory mineral in many igneous and metamorphic rocks and in nature displays a wide range of F-Cl-OH-CO3 mixtures (e.g., O'Reilly and Griffin, 2000) that have been used to interpret the role of fluids, e.g. Cl, F, and OH activities, during metamorphic and igneous processes (e.g., Harlov and Förster, 2002). It is important, therefore, to understand the thermodynamic behavior of these solid solutions, including their thermal expansion properties. Fluorapatite - chlorapatite samples were synthesized at the GFZ-Potsdam (Hovis, Harlov, Hahn and Steigert, 2007) using an adaptation of the molten flux method of Cherniak (2000). Dry CaF2 and CaCl2 (0.1 mole total) were mixed with Ca3(PO4)2 (0.03 moles), placed in a Pt crucible, equilibrated for 15 hours at 1375 °C, cooled to 1220 °C at 3 °C/hour, removed from the oven and cooled in air. Crystals were separated from the flux by boiling the quenched product in water. F:Cl fractions for each sample were determined via Rietveld refinement of X-ray powder diffraction data. Chemical homogeneity was confirmed by Rietveld refinement and high-contrast back-scattered electron imaging. Room-temperature unit-cell volumes were determined at the GFZ-Potsdam through Rietveld analysis of X-ray powder diffraction data and also at Lafayette College by standard unit-cell refinement techniques (Holland and Redfern, 1997) using NBS/NIST 640a Si as an internal standard. High-temperature unit-cell dimensions were calculated from X-ray powder diffraction data collected at Cambridge University from room temperature to 1000 °C on a Bruker D8 X-ray diffractometer. NBS Si again was utilized as an internal standard; high-temperature Si peak positions were taken from Parrish (1953). Results indicate that despite the considerable size difference between fluorine and chlorine ions, reflected by substantially different unit-cell sizes at room temperature, the coefficient of thermal expansion across

  4. Multiple thermal transitions and anisotropic thermal expansions of vertically aligned carbon nanotubes

    Science.gov (United States)

    Ya'akobovitz, Assaf

    2016-10-01

    Vertically aligned carbon nanotubes (VA-CNTs) hold the potential to play an instrumental role in a wide variety of applications in micro- and nano-devices and composites. However, their successful large-scale implementation in engineering systems requires a thorough understanding of their material properties, including their thermal behavior, which was the focus of the current study. Thus, the thermal expansion of as-grown VA-CNT microstructures was investigated while increasing the temperature from room temperature to 800 °C and then cooling it down. First thermal transition was observed at 191 ± 68 °C during heating, and an additional thermal transition was observed at 523 ± 138 °C during heating and at similar temperatures during cooling. Each thermal transition was characterized by a significant change in the coefficient of thermal expansion (CTE), which can be related to a morphological change in the VA-CNT microstructures. Measurements of the CTEs in the lateral directions revealed differences in the lateral thermal behaviors of the top, middle, and bottom portions of the VA-CNT microstructures, again indicating that their morphology dominates their thermal characteristics. A hysteretic behavior was observed, as the measured values of CTEs were altered due to the applied thermal loads and the height of the microstructures was slightly higher compared to its initial value. These findings provide an insight into the anisotropic thermal behavior of VA-CNT microstructures and shed light on the relationship between their morphology and thermal behavior.

  5. Structurally Efficient Three-dimensional Metamaterials with Controllable Thermal Expansion

    Science.gov (United States)

    Xu, Hang; Pasini, Damiano

    2016-01-01

    The coefficient of thermal expansion (CTE) of architected materials, as opposed to that of conventional solids, can be tuned to zero by intentionally altering the geometry of their structural layout. Existing material architectures, however, achieve CTE tunability only with a sacrifice in structural efficiency, i.e. a drop in both their stiffness to mass ratio and strength to mass ratio. In this work, we elucidate how to resolve the trade-off between CTE tunability and structural efficiency and present a lightweight bi-material architecture that not only is stiffer and stronger than other 3D architected materials, but also has a highly tunable CTE. Via a combination of physical experiments on 3D fabricated prototypes and numeric simulations, we demonstrate how two distinct mechanisms of thermal expansion appearing in a tetrahedron, can be exploited in an Octet lattice to generate a large range of CTE values, including negative, zero, or positive, with no loss in structural efficiency. The novelty and simplicity of the proposed design as well as the ease in fabrication, make this bi-material architecture well-suited for a wide range of applications, including satellite antennas, space optical systems, precision instruments, thermal actuators, and MEMS. PMID:27721437

  6. Nanoscale Electromechanics To Measure Thermal Conductivity, Expansion, and Interfacial Losses.

    Science.gov (United States)

    Mathew, John P; Patel, Raj; Borah, Abhinandan; Maliakkal, Carina B; Abhilash, T S; Deshmukh, Mandar M

    2015-11-11

    We study the effect of localized Joule heating on the mechanical properties of doubly clamped nanowires under tensile stress. Local heating results in systematic variation of the resonant frequency; these frequency changes result from thermal stresses that depend on temperature dependent thermal conductivity and expansion coefficient. The change in sign of the linear expansion coefficient of InAs is reflected in the resonant response of the system near a bath temperature of 20 K. Using finite element simulations to model the experimentally observed frequency shifts, we show that the thermal conductivity of a nanowire can be approximated in the 10-60 K temperature range by the empirical form κ = bT W/mK, where the value of b for a nanowire was found to be b = 0.035 W/mK(2), significantly lower than bulk values. Also, local heating allows us to independently vary the temperature of the nanowire relative to the clamping points pinned to the bath temperature. We suggest a loss mechanism (dissipation ~10(-4)-10(-5)) originating from the interfacial clamping losses between the metal and the semiconductor nanostructure.

  7. Structurally Efficient Three-dimensional Metamaterials with Controllable Thermal Expansion.

    Science.gov (United States)

    Xu, Hang; Pasini, Damiano

    2016-10-10

    The coefficient of thermal expansion (CTE) of architected materials, as opposed to that of conventional solids, can be tuned to zero by intentionally altering the geometry of their structural layout. Existing material architectures, however, achieve CTE tunability only with a sacrifice in structural efficiency, i.e. a drop in both their stiffness to mass ratio and strength to mass ratio. In this work, we elucidate how to resolve the trade-off between CTE tunability and structural efficiency and present a lightweight bi-material architecture that not only is stiffer and stronger than other 3D architected materials, but also has a highly tunable CTE. Via a combination of physical experiments on 3D fabricated prototypes and numeric simulations, we demonstrate how two distinct mechanisms of thermal expansion appearing in a tetrahedron, can be exploited in an Octet lattice to generate a large range of CTE values, including negative, zero, or positive, with no loss in structural efficiency. The novelty and simplicity of the proposed design as well as the ease in fabrication, make this bi-material architecture well-suited for a wide range of applications, including satellite antennas, space optical systems, precision instruments, thermal actuators, and MEMS.

  8. Structurally Efficient Three-dimensional Metamaterials with Controllable Thermal Expansion

    Science.gov (United States)

    Xu, Hang; Pasini, Damiano

    2016-10-01

    The coefficient of thermal expansion (CTE) of architected materials, as opposed to that of conventional solids, can be tuned to zero by intentionally altering the geometry of their structural layout. Existing material architectures, however, achieve CTE tunability only with a sacrifice in structural efficiency, i.e. a drop in both their stiffness to mass ratio and strength to mass ratio. In this work, we elucidate how to resolve the trade-off between CTE tunability and structural efficiency and present a lightweight bi-material architecture that not only is stiffer and stronger than other 3D architected materials, but also has a highly tunable CTE. Via a combination of physical experiments on 3D fabricated prototypes and numeric simulations, we demonstrate how two distinct mechanisms of thermal expansion appearing in a tetrahedron, can be exploited in an Octet lattice to generate a large range of CTE values, including negative, zero, or positive, with no loss in structural efficiency. The novelty and simplicity of the proposed design as well as the ease in fabrication, make this bi-material architecture well-suited for a wide range of applications, including satellite antennas, space optical systems, precision instruments, thermal actuators, and MEMS.

  9. Thermal expansion pump for capillary high-performance liquid chromatography.

    Science.gov (United States)

    Tao, Qian; Wu, Qian; Zhang, Xiangmin

    2010-02-01

    A thermal expansion pump (TEP) based on a principle of liquid thermal expansion for capillary high-performance liquid chromatography has been developed. The novel pump is capable of generating a continuous flow at high pressure for constant and stable delivery of binary solvents from nanoliters to microliters per minute without splitting. Theoretical equations for controlling fluidic output of this pump have been established and validated by a series of experiments. Factors affecting flow rate, such as density discrepancy, liquid compressibility, and mass loss in output, were taken into account. An assembly of the pump system employing two groups of thermal expansion pumps (TEPs) working in turns were fabricated, and a controlling strategy for the pump system to maintain a continuous delivery without pressure fluctuation even at switching points was also developed. Both isocratic and gradients of binary solvent delivery by the TEPs were performed. Reproducibility and standard deviation at different flow rates were determined. A capillary high-performance liquid chromatography (micro-HPLC) system consisting of the TEPs, an injection valve, a homemade packed capillary column (20 cm x 100 microm i.d. with 5 microm C18), and a laser-induced fluorescence detector was set up, and sample separations were carried out. Results of RSD = 4% for flow and RSD = 2% for retention times at 500 nL/min were achieved. Such a pump system has almost no moving parts except for the solvent switches. Its overall costs of manufacture and running are very low. It is proven that the TEPs system has great potential and competitive capabilities in capillary liquid chromatography.

  10. Modulus of Elasticity and Thermal Expansion Coefficient of ITO Film

    Energy Technology Data Exchange (ETDEWEB)

    Carter, Austin D. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States); Elhadj, S. [Lawrence Livermore National Lab. (LLNL), Livermore, CA (United States)

    2016-06-24

    The purpose of this experiment was to determine the modulus of elasticity (E) and thermal expansion coefficient (α) of RF sputtered Indium Tin Oxide (ITO) as a function of temperature (T), and to collect ITO film stress data. In order to accomplish that goal, the Toho FLX-2320-S thin film stress measurement machine was used to collect both single stress and stress-temperature data for ITO coated fused silica and sapphire substrates. The stress measurement function of the FLX-2320-S cannot be used to calculate the elastic modulus of the film because the Stoney formula incorporates the elastic modulus of the substrate, rather than of the film itself.

  11. Deformation analysis considering thermal expansion of injection mold

    Energy Technology Data Exchange (ETDEWEB)

    Kim, Jun Hyung; Yi, Dae Eun; Jang, Jeong Hui; Lee, Min Seok [Samsung Electronics Co., LTD., Seoul (Korea, Republic of)

    2015-09-15

    In the design of injection molds, the temperature distribution and deformation of the mold is one of the most important parameters that affect the flow characteristics, flash generation, and surface appearance, etc. Plastic injection analyses have been carried out to predict the temperature distribution of the mold and the pressure distribution on the cavity surface. As the input loads, we transfer the temperature and pressure results to the structural analysis. We compare the structural analysis results with the thermal expansion effect using the actual flash and step size of a smartphone cover part. To reduce the flash problem, we proposed a new mold design, and verified the results by performing simulations.

  12. High Accuracy Thermal Expansion Measurement at Cryogenic Temperatures

    Science.gov (United States)

    Tucker, Jim; Despit, Gregory; Stallcup, Michael; Presson, Joan; Nein, Max

    2003-01-01

    A new, interferometer-based system for measuring thermal expansion to an absolute accuracy of 20 ppb or better at cryogenic temperatures has been developed. Data from NIST Copper SRM 736 measured from room temperature to 15 K will be presented along with data from many other materials including beryllium, ULE, Zerodur, and composite materials. Particular attention will be given to a study by the Space Optics Manufacturing Technology Center (SOMTC) investigating the variability of ULE and beryllium materials used in the AMSD program Approximately 20 samples of each material, tested from room temperature to below 30 K are compared as a function of billet location.

  13. Coefficient of thermal expansion of stressed thin films

    Institute of Scientific and Technical Information of China (English)

    WANG Zheng-dao; JIANG Shao-qing

    2006-01-01

    A new technique was proposed to determine the coefficient of thermal expansion (CTE) of thin films at low temperature. Different pre-stress could be applied and the elastic modulus of materials at different temperatures was measured with CTE simultaneously to eliminate the influence of mechanical deformation caused by the pre-stress. By using this technique,the CTEs of polyimide/silica nanocomposite films with different silica doping levels were experimentally studied at temperature from 77 K to 287 K,and some characteristics related to this new technique were discussed.

  14. Series expansion of the photon self-energy in QED and the photon anomalous magnetic moment

    CERN Document Server

    Rojas, H Perez; Chavez, S Villalba

    2008-01-01

    We start from the analytical expression of the eigenvalues $\\kappa^{(i)}$ of the photon self-energy tensor in an external constant magnetic field $B$ calculated by Batalin Shabad in the Furry representation, and in the one-loop approximation. We expand in power series of the external field and in terms of the squared photon transverse momentum $z_2$ and (minus) transverse energy $z_1=k^2-z_2$, in terms of which are expressed $\\kappa^{(i)}$. A general expression is given for the photon anomalous magnetic moment $\\mu_{\\gamma}>0$ in the region of transparency, below the first threshold for pair creation, and it is shown that it is positive, i.e. paramagnetic. The results of the numerical calculation for $\\mu_{\\gamma}>0$ are displayed in a region close to the threshold.

  15. Negative thermal expansion and its relation to high pressures

    Science.gov (United States)

    Sikka, S. K.

    2004-04-01

    Most materials expand when heated. However, many exceptions are now known. Recently, interest in this has been revived with the discovery of isotropic negative thermal expansion (NTE) in ZrW2O8. From equation of state considerations, one can relate NTE to negative Grüneisen parameters (thermal or electronic). Under pressure, these lead to equation of state anomalies with the pressure derivative of the bulk modules being small or negative. Many of these materials undergo pressure-induced amorphization. This in some of them can be understood on the steric constraint model. It is also argued that NTE in most materials may be understood from the fact that these materials have two degenerate or nearly degenerate energy states. On increase of temperature, the material then samples the lower volume state, leading to NTE.

  16. Negative thermal expansion and its relation to high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Sikka, S K [Office of the Principal Scientific Adviser to the Government of India, 324-A, Vigyan Bhawan Annexe, Maulana Azad Road, New Delhi 110011 (India)

    2004-04-14

    Most materials expand when heated. However, many exceptions are now known. Recently, interest in this has been revived with the discovery of isotropic negative thermal expansion (NTE) in ZrW{sub 2}O{sub 8}. From equation of state considerations, one can relate NTE to negative Grueneisen parameters (thermal or electronic). Under pressure, these lead to equation of state anomalies with the pressure derivative of the bulk modules being small or negative. Many of these materials undergo pressure-induced amorphization. This in some of them can be understood on the steric constraint model. It is also argued that NTE in most materials may be understood from the fact that these materials have two degenerate or nearly degenerate energy states. On increase of temperature, the material then samples the lower volume state, leading to NTE.

  17. Low coefficient of thermal expansion polyimides containing metal ion additives

    Science.gov (United States)

    Stoakley, D. M.; St. Clair, A. K.

    1992-01-01

    Polyimides have become widely used as high performance polymers as a result of their excellent thermal stability and toughness. However, lowering their coefficient of thermal expansion (CTE) would increase their usefulness for aerospace and electronic applications where dimensional stability is a requirement. The incorporation of metal ion-containing additives into polyimides, resulting in significantly lowered CTE's, has been studied. Various metal ion additives have been added to both polyamic acid resins and soluble polyimide solutions in the concentration range of 4-23 weight percent. The incorporation of these metal ions has resulted in reductions in the CTE's of the control polyimides of 12 percent to over 100 percent depending on the choice of additive and its concentration.

  18. Interplay of variable thermal conductivity and expansivity on the thermal structure of oceanic lithosphere II

    Science.gov (United States)

    Honda, S.; Yuen, D. A.

    2004-04-01

    We have extended our previous analysis of the effects of constant vs. variable, i.e., pressure and temperature dependent thermal conductivity (k) and constant thermal expansivity (a) on the thermal structure of the oceanic lithosphere. We apply our analysis to the actual data set including information on the geoid slope. The heat flow and ocean floor depth data constrain the thermal expansivity (a ≍ 3 × 10-5 1/°C). Including geoid slope data may loosely constrain both the thermal expansivity and the thermal conductivity. The probable value of thermal conductivity is ≍ 3 W/m/°C for the constant k case and ≍ 4 W/m/°C (at ambient conditions) for the variable k case. These a and k are generally consistent with laboratory data of appropriate lithospheric materials. Our analysis supports the plate model with thin lithosphere and high bottom temperature, such as GDH1 (95 km; 1450°C). Variable k case requires slightly thinner and higher temperature lithosphere (≍ 85 km and ≍ 1500°C) and gives a slightly better fit to the geoid slope data.

  19. The thermal expansion of anhydrite to 1000° C

    Science.gov (United States)

    Evans, Howard T.

    1979-01-01

    The thermal expansion of anhydrite, CaSO4, has been measured from 22° to 1,000° C by X-ray diffraction, using the Guinier-Lenné heating powder camera. The heating patterns were calibrated with Guinier-Hägg patterns at 25° C, using quartz as internal standard. Heating experiments were run on natural anhydrite (Bancroft, Ontario), which at room temperature has lattice constants in close agreement with those of synthetic material. The orthorhombic unit cell at 22° C (space groupAmma) has a=7.003 (1) Å, b=6.996 (2) Å and c=6.242 (1) Å, V=305.9 (2) Å3. At room temperature, the thermal expansion coefficients α and β (α in °C−1×104, β in °C−2×108) are for a, 0.10, −0.69; forb, 0.08, 0.19; for c, 0.18, 1.60; for V, 0.37, 1.14. Second-order coefficients provide an excellent fit over the whole range to 1,000° C.

  20. Study on the Thermal Expansion and Thermal Cycling of AlNp/Al Composites

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The AIN particle reinforced aluminum matrix composites with 50% volume fraction were fabricated by squeeze-castingtechnology. The thermal expansion behavior and its response to thermal cycling were studied between 20C and400C. Compared with four theoretical models, the measured CTEs of the composite lie within the elastic boundsat lower temperature and elevated temperature, respectively. Strain hysteresis was observed between heating andcooling curves during cycling. This was attributed primarily to the anelastic behavior of the matrix induced by matrixresidual stresses.

  1. Interplay of variable thermal conductivity and expansivity on the thermal structure of oceanic lithosphere

    Science.gov (United States)

    Honda, S.; Yuen, D. A.

    The sensitivity of pressure- and temperature-dependent thermal conductivity (k: W/m/K) and the thermal expansivity (α:1/K) on the thermal structure of the oceanic plate is investigated parametrically by comparing the ocean floor depth and heat flux calculated by one-dimensional conduction model with those of GDH1, a theoretical thermal model of the oceanic lithosphere. We find that an optimum fit is obtained, when the value of thermal expansivity is ˜ 3 × 10-5, while those associated with the thermal conductivity have many possibilities. The estimates, which give an equally good fit to the GDH1 model, of the plate thickness D (km) and the temperature at the base of the plate Tm (°C) may be given by Tm ˜ 1450-(k0-4.5) × 100-(α-3.0 × 10-5) × 105×100, D ˜ 90 + (k0-4.5) × 20 - (α-3.0 × 10-5) × 105 × 20 where k0 (W/m/K) is the lattice thermal conductivity at the ocean floor. A similar relation is obtained for constant thermal conductivity.

  2. Interpenetration as a Mechanism for Negative Thermal Expansion in the Metal-Organic Framework Cu3(btb)2 (MOF-14)

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Yue; Peterson, Vanessa K.; Luks, Emily; Darwish, Tamim A.; Kepert, Cameron J. [Sydney; (ANSTO)

    2014-07-11

    Metal–organic framework materials (MOFs) have recently been shown in some cases to exhibit strong negative thermal expansion (NTE) behavior, while framework interpenetration has been found to reduce NTE in many materials. Using powder and single-crystal diffraction methods we investigate the thermal expansion behavior of interpenetrated Cu3(btb)2 (MOF-14) and find that it exhibits an anomalously large NTE effect. Temperature-dependent structural analysis shows that, contrary to other interpenetrated materials, in MOF-14 the large positive thermal expansion of weak interactions that hold the interpenetrating networks together results in a low-energy contractive distortion of the overall framework structure, demonstrating a new mechanism for NTE.

  3. Relationships between elastic anisotropy and thermal expansion in A2Mo3O12 materials.

    Science.gov (United States)

    Romao, Carl P; Donegan, S P; Zwanziger, J W; White, Mary Anne

    2016-11-09

    We report calculated elastic tensors, axial Grüneisen parameters, and thermal stress distributions in Al2Mo3O12, ZrMgMo3O12, Sc2Mo3O12, and Y2Mo3O12, a series of isomorphic materials for which the coefficients of thermal expansion range from low-positive to negative. Thermal stress in polycrystalline materials arises from interactions between thermal expansion and mechanical properties, and both can be highly anisotropic. Thermal expansion anisotropy was found to be correlated with elastic anisotropy: axes with negative thermal expansion were less compliant. Calculations of axial Grüneisen parameters revealed that the thermal expansion anisotropy in these materials is in part due to the Poisson effect. Models of thermal stress due to thermal expansion anisotropy in polycrystals following cooling showed thermal stresses of sufficient magnitude to cause microcracking in all cases. The thermal expansion anisotropy was found to couple to elastic anisotropy, decreasing the bulk coefficient of thermal expansion and leading to lognormal extremes of the thermal stress distributions.

  4. Thermal expansion behavior of a β-LiA1SiO4/Cu composite

    Institute of Scientific and Technical Information of China (English)

    WANG Lidong; XUE Zongwei; LIU Zhe; FEI Weidong

    2009-01-01

    A copper matrix composite reinforced by β-LiAlSiO4 with negative thermal expansion coefficient was fabricated using vacuum hot-pressed sintering technique. The thermal expansion behavior of the composite was investigated, and the average residual stress in the matrix was analyzed by a simple model. The results indicate that the residual stress in the matrix affects the thermal expansion properties. After heat treatment, the coefficient of thermal expansion (CTE) of the composite decreases greatly. The CTE of the composite after thermal cycling between 50-350℃ is the lowest.

  5. Linear thermal expansion, thermal diffusivity and melting temperature of Am-MOX and Np-MOX

    OpenAIRE

    PRIEUR DAMIEN; BELIN R. C.; Manara, Dario; Staicu, Dragos; RICHAUD J.-C.; VIGIER JEAN-FRANCOIS; Scheinost A.C.; Somers, Joseph; Martin, Philippe

    2014-01-01

    The thermal properties of Np- and Am-MOX solid solution materials were investigated. Their linear thermal expansion, determined using high temperature X-ray diffraction from room temperature to 1973 K showed no significant difference between the Np and the Am doped MOX. The thermal conductivity of the Am-MOX is about 10% higher than that of Np-MOX. The melting temperatures of Np-MOX and Am-MOX, measured using a laser heating self crucible arrangement were 3020 ± 30 K and 3005 ± 30 K, respecti...

  6. Thermal expansion properties of metallic and cermet coatings

    Energy Technology Data Exchange (ETDEWEB)

    Ilavsky, J.; Berndt, C.C. [State Univ. of New York, Stony Brook, NY (United States). Center for Thermal Spray Res.

    1998-04-01

    Free-standing deposits of NiCrAl, stainless steel, and 8 wt.% yttria-stabilized zirconia were prepared using atmospheric plasma spraying and high velocity oxygen fuel processing. Feedstock powders were blended, yielding mixtures (by weight) of 100%, 75%, and 50% of the metallic material. Porosity and composition (i.e. metal or ceramic constituents) of these deposits were measured by image analysis. The coefficient of thermal expansion (CTE) was measured in the 200-950 C interval for four thermal cycles. The first runs of these CTE measurements were not linear and differentiation of this curve established the CTE dependence with respect to temperature. Maximums in CTE behavior suggest that stress relaxation and/or oxidation may be occurring. Measurements of CTE from thermal cycles after the first cycle were constant and obeyed the law of mixtures in the measured temperature region, suggesting that stress relaxation and/or oxidation, evident in the first cycle, are no longer dominant. Microstructural analysis and microhardness measurements were used to confirm the findings from CTE measurements. (orig.) 13 refs.

  7. Strongly anomalous non-thermal fixed point in a quenched two-dimensional Bose gas

    CERN Document Server

    Karl, Markus

    2016-01-01

    Universal scaling behavior in the relaxation dynamics of an isolated two-dimensional Bose gas is studied by means of semi-classical stochastic simulations of the Gross-Pitaevskii model. The system is quenched far out of equilibrium by imprinting vortex defects into an otherwise phase-coherent condensate. A strongly anomalous non-thermal fixed point is identified, associated with a slowed decay of the defects in the case that the dissipative coupling to the thermal background noise is suppressed. At this fixed point, a large anomalous exponent $\\eta \\simeq -3$ and, related to this, a large dynamical exponent $z \\simeq 5$ are identified. The corresponding power-law decay is found to be consistent with three-vortex-collision induced loss. The article discusses these aspects of non-thermal fixed points in the context of phase-ordering kinetics and coarsening dynamics, thus relating phenomenological and analytical approaches to classifying far-from-equilibrium scaling dynamics with each other. In particular, a clo...

  8. Elastic cell membranes induce long-lived anomalous thermal diffusion on nearby particles

    CERN Document Server

    Daddi-Moussa-Ider, Abdallah; Gekle, Stephan

    2016-01-01

    The physical approach of a small particle (virus, medical drug) to the cell membrane represents the crucial first step before active internalization and is governed by thermal diffusion. Using a fully analytical theory we show that the stretching and bending of the elastic membrane by the approaching particle induces a memory in the system which leads to anomalous diffusion, even though the particle is immersed in a purely Newtonian liquid. For typical cell membranes the transient subdiffusive regime extends beyond 10ms and can enhance residence times and binding rates up to 50\\%. Our analytical predictions are validated by numerical simulations.

  9. Thermal field theory to all orders in gradient expansion

    CERN Document Server

    Millington, Peter

    2013-01-01

    We present a new perturbative formulation of non-equilibrium thermal field theory, based upon non-homogeneous free propagators and time-dependent vertices. The resulting time-dependent diagrammatic perturbation series are free of pinch singularities without the need for quasi-particle approximation or effective resummation of finite widths. After arriving at a physically meaningful definition of particle number densities, we derive master time evolution equations for statistical distribution functions, which are valid to all orders in perturbation theory and all orders in a gradient expansion. For a scalar model, we make a loopwise truncation of these evolution equations, whilst still capturing fast transient behaviour, which is found to be dominated by energy-violating processes, leading to non-Markovian evolution of memory effects.

  10. Thermal Expansion Studies of Selected High-Temperature Thermoelectric Materials

    Science.gov (United States)

    Ravi, Vilupanur; Firdosy, Samad; Caillat, Thierry; Brandon, Erik; van der Walde, Keith; Maricic, Lina; Sayir, Ali

    2009-07-01

    Radioisotope thermoelectric generators (RTGs) generate electrical power by converting the heat released from the nuclear decay of radioactive isotopes (typically plutonium-238) into electricity using a thermoelectric converter. RTGs have been successfully used to power a number of space missions and have demonstrated their reliability over an extended period of time (tens of years) and are compact, rugged, radiation resistant, scalable, and produce no noise, vibration or torque during operation. System conversion efficiency for state-of-practice RTGs is about 6% and specific power ≤5.1 W/kg. A higher specific power would result in more onboard power for the same RTG mass, or less RTG mass for the same onboard power. The Jet Propulsion Laboratory has been leading, under the advanced thermoelectric converter (ATEC) project, the development of new high-temperature thermoelectric materials and components for integration into advanced, more efficient RTGs. Thermoelectric materials investigated to date include skutterudites, the Yb14MnSb11 compound, and SiGe alloys. The development of long-lived thermoelectric couples based on some of these materials has been initiated and is assisted by a thermomechanical stress analysis to ensure that all stresses under both fabrication and operation conditions will be within yield limits for those materials. Several physical parameters are needed as input to this analysis. Among those parameters, the coefficient of thermal expansion (CTE) is critically important. Thermal expansion coefficient measurements of several thermoelectric materials under consideration for ATEC are described in this paper. The stress response at the interfaces in material stacks subjected to changes in temperature is discussed, drawing on work from the literature and project-specific tools developed here. The degree of CTE mismatch and the associated effect on the formation of stress is highlighted.

  11. Thermal Expansion Studies of Selected High Temperature Thermoelectric Materials

    Science.gov (United States)

    Ravi, Vilupanur; Firdosy, Samad; Caillat, Thierry; Brandon, Erik; Van Der Walde, Keith; Maricic, Lina; Sayir, Ali

    2008-01-01

    Radioisotope thermoelectric generators (RTGs) generate electrical power by converting the heat released from the nuclear decay of radioactive isotopes (typically plutonium-238) into electricity using a thermoelectric converter. RTGs have been successfully used to power a number of space missions and have demonstrated their reliability over an extended period of time (tens of years) and are compact, rugged, radiation resistant, scalable, and produce no noise, vibration or torque during operation. System conversion efficiency for state-of-practice RTGs is about 6% and specific power less than or equal to 5.1 W/kg. Higher specific power would result in more on-board power for the same RTG mass, or less RTG mass for the same on-board power. The Jet Propulsion Laboratory has been leading, under the advanced thermoelectric converter (ATEC) project, the development of new high-temperature thermoelectric materials and components for integration into advanced, more efficient RTGs. Thermoelectric materials investigated to date include skutterudites, the Yb14MnSb11 compound, and SiGe alloys. The development of long-lived thermoelectric couples based on some of these materials has been initiated and is assisted by a thermo-mechanical stress analysis to ensure that all stresses under both fabrication and operation conditions will be within yield limits for those materials. Several physical parameters are needed as input to this analysis. Among those parameters, the coefficient of thermal expansion (CTE) is critically important. Thermal expansion coefficient measurements of several thermoelectric materials under consideration for ATEC are described in this paper. The stress response at the interfaces in material stacks subjected to changes in temperature is discussed, drawing on work from the literature and project-specific tools developed here. The degree of CTE mismatch and the associated effect on the formation of stress is highlighted.

  12. Local Structural Distortion Induced Uniaxial Negative Thermal Expansion in Nanosized Semimetal Bismuth.

    Science.gov (United States)

    Li, Qiang; Zhu, He; Zheng, Lirong; Fan, Longlong; Ren, Yang; Chen, Jun; Deng, Jinxia; Xing, Xianran

    2016-11-01

    The corrugated layer structure bismuth has been successfully tailored into negative thermal expansion along c axis by size effect. Pair distribution function and extended X-ray absorption fine structure are combined to reveal the local structural distortion for nanosized bismuth. The comprehensive method to identify the local structure of nanomaterials can benefit the regulating and controlling of thermal expansion in nanodivices.

  13. PREPARATION OF HIGH THERMAL EXPANSION COEFFICIENT PORCELAINS FUSED TO METALS

    Institute of Scientific and Technical Information of China (English)

    J.P. Yang; J.Q. Wu

    2003-01-01

    Usually the thermal expansion coefficients (TEC) of metals are higher than that of porcelains. In order to match the TECs in the case of coating porcelains on metals, high TEC porcelains are needed. In this research, the high TEC phase leucite(KAlSi2 O6) in the high TEC porcelain was prepared by sol-gel method. The crystal size of leucite made by sol-gel is about 77nm through controlling the process parameters. The process from xerogel to leucite was investigated by means of DSC (differential scanning calorimetry), TG (thermogravimetry), XRD ( X-ray diffraction) and IR(infrared absorption spectrum). Leucite had been detected after the gel was treated at 900°C, this formation temperature is about 250°C lower than that of melting method.The porcelain made from 50% of the leucite powder and 50%o of low fused temperature frit has an average TEC of 19.2× 10-6/° C from room temperature to 450°C, which is much higher than the common porcelains.

  14. Calculation of thermal expansion coefficient of glasses based on topological constraint theory

    Science.gov (United States)

    Zeng, Huidan; Ye, Feng; Li, Xiang; Wang, Ling; Yang, Bin; Chen, Jianding; Zhang, Xianghua; Sun, Luyi

    2016-10-01

    In this work, the thermal expansion behavior and the structure configuration evolution of glasses were studied. Degree of freedom based on the topological constraint theory is correlated with configuration evolution; considering the chemical composition and the configuration change, the analytical equation for calculating the thermal expansion coefficient of glasses from degree of freedom was derived. The thermal expansion of typical silicate and chalcogenide glasses was examined by calculating their thermal expansion coefficients (TEC) using the approach stated above. The results showed that this approach was energetically favorable for glass materials and revealed the corresponding underlying essence from viewpoint of configuration entropy. This work establishes a configuration-based methodology to calculate the thermal expansion coefficient of glasses that, lack periodic order.

  15. Thermal expansion properties of Lu2-x FexMo3O12

    Institute of Scientific and Technical Information of China (English)

    Wu Mei-Mei; Peng Jie; Zu Yong; Liu Rong-Deng; Hu Zhong-Bo; Liu Yun-Tao; Chen Dong-Feng

    2012-01-01

    The structures and thermal expansion properties of Lu2-xFex Mo3O12 have been investigated by X-ray diffraction (XRD).XRD patterns at room temperature indicate that componnds Lu2 xFexMo3O12 with x ≤ 1.3 exhibit an orthorhombic structure with space group Pnca;compounds with x =1.5 and 1.7 have a monoclinic structure with space group P21/a.Studies on thermal expansion properties show that the linear thermal expansion coefficients of orthorhombic phase vary from negative to positive with increasing Fe content.Attempts to make zero thermal expansion materials indicate that zero thermal expansion can be observed in Lu1.3Feo.7Mo3O12 in the temperature range of 200-400°C.

  16. Thermal Expansion Anomaly of Tb2Fe14Cr3 Compound

    Institute of Scientific and Technical Information of China (English)

    HAO Yan-Ming; HE Xiao-Hong; AN Li-Qun; Fu Bin

    2008-01-01

    We investigate the thermal expansion property of the Tb2Fe14Cr3 compound by means of x-ray diffraction.The result shows that the Tb2Fe14Cr3 compound has a hexagonal Th2Ni17-type structure.Negative thermal expansion is found in the Tb2Fe14Cr3 compound from 296 to 493K by x-ray dilatometry.The coefficient of the average thermal expansion is (a)=-2.82×10-5 K-1.In the temperature range 493-692K,the coefficient of the average thermal expansion is (a)=1.59×10-5 K-1.The physical mechanism of thermal expansion anomaly of the Tb2Fe14Cr3 compound is discussed according to the temperature dependence of magnetization measured by a superconducting quantum interference device.

  17. Anomalous thermally induced pinning of a liquid drop on a solid substrate.

    Science.gov (United States)

    Mettu, Srinivas; Kanungo, Mandakini; Law, Kock-Yee

    2013-08-27

    The effect of substrate temperature on the wetting and spreading behavior of a UV ink monomer has been studied as a surrogate for the ink on four different substrates: DTC (digital top coat)-coated BOPP (biaxial oriented polypropylene), Flexo-coated BOPP, DTC-coated SGE (semigloss elite) paper, and Flexo-coated SGE paper. Results show that the dynamic contact angles of the monomer decrease exponentially over time after contacting the surface, and the rate of spreading is consistently higher at 95 °C than at 22 °C. This observation indicates that spreading is controlled by the viscosity of the monomer as it decreases with temperature. An anomalous temperature effect is observed for the static contact angle on the DTC-coated BOPP substrate. The static contact angle at 95 °C is significantly larger than that at 22 °C (52° versus 30°). This is counterintuitive, as the surface tension of the monomer is shown to decease with increasing temperature. Microscopy (SEM and AFM) studies suggest that there is little interaction between the DTC coating solution and the BOPP substrate during the fast-drying coating process. This results in a smooth coated surface and, more importantly, voids between the BOPP nanofibers underneath the DTC coating. As the DTC-BOPP substrate is heated to 95 °C, fiber expansions occur. Microscopy results show that nanosized protrusions are formed on the DTC surface. We attribute it to fiber expansions in the vertical direction. Fiber expansions in the lateral direction causes little surface morphology change as the expanded materials only fill the voids laterally between the nanofiber network. We suggest that the protrusions on the surface create strong resistance to the wetting process and pin the monomer drop into a metastable wetting state. This interpretation is supported by the sliding angle and sessile drop height experiments.

  18. Absence of the Thermal Hall Effect in Anomalous Nernst and Spin Seebeck Effects

    Science.gov (United States)

    Chen, Yi-Jia; Huang, Ssu-Yen

    2016-12-01

    The anomalous Nernst effect (ANE) and the spin Seebeck effect (SSE) in spin caloritronics are two of the most important mechanisms to manipulate the spin-polarized current and pure spin current by thermal excitation. While the ANE in ferromagnetic metals and the SSE in magnetic insulators have been extensively studied, a recent theoretical work suggests that the signals from the thermal Hall effect (THE) have field dependences indistinguishable from, and may even overwhelm, those of the ANE and SSE. Therefore, it is vital to investigate the contribution of the THE in the ANE and SSE. In this work, we systematically study the THE in a ferromagnetic metal, Permalloy (Py), and magnetic insulator, an yttrium iron garnet (YIG), by using different Seebeck coefficients between electrodes and contact wires. Our results demonstrate that the contribution of the THE by the thermal couple effect in the Py and YIG is negligibly small if one includes the thickness dependence of the Seebeck coefficient. Thus, the spin-polarized current in the ANE and the pure spin current in the SSE remain indispensable for exploring spin caloritronics phenomena.

  19. Thermal expansion behaviour of Long-Period Stacking Ordered (LPSO) phase

    Energy Technology Data Exchange (ETDEWEB)

    Garces, G.; Requena, G.; Tolnai, D.; Perez, P.; Adeva, P.; Jimenez, J. A.; Stark, A.; Schell, N.

    2015-07-01

    The lineal thermal expansion coefficient of the 18R Long-Period Stacking Ordered (LPSO) structure was determined in the range between room temperature and 400 degree centigrade by dilatometry and synchrotron radiation diffraction. Results clearly show that the lineal thermal expansion coefficients for magnesium and the LPSO phase are similar and therefore no mismatch thermal stresses are generated at their interface in two-phase Mg-Y-Zn alloys containing this phase during thermomechanical processing. (Author)

  20. 框架结构化合物的热膨胀和相变特性%THERMAL EXPANSION AND PHASE TRANSITIONS IN FRAMEWORK STRUCTURED COMPOUNDS

    Institute of Scientific and Technical Information of China (English)

    TYAGI A K; ACHARY S N

    2009-01-01

    Thermal expansion of materials is an important constraint in the modern precise technological devices facing the thermal gradients. Though all the materils expand on heating due to the thermal expansion of chemical bonds, there are several materials which exhibit anomalous (low or negative) thermal expansion behavior. Such materials become lucrative for the fundamental under- standing as well as in designing tunable thermal expansion materials for technological applications. It has been known that the anomalous thermal expansion behaviors of materials are the direct consequences of their crystal structure which are commonly ob- served in the framework architect compounds. Recently, a large number of AMo2O8, APO4, A2Mo3O12 type framework compounds have been studied to understand the role of crystal structure on thermal expansion behavior and phase transition. The results of de- tailed crystallographic studies relating the structural intricacies to their thermal expansions and phases transitions are reviewed in this article.%在现代精密器件中,因存在热梯度,材料的热膨胀成为一个重要的影响因素.通常材料受热后因化学键的伸长而产生膨胀,而仍有一些材料显示异常的(低的或负的)热膨胀特性,这些特性值得深入研究.并以期设计具有应用可能的热膨胀系数uI控的材料.众所刷知,材料的异常热膨胀特性与框架构造化合物中的晶体结构常存在密切关系.近年来,人们对AMo2O8,APO4,A2Mo3O12炎系列框架构造化合物进行了研究,以了解晶体结构对其热膨胀特性和相转变过程的影响.本文综合评述了影响这类材料热膨胀特性和相转变过程相关的结晶学研究结果.

  1. Thermally Driven Pure Spin and Valley Currents via the Anomalous Nernst Effect in Monolayer Group-VI Dichalcogenides

    DEFF Research Database (Denmark)

    Yu, Xiao-Qin; Zhu, Zhen-Gang; Su, Gang;

    2015-01-01

    The spin and valley-dependent anomalous Nernst effects are analyzed for monolayer MoS2 and other group-VI dichalcogenides. We find that pure spin and valley currents can be generated perpendicular to the applied thermal gradient in the plane of these two-dimensional materials. This effect provide...

  2. The coefficient of bond thermal expansion measured by extended x-ray absorption fine structure.

    Science.gov (United States)

    Fornasini, P; Grisenti, R

    2014-10-28

    The bond thermal expansion is in principle different from the lattice expansion and can be measured by correlation sensitive probes such as extended x-ray absorption fine structure (EXAFS) and diffuse scattering. The temperature dependence of the coefficient α(bond)(T) of bond thermal expansion has been obtained from EXAFS for CdTe and for Cu. A coefficient α(tens)(T) of negative expansion due to tension effects has been calculated from the comparison of bond and lattice expansions. Negative lattice expansion is present in temperature intervals where α(bond) prevails over α(tens); this real-space approach is complementary but not equivalent to the Grüneisen theory. The relevance of taking into account the asymmetry of the nearest-neighbours distribution of distances in order to get reliable bond expansion values and the physical meaning of the third cumulant are thoroughly discussed.

  3. Thermally-induced expansion in the 8 GeV/c $\\pi^{-} + ^{197}Au$ reaction

    CERN Document Server

    Lefort, T; Botvina, A S; Durand, D; Kwiatkowski, K K; Hsi, W C; Pienkowski, L; Back, B B; Breuer, H; Gushue, S; Korteling, R G; Martin, R L E; Ramakrishnan, E; Remsberg, L P; Rowland, D; Ruangma, A; Viola, V E; Winchester, E M; Yennello, S J

    2000-01-01

    Fragment kinetic energy spectra for reactions induced by 8.0 GeV/c order to deduce the possible existence and influence of thermal expansion. The average fragment kinetic energies are observed to increase systematically with fragment charge and to be nearly independent of excitation energy. Comparison of the data with statistical multifragmentation models indicates the onset of extra collective thermal expansion near an excitation energy of E*/A expansion observed in heavy-ion-induced reactions, consistent with the interpretation that the latter expansion may be driven primarily by dynamical effects such as compression/decompression.

  4. INFLUENCE OF THERMAL CYCLING ON MICROSTRUCTURE AND THERMAL EXPANSION OF CARBON FIBRES/COPPER COMPOSITES

    Directory of Open Access Journals (Sweden)

    Pavol Štefánik

    2009-06-01

    Full Text Available The preparation of copper matrix reinforced by high modulus carbon fibres (Thornel K1100 as well as the microstructure and dilatation changes during thermocycling is presented.Unidirectional composites with two types of matrix - pure copper and/or copper alloy with 0.2 wt. % of chromium - were thermally cycled between 30-600 °C three times.The composite with pure Cu exhibited larger voids and weak interfacial bonding. Due to the chemical reaction with K1100 fibres a reactive interfacial bonding has been formed. During thermocycling the hysteresis, but no large disintegration was observed. The coefficients of thermal expansion (CTEs strongly depend on fibre orientation. In direction parallel to the fibre orientation in the temperature range of 220-500°C CTEs were very low (0.7-1.0x10-6/K, but in perpendicular direction the CTEs were higher than that of pure copper.

  5. Controllable rectification of the axial expansion in the thermally driven artificial muscle

    Science.gov (United States)

    Yue, Donghua; Zhang, Xingyi; Yong, Huadong; Zhou, Jun; Zhou, You-He

    2015-09-01

    At present, the concept of artificial muscle twisted by polymers or fibers has become a hot issue in the field of intelligent material research according to its distinguishing advantages, e.g., high energy density, large-stroke, non-hysteresis, and inexpensive. The axial thermal expansion coefficient is an important parameter which can affect its demanding applications. In this letter, a device with high accuracy capacitive sensor is constructed to measure the axial thermal expansion coefficient of the twisted carbon fibers and yarns of Kevlar, and a theoretical model based on the thermal elasticity and the geometrical features of the twisted structure are also presented to predict the axial expansion coefficient. It is found that the calculated results take good agreements with the experimental data. According to the present experiment and analyses, a method to control the axial thermal expansion coefficient of artificial muscle is proposed. Moreover, the mechanism of this kind of thermally driven artificial muscle is discussed.

  6. Nonlinear temperature characteristic of thermal expansion of Grf/Mg composites

    Institute of Scientific and Technical Information of China (English)

    SONG Mei-hui; XIU Zi-yang; WU Gao-hui; CHEN Guo-qin

    2009-01-01

    Graphite fiber reinforced magnesium matrix(Grf/Mg) composites were fabricated by squeeze casting technology. M40 graphite fibers were reinforced to AZ91D and ZM6, their thermal expansion behaviors of M40/AZ91D and M40/ZM6 composites in the temperature range from 20 to 490 ℃ were investigated. The results show that the interfacial species and thermal stress have significant influence on the thermal expansion behavior of the composites. Simultaneously, the longitudinal coefficient of thermal expansion of Grf/Mg composites are affected by the thermal stress, interfacial species and yield strength of matrix alloy, it also decreases with increasing temperature and descending rate of longitudinal coefficient of thermal expansion(CTEs) of Grf/Mg composites changed in different temperature ranges. In terms of different descending rates, the curve of coefficient of thermal expansion vs temperature can be divided into three stages. The matrix alloys M40/AZ91D and M40/ZM6 yield at 170 and 155℃ in the thermal expansion, respectively.

  7. Multi-scale numerical simulations of thermal expansion properties of CNT-reinforced nanocomposites.

    Science.gov (United States)

    Alamusi, Affa; Hu, Ning; Qiu, Jianhui; Li, Yuan; Chang, Christiana; Atobe, Satoshi; Fukunaga, Hisao; Liu, Yaolu; Ning, Huiming; Wu, Liangke; Li, Jinhua; Yuan, Weifeng; Watanabe, Tomonori; Yan, Cheng; Zhang, Yajun

    2013-01-07

    In this work, the thermal expansion properties of carbon nanotube (CNT)-reinforced nanocomposites with CNT content ranging from 1 to 15 wt% were evaluated using a multi-scale numerical approach, in which the effects of two parameters, i.e., temperature and CNT content, were investigated extensively. For all CNT contents, the obtained results clearly revealed that within a wide low-temperature range (30°C ~ 62°C), thermal contraction is observed, while thermal expansion occurs in a high-temperature range (62°C ~ 120°C). It was found that at any specified CNT content, the thermal expansion properties vary with temperature - as temperature increases, the thermal expansion rate increases linearly. However, at a specified temperature, the absolute value of the thermal expansion rate decreases nonlinearly as the CNT content increases. Moreover, the results provided by the present multi-scale numerical model were in good agreement with those obtained from the corresponding theoretical analyses and experimental measurements in this work, which indicates that this multi-scale numerical approach provides a powerful tool to evaluate the thermal expansion properties of any type of CNT/polymer nanocomposites and therefore promotes the understanding on the thermal behaviors of CNT/polymer nanocomposites for their applications in temperature sensors, nanoelectronics devices, etc.

  8. Tuning of a cavity in a silicon photonic crystal by thermal expansion of an elastomeric infill

    NARCIS (Netherlands)

    Erdamar, A.K.; Van Leest, M.M.; Picken, S.J.; Caro, J.

    2011-01-01

    We use an elastomer as infill material for a photonic crystal. As a result of the thermal-expansion-induced strongly negative thermal optical coefficient, this material is highly suitable for thermal tuning of the transmission of a cavity. This is demonstrated by global infilling of a hole-type sili

  9. Thermophysical Properties of Matter - the TPRC Data Series. Volume 13. Thermal Expansion - Nonmetallic Solids

    Science.gov (United States)

    1977-01-01

    Amer. Dental Assoc., 20, 108-19, 1933. 267 52429 Nielsen, T. H. and Leipold, M. H., "Thermal Expansion of Yttria-Stpbilized Zirconia , "J. Amer. Ceram...isotropic the coefficient of thermal Symmetres expansion is equal to three times the coefficient of linear thermal expansion; i.e., Cubic at a, a1 0 0 0...can Where sj (j = 4, 5, 6) = 0, as in cubic , hexagonal, happen in open-structure crystals, such as silicon orthorhombic, and some tetragonal crystals, a

  10. A theoretical approach to thermal noise caused by an inhomogeneously distributed loss -- Physical insight by the advanced modal expansion

    OpenAIRE

    Yamamoto, Kazuhiro; Ando, Masaki; Kawabe, Keita; Tsubono, Kimio

    2006-01-01

    We modified the modal expansion, which is the traditional method used to calculate thermal noise. This advanced modal expansion provides physical insight about the discrepancy between the actual thermal noise caused by inhomogeneously distributed loss and the traditional modal expansion. This discrepancy comes from correlations between the thermal fluctuations of the resonant modes. The thermal noise spectra estimated by the advanced modal expansion are consistent with the results of measurem...

  11. Effects of freezing rates and cryoprotectant on thermal expansion of articular cartilage during freezing process.

    Science.gov (United States)

    Xu, Y; Sun, H J; Lv, Y; Zou, J C; Lin, B L; Hua, T C

    2013-01-01

    The intact articular cartilage has not yet been successfully preserved at low temperature most likely due to the volume expansion from water to ice during freezing. The objective of this current study focuses on examining thermal expansion behavior of articular cartilage (AC) during freezing from 0 degree C to -100 degree C. Thermo Mechanical Analysis (TMA) was used to investigate the effects of different concentrations of dimethyl sulphoxide (DMSO) (0%, 10%, 30% and 60% v/v) and different freezing rates (1 C/min, 3 C/min and 5 C/min). The results showed that: (1) the inhomogeneous thermal expansion (or contraction) presents due to inhomogeneous water distributions in articular cartilage during freezing, which also may be the most likely reason that the matrix has been damaged in cryopreserved intact articular cartilage; (2) at the phase transition temperature range, the maximum thermal strain change value for 5C/min is approximately 1.45 times than that for 1 C/min, but the maximum thermal expansion coefficient of the later is about six times than that of the former; (3) the thermal expansion coefficient decreases with increasing cooling rate at the unfrozen temperature region, but some opposite results are obtained at the frozen temperature region; (4) the higher the DMSO concentration is, at the phase change temperature region, the smaller the thermal strain change as well as the maximum thermal expansion coefficient are, but DMSO concentration exhibits little effect on the thermal expansion coefficient at both unfrozen and frozen region. Once the DMSO concentration increasing enough, e.g. 60% v/v, the thermal strain decreases linearly and smoothly without any abrupt change due to little or no ice crystal forms (i.e. vitrification) in frozen articular cartilage. This study may improve our understanding of the thermal expansion (or contraction) behavior of cryopreserved articular cartilage and it may be useful for the future study on cryopreservation of intact

  12. Thermally anomalous features in the subsurface of Enceladus's south polar terrain

    Science.gov (United States)

    Le Gall, A.; Leyrat, C.; Janssen, M. A.; Choblet, G.; Tobie, G.; Bourgeois, O.; Lucas, A.; Sotin, C.; Howett, C.; Kirk, R.; Lorenz, R. D.; West, R. D.; Stolzenbach, A.; Massé, M.; Hayes, A. H.; Bonnefoy, L.; Veyssière, G.; Paganelli, F.

    2017-03-01

    Saturn's moon Enceladus is an active world. In 2005, the Cassini spacecraft witnessed for the first time water-rich jets venting from four anomalously warm fractures (called sulci) near its south pole1,2. Since then, several observations have provided evidence that the source of the material ejected from Enceladus is a large underground ocean, the depth of which is still debated3-6. Here, we report on the first and only opportunity that Cassini's RADAR instrument7,8 had to observe Enceladus's south polar terrain closely, targeting an area a few tens of kilometres north of the active sulci. Detailed analysis of the microwave radiometry observations highlights the ongoing activity of the moon. The instrument recorded the microwave thermal emission, revealing a warm subsurface region with prominent thermal anomalies that had not been identified before. These anomalies coincide with large fractures, similar or structurally related to the sulci. The observations imply the presence of a broadly distributed heat production and transport system below the south polar terrain with 'plate-like' features and suggest that a liquid reservoir could exist at a depth of only a few kilometres under the ice shell at the south pole. The detection of a possible dormant sulcus further suggests episodic geological activity.

  13. Sensitivity analysis of hydraulic and thermal parameters inducing anomalous heat flow in the Lower Yarmouk Gorge

    Science.gov (United States)

    Goretzki, Nora; Inbar, Nimrod; Kühn, Michael; Möller, Peter; Rosenthal, Eliyahu; Schneider, Michael; Siebert, Christian; Magri, Fabien

    2016-04-01

    The Lower Yarmouk Gorge, at the border between Israel and Jordan, is characterized by an anomalous temperature gradient of 46 °C/km. Numerical simulations of thermally-driven flow show that ascending thermal waters are the result of mixed convection, i.e. the interaction between the regional flow from the surrounding heights and buoyant flow within permeable faults [1]. Those models were calibrated against available temperature logs by running several forward problems (FP), with a classic "trial and error" method. In the present study, inverse problems (IP) are applied to find alternative parameter distributions that also lead to the observed thermal anomalies. The investigated physical parameters are hydraulic conductivity and thermal conductivity. To solve the IP, the PEST® code [2] is applied via the graphical interface FEPEST® in FEFLOW® [3]. The results show that both hydraulic and thermal conductivity are consistent with the values determined with the trial and error calibrations, which precede this study. However, the IP indicates that the hydraulic conductivity of the Senonian Paleocene aquitard can be 8.54*10-3 m/d, which is three times lower than the originally estimated value in [1]. Moreover, the IP suggests that the hydraulic conductivity in the faults can increase locally up to 0.17 m/d. These highly permeable areas can be interpreted as local damage zones at the faults/units intersections. They can act as lateral pathways in the deep aquifers that allow deep outflow of thermal water. This presentation provides an example about the application of FP and IP to infer a wide range of parameter values that reproduce observed environmental issues. [1] Magri F, Inbar N, Siebert C, Rosenthal E, Guttman J, Möller P (2015) Transient simulations of large-scale hydrogeological processes causing temperature and salinity anomalies in the Tiberias Basin. Journal of Hydrology, 520, 342-355 [2] Doherty J (2010) PEST: Model-Independent Parameter Estimation. user

  14. Simulation of thermal and sodium expansion stress in aluminum reduction cells

    Institute of Scientific and Technical Information of China (English)

    LI Jie; WU Yu-yun; LAI Yan-qing; LIU Wei; WANG Zhi-gang; LIU Jie; LIU Ye-xiang

    2008-01-01

    Two finite element(FE) models were built up for analysis of stress field in the lining of aluminum electrolysis cells. Distribution of sodium concentration in cathode carbon blocks was calculated by one FE model of a cathode block. Thermal stress field was calculated by the other slice model of the cell at the end of the heating-up. Then stresses coupling thermal and sodium expansion were considered after 30 d start-up. The results indicate that sodium penetrates to the bottom of the cathode block after 30 d start-up. The semi-graphitic carbon block has the largest stress at the thermal stage. After 30 d start-up the anthracitic carbon has the greatest sodium expansion stress and the graphitized carbon has the lowest sodium expansion stress. Sodium penetration can cause larger deformation and stress in the cathode carbon block than thermal expansion.

  15. Absolute thermal expansion of copper and aluminum between 5 K and 330 K

    Energy Technology Data Exchange (ETDEWEB)

    Kroeger, F.R. Jr.

    1976-02-01

    Theoretical and experimental results of experiments on thermal expansion of Al and Cu are presented. Experimental apparatus and procedures are described. Results are presented in graphs and plots and discussed. (JRD)

  16. Using a Michelson Interferometer to Measure Coefficient of Thermal Expansion of Copper

    Science.gov (United States)

    Scholl, Ryan; Liby, Bruce W.

    2009-01-01

    When most materials are heated they expand. This concept is usually demonstrated using some type of mechanical measurement of the linear expansion of a metal rod. We have developed an alternative laboratory method for measuring thermal expansion by using a Michelson interferometer. Using the method presented, interference, interferometry, and the…

  17. Phase Composition and Thermal Expansion of CaO Stabilised ZrO2 Refactories

    Institute of Scientific and Technical Information of China (English)

    ZHAOShike; WUJingyuan; 等

    2000-01-01

    In this,phase compsition and thermal expansion behaviour of CaO Stabilised refractories were studied,Special attention was paid to the expasion behaviour of three materials with different phase composition,The research results indicated that the expansion behaviour could be improved by modifying the stabilization of ZrO2,which thus leads to the increase in the thermal shock resistance and possibly eroion resistace of as-obtained CaO stabilised ZrO material.

  18. Effect of graphene nanoplatelets on coefficient of thermal expansion of polyetherimide composite

    Energy Technology Data Exchange (ETDEWEB)

    Wu, Huang, E-mail: huang.wu.84@gmail.com [Composite Materials and Structures Center, Michigan State University, East Lansing, MI 48864 (United States); Department of Chemical Engineering and Material Science, Michigan State University, East Lansing, MI 48864 (United States); Drzal, Lawrence T. [Composite Materials and Structures Center, Michigan State University, East Lansing, MI 48864 (United States); Department of Chemical Engineering and Material Science, Michigan State University, East Lansing, MI 48864 (United States)

    2014-07-01

    Thermal expansion is one of the major concerns for polymer composites. In this research, graphene nanoplatelets (GNPs) were added to polyetherimide (PEId) thermoplastic polymer in order to reduce the coefficient of thermal expansion (CTE) of the injection molded composite. First, the coefficient of linear thermal expansion (LTE) was measured in three directions in the anisotropic coupon: 0°, 90° and the out of plane Z direction. It is found that the GNP particles are very effective in terms of reducing the LTE in 0° direction due to high degree of alignment. After annealing above glass transition temperature, significant increase of 0° LTE and decrease of Z° LTE were observed. The bulk CTE was calculated by adding up the LTEs in all three directions and is found to be independent of annealing. Second, several models were applied to predict both CTE and LTE. It is found that Schapery's lower limit model fits the experimental CTE very well. Chow's model was applied for LTEs in three directions. The behavior of GNP-5/PEId composites is explained by the combination of Chow's model and morphology obtained by scanning electron microscope (SEM). - Highlights: • Coefficient of thermal expansion (CTE) of polymer composite is characterized. • Reduction of linear thermal expansion depends on filler orientation. • Filler orientation is characterized based on the location of the specimen. • Filler orientation is changed by annealing, causing subsequent change in CTE. • CTE and linear thermal expansion coefficient are modeled.

  19. Anisotropic thermal expansion and cooperative Invar and anti-Invar effects in mn alloys.

    Science.gov (United States)

    Yokoyama, Toshihiko; Eguchi, Keitaro

    2013-02-15

    We have investigated thermal expansion of a tetragonal Mn(88)Ni(12) alloy by x-ray diffraction, Mn and Ni K-edge extended x-ray-absorption fine-structure spectroscopy, and the computational simulations based on the path-integral effective-classical-potential theory. It is found from the x-ray diffraction that the tetragonal lattice constant c exhibits almost no thermal expansion like an Invar alloy, while the lattice constant a shows even larger thermal expansion than usually expected from anharmonicity, implying significant anisotropy in thermal expansion. The extended x-ray-absorption fine-structure reveals that the Mn local environment is actually tetragonally distorted, while the Ni one retains its inherent cubiclike symmetry. Combined with the computational simulations, it is concluded that large thermal expansion along the a axis originates from the anti-Invar effect, while negligibly small thermal expansion along the c axis originates from the cooperative Invar effect. Namely, the tetragonally distorted more stable antiferromagnetic Mn state gives a significantly smaller (slightly longer) atomic radius along the a (c) axis than the radius of the spherical paramagnetic state.

  20. Dynamic thermal expansivity of liquids near the glass transition

    DEFF Research Database (Denmark)

    Niss, Kristine; Gundermann, Ditte; Christensen, Tage Emil;

    2012-01-01

    Based on previous works on polymers by Bauer et al. [ Phys. Rev. E 61 1755 (2000)], this paper describes a capacitative method for measuring the dynamical expansion coefficient of a viscous liquid. Data are presented for the glass-forming liquid tetramethyl tetraphenyl trisiloxane (DC704) in the ......Based on previous works on polymers by Bauer et al. [ Phys. Rev. E 61 1755 (2000)], this paper describes a capacitative method for measuring the dynamical expansion coefficient of a viscous liquid. Data are presented for the glass-forming liquid tetramethyl tetraphenyl trisiloxane (DC704...

  1. Pressure-induced reversal between thermal contraction and expansion in ferroelectric PbTiO3.

    Science.gov (United States)

    Zhu, Jinlong; Zhang, Jianzhong; Xu, Hongwu; Vogel, Sven C; Jin, Changqing; Frantti, Johannes; Zhao, Yusheng

    2014-01-15

    Materials with zero/near zero thermal expansion coefficients are technologically important for applications in thermal management and engineering. To date, this class of materials can only be produced by chemical routes, either by changing chemical compositions or by composting materials with positive and negative thermal expansion. Here, we report for the first time a physical route to achieve near zero thermal expansion through application of pressure. In the stability field of tetragonal PbTiO3 we observed pressure-induced reversals between thermal contraction and expansion between ambient pressure and 0.9 GPa. This hybrid behavior leads to a mathematically infinite number of crossover points in the pressure-volume-temperature space and near-zero thermal expansion coefficients comparable to or even smaller than those attained by chemical routes. The observed pressures for this unusual phenomenon are within a small range of 0.1-0.9 GPa, potentially feasible for designing stress-engineered materials, such as thin films and nano-crystals, for thermal management applications.

  2. A new look on anomalous thermal gradient values obtained in South Portugal

    Science.gov (United States)

    Duque, M. R.; Malico, I.

    2012-04-01

    A NEW LOOK ON THE ANOMALOUS THERMAL GRADIENT VALUES OBTAINED IN SOUTH PORTUGAL Duque, M. R. and Malico, I. M. Physics Department, University of Évora, Rua Romão Ramalho, 59,7000-671, Évora, Portugal It is well known that soil temperatures can be altered by water circulation. In this paper, we study numerically this effect by simulating some aquifers occurring in South Portugal. At this location, the thermal gradient values obtained in boreholes with depths less than 200 m, range between 22 and 30 °C km-1. However, there, it is easy to find places where temperatures are around 30 °C, at depths of 100 m. The obtained thermal gradient values show an increase one day after raining and a decrease during the dry season. Additionally, the curve of temperature as function of depth showed no hot water inlet in the hole. The region studied shows a smooth topography due to intensive erosion, but it was affected by alpine and hercinian orogenies. As a result, a high topography in depth, with folds and wrinkles is present. The space between adjacent folds is now filled by small sedimentary basins. Aquifers existing in this region can reach considerable depths and return to depths near the surface, but hot springs in the area are scarce. Water temperature rises in depth, and when the speed is high enough high temperatures near the surface, due to water circulation, can be found. The ability of the fluid to flow through the system depends on topography relief, rock permeability and basal heat flow. In this study, the steady-state fluid flow and heat transfer by conduction and advection are modeled. Fractures in the medium are simulated by an equivalent porous medium saturated with liquid. Thermal conductivity values for the water and the rocks can vary in space .Porosities used have high values in the region of the aquifer, low values in the lower region of the model and intermediate values in the upper regions. The results obtained show that temperature anomaly values

  3. Stability and anomalous compressibility of Bose gases near resonance: The scale-dependent interactions and thermal effects

    Science.gov (United States)

    Jiang, Shao-Jian; Zhou, Fei

    2015-07-01

    The stability of Bose gases near resonance has been a puzzling problem in recent years. In this article, we demonstrate that in addition to generating thermal pressure, thermal atoms enhance the repulsiveness of the scale-dependent interactions between condensed atoms due to a renormalization effect and further stabilize the Bose gases. Consequently, we find that, as a precursor of instability, the compressibility develops an anomalous structure as a function of scattering length and is drastically reduced compared with the mean-field value. Furthermore, the density profile of a Bose gas in a harmonic trap is found to develop a flat top near the center. This is due to the anomalous behavior of compressibility and can be a potential smoking gun for probing such an effect.

  4. Anomalous opening of the Equatorial Atlantic due to an equatorial mantle thermal minimum

    Science.gov (United States)

    Bonatti, Enrico

    1996-09-01

    The geology of the Equatorial Atlantic is dominated by a broad east-west megashear belt where a cluster of large fracture zones offsets anomalously deep segments of the Mid-Atlantic Ridge (MAR). The origin and evolution of this megashear region may lie ultimately in an equatorial mantle thermal minimum. The notion of a mantle thermal minimum in the Equatorial Atlantic is supported by an equatorial minimum of zero-age topography, a maximum in mantle shear waves seismic velocity and a minimum in the degree of melting, indicated by the chemistry of MAR basalts and peridotites. This thermal minimum has probably been a stable feature since before the Cretaceous separation of Africa from South America; it caused a pre-opening equatorial continental lithosphere thicker and colder than normal. The Cretaceous Benue Trough in western Africa and the Amazon depression in South America are interpreted as morphostructural depressions created or rejuvenated by strike-slip, transpressional and transtensional tectonics ducing extension of the cold/thick equatorial lithosphere. The oceanic rift propagating northward from the South Atlantic impinged against the equatorial thicker, colder and, therefore, stronger than normal continental, lithosphere that consequently acted as a 'locked zone'. This, and a low magmatic budget due to the cold upper mantle, caused a lower than normal rate of propagation of the oceanic rift into the equatorial belt, with diffuse deformation during mostly amagmatic extension. The thick/cold lithosphere prevented major Cretaceous igneous activity from the St. Helena plume. Eventually initial 'weak' isolated nuclei oceanic lithosphere were emplaced, separated by E-W continent/continent transforms. Opening occurred largely by strike-slip motion along these initial transforms. The consequences were that the Equatorial Atlantic opened prevalently along an E-W direction, in contrast to the N-S opening of the North and South Atlantic, and that sheared continental

  5. Thermal Expansion: Using Calculator-Based Laboratory Technology to Observe the Anomalous Behavior of Water

    Science.gov (United States)

    Branco, Mario; Soletta, Isabella

    2005-01-01

    An experiment that consists of following the changes in temperature at different depths in a precooled liquid while the liquid slowly warms up to the temperature of the surrounding environment is presented. The experiment might be used in a course on temperature, on heat transmission, and in particular in the study of convection currents.

  6. Porous composite with negative thermal expansion obtained by photopolymer additive manufacturing

    Directory of Open Access Journals (Sweden)

    Akihiro Takezawa

    2015-07-01

    Full Text Available Additive manufacturing (AM could be a novel method of fabricating composite and porous materials having various effective performances based on mechanisms of their internal geometries. Materials fabricated by AM could rapidly be used in industrial application since they could easily be embedded in the target part employing the same AM process used for the bulk material. Furthermore, multi-material AM has greater potential than usual single-material AM in producing materials with effective properties. Negative thermal expansion is a representative effective material property realized by designing a composite made of two materials with different coefficients of thermal expansion. In this study, we developed a porous composite having planar negative thermal expansion by employing multi-material photopolymer AM. After measurement of the physical properties of bulk photopolymers, the internal geometry was designed by topology optimization, which is the most effective structural optimization in terms of both minimizing thermal stress and maximizing stiffness. The designed structure was converted to a three-dimensional stereolithography (STL model, which is a native digital format of AM, and assembled as a test piece. The thermal expansions of the specimens were measured using a laser scanning dilatometer. Negative thermal expansion corresponding to less than −1 × 10−4 K−1 was observed for each test piece of the N = 3 experiment.

  7. Pseudonegative thermal expansion and the state of water in graphene oxide layered assemblies.

    Science.gov (United States)

    Zhu, Jian; Andres, Christine M; Xu, Jiadi; Ramamoorthy, Ayyalusamy; Tsotsis, Thomas; Kotov, Nicholas A

    2012-09-25

    Unraveling the complex interplay between thermal properties and hydration is a part of understanding the fundamental properties of many soft materials and very essential for many applications. Here we show that graphene oxide (GO) demonstrates a highly negative thermal expansion (NTE) coefficient owing to unique thermohydration processes related with fast transport of water between the GO sheets, the amphiphilic nature of nanochannels, and close-to-zero intrinsic thermal expansion of GO. The humidity-dependent NTE of GO layered assemblies, or "pseudonegative thermal expansion" (PNTE), differs from that of other hygroscopic materials due to its relatively fast and highly reversible expansion/contraction cycles and occurrence at low humidity levels while bearing similarities to classic NTE. Thermal expansion of polyvinyl alcohol/GO composites is easily tunable with additional intricacy of thermohydration effects. PNTE combined with isotropy, nontoxicity, and mechanical robustness is an asset for applications of actuators, sensors, MEMS devices, and memory materials and crucial for developing methods of thermal/photopatterning of GO devices.

  8. Tunable anisotropic thermal expansion of a porous zinc(II) metal-organic framework.

    Science.gov (United States)

    Grobler, Ilne; Smith, Vincent J; Bhatt, Prashant M; Herbert, Simon A; Barbour, Leonard J

    2013-05-01

    A novel three-dimensional metal-organic framework (MOF) that displays anisotropic thermal expansion has been prepared and characterized by single-crystal X-ray diffraction (SCD) and thermal analysis. The as-prepared MOF has one-dimensional channels containing guest molecules that can be removed and/or exchanged for other guest molecules in a single-crystal to single-crystal fashion. When the original guest molecules are replaced there is a noticeable effect on the host mechanics, altering the thermal expansion properties of the material. This study of the thermal expansion coefficients of different inclusion complexes of the host MOF involved systematic alteration of guest size, i.e., methanol, ethanol, n-propanol, and isopropanol, showing that fine control over the thermal expansion coefficients can be achieved and that the coefficients can be correlated with the size of the guest. As a proof of concept, this study demonstrates the realizable principle that a single-crystal material with an exchangeable guest component (as opposed to a composite) may be used to achieve a tunable thermal expansion coefficient. In addition, this study demonstrates that greater variance in the absolute dimensions of a crystal can be achieved when one has two variables that affect it, i.e., the host-guest interactions and temperature.

  9. Grain size and film thickness effect on the thermal expansion coefficient of FCC metallic thin films.

    Science.gov (United States)

    Hwang, Seulgi; Kim, Youngman

    2011-08-01

    Thin films are used in wide range of applications in industry, such as solar cells and LEDs. When thin films are deposited on substrates, various stresses are generated due to the mechanical difference between the film and substrate. These stresses can cause defects, such as cracking and buckling. Therefore, knowledge of the mechanical properties is important for improving their reliability and stability. In this study, the thermal expansion coefficient of FCC metallic thin films, such as Ag and Cu, which have different grain sizes and thicknesses, were calculated using the thermal cycling method. As a result, thermal expansion coefficient increased with increasing grain size. However, the film thickness had no remarkable effect.

  10. Thermal expansion of lattice parameter of (powder) silicon up to 1473 K

    Institute of Scientific and Technical Information of China (English)

    XING Xianran; CHEN Jun; DENG Jinxia; LIU Guirong

    2004-01-01

    The XRPD (X-ray powder diffractometry) patterns of silicon powder with a unit cell structure of diamond were determined from 298 to 1473 K. Lattice parameters of Si linearly increase with temperature. The thermal shifts of the positions of all reflection peaks are linearly correlated with the temperature. The coefficients of the intrinsic linear thermal expansion and volumetric thermal expansion were determined as 3.87×10-6/K and 1.16 × 10-5/K respectively. It indicates that Si is still a suitable standard in the XRPD method at high temperatures.

  11. Analysis of thermal expansivity of iron (Fe) metal at ultra high temperature and pressure

    Indian Academy of Sciences (India)

    Deepika Kandpal; B R K Gupta

    2007-01-01

    In the present investigation we have explained the thermal and compression properties of HCP iron (Fe) at high pressure with variable temperature (isobars) and at high temperature with variable pressure (isotherm). The usual Tait equation of state is modified by incorporating the effect of thermal pressure. The calculated values of pressure for different isotherms and isochors and thermal expansivity () as a function of both temperature and pressure have been compared with those values obtained by Isaak et al and Wasserman et al.

  12. Colossal negative thermal expansion in BiNiO3 induced by intermetallic charge transfer.

    Science.gov (United States)

    Azuma, Masaki; Chen, Wei-tin; Seki, Hayato; Czapski, Michal; Olga, Smirnova; Oka, Kengo; Mizumaki, Masaichiro; Watanuki, Tetsu; Ishimatsu, Naoki; Kawamura, Naomi; Ishiwata, Shintaro; Tucker, Matthew G; Shimakawa, Yuichi; Attfield, J Paul

    2011-06-14

    The unusual property of negative thermal expansion is of fundamental interest and may be used to fabricate composites with zero or other controlled thermal expansion values. Here we report that colossal negative thermal expansion (defined as linear expansion transfer transitions. BiNiO(3) shows a 2.6% volume reduction under pressure due to a Bi/Ni charge transfer that is shifted to ambient pressure through lanthanum substitution for Bi. Changing proportions of coexisting low- and high-temperature phases leads to smooth volume shrinkage on heating. The crystallographic linear expansion coefficient for Bi(0.95)La(0.05)NiO(3) is -137×10(-6) K(-1) and a value of -82×10(-6) K(-1) is observed between 320 and 380 K from a dilatometric measurement on a ceramic pellet. Colossal negative thermal expansion materials operating at ambient conditions may also be accessible through metal-insulator transitions driven by other phenomena such as ferroelectric orders.

  13. Colossal negative thermal expansion in BiNiO3 induced by intermetallic charge transfer

    Science.gov (United States)

    Azuma, Masaki; Chen, Wei-tin; Seki, Hayato; Czapski, Michal; Olga, Smirnova; Oka, Kengo; Mizumaki, Masaichiro; Watanuki, Tetsu; Ishimatsu, Naoki; Kawamura, Naomi; Ishiwata, Shintaro; Tucker, Matthew G.; Shimakawa, Yuichi; Attfield, J. Paul

    2011-01-01

    The unusual property of negative thermal expansion is of fundamental interest and may be used to fabricate composites with zero or other controlled thermal expansion values. Here we report that colossal negative thermal expansion (defined as linear expansion <−10−4 K−1 over a temperature range ~100 K) is accessible in perovskite oxides showing charge-transfer transitions. BiNiO3 shows a 2.6% volume reduction under pressure due to a Bi/Ni charge transfer that is shifted to ambient pressure through lanthanum substitution for Bi. Changing proportions of coexisting low- and high-temperature phases leads to smooth volume shrinkage on heating. The crystallographic linear expansion coefficient for Bi0.95La0.05NiO3 is −137×10−6 K−1 and a value of −82×10−6 K−1 is observed between 320 and 380 K from a dilatometric measurement on a ceramic pellet. Colossal negative thermal expansion materials operating at ambient conditions may also be accessible through metal-insulator transitions driven by other phenomena such as ferroelectric orders. PMID:21673668

  14. Direct measurement of thermal expansion in unsaturated soils

    OpenAIRE

    Pintado Llurba, Xavier; Lloret Morancho, Antonio

    2010-01-01

    A method designed to measure the thermal dilatation coefficient of unsaturated soils is presented. It is based on the ASTM 4535-85 standard with some important considerations taken into account. A number of tests following this methodology were performed on unsaturated swelling clay. Thermal dilatation coefficients were measured over a temperature range from 25 to 65°C for material dry densities and saturation degrees varying between 16–17 kN/m3 and 60–95%, respectively. The results are so...

  15. Thermal expansion of simulated thoria-urania fuel by high temperature XRD

    Science.gov (United States)

    Bhagat, R. K.; Krishnan, K.; Kutty, T. R. G.; Kumar, Arun; Kamath, H. S.; Banerjee, S.

    2012-03-01

    The thermal expansion behavior of polycrystalline samples of ThO2-3.45% UO2 and SIMFUEL corresponding to burn-up of 43,000 MWd/Te has been investigated from room temperature to 1473 K, and for SIMFUEL corresponding to burn-up of 28,000 MWd/Te has been investigated from room temperature to 1173 K, using a high temperature X-ray diffraction (HTXRD). Linear and volumetric thermal expansion data like, percentage thermal expansion, average or mean coefficient of thermal expansion (CTE) was generated using the lattice parameters. It is observed that SIMFUEL has a lower lattice parameter compared to ThO2-3.45% UO2 and this is attributed to the dissolution of the rare earths and part of the Zr and Ce in fuel matrix. Also SIMFUEL has slightly higher thermal expansion than ThO2-3.45% UO2 and this is related to the lower melting point of SIMFUEL.

  16. Thermal expansion of simulated thoria-urania fuel by high temperature XRD

    Energy Technology Data Exchange (ETDEWEB)

    Bhagat, R.K. [Radiometallurgy Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Krishnan, K. [Fuel Chemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Kutty, T.R.G., E-mail: tkutty@barc.gov.in [Radiometallurgy Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Kumar, Arun [Radiometallurgy Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Kamath, H.S. [Nuclear Fuels Group, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Banerjee, S. [Department of Atomic Energy, Anushakti Bhavan, Mumbai 400 001 (India)

    2012-03-15

    The thermal expansion behavior of polycrystalline samples of ThO{sub 2}-3.45% UO{sub 2} and SIMFUEL corresponding to burn-up of 43,000 MWd/Te has been investigated from room temperature to 1473 K, and for SIMFUEL corresponding to burn-up of 28,000 MWd/Te has been investigated from room temperature to 1173 K, using a high temperature X-ray diffraction (HTXRD). Linear and volumetric thermal expansion data like, percentage thermal expansion, average or mean coefficient of thermal expansion (CTE) was generated using the lattice parameters. It is observed that SIMFUEL has a lower lattice parameter compared to ThO{sub 2}-3.45% UO{sub 2} and this is attributed to the dissolution of the rare earths and part of the Zr and Ce in fuel matrix. Also SIMFUEL has slightly higher thermal expansion than ThO{sub 2}-3.45% UO{sub 2} and this is related to the lower melting point of SIMFUEL.

  17. Pressure-dependence of the phase transitions and thermal expansion in zirconium and hafnium pyrovanadate

    Energy Technology Data Exchange (ETDEWEB)

    Gallington, Leighanne C.; Hester, Brett R.; Kaplan, Benjamin S.; Wilkinson, Angus P.

    2017-05-01

    Low or negative thermal expansion (NTE) has been previously observed in members of the ZrP2O7 family at temperatures higher than their order-disorder phase transitions. The thermoelastic properties and phase behavior of the low temperature superstructure and high temperature negative thermal expansion phases of ZrV2O7 and HfV2O7 were explored via in situ variable temperature/pressure powder x-ray diffraction measurements. The phase transition temperatures of ZrV2O7 and HfV2O7 exhibited a very strong dependence on pressure (~700 K GPa), with moderate compression suppressing the formation of their NTE phases below 513 K. Compression also reduced the magnitude of the coefficients of thermal expansion in both the positive and negative thermal expansion phases. Additionally, the high temperature NTE phase of ZrV2O7 was found to be twice as stiff as the low temperature positive thermal expansion superstructure (24 and 12 GPa respectively).

  18. Thermal expansion anomaly and spontaneous magnetostriction of Gd2Fe17 compound

    Institute of Scientific and Technical Information of China (English)

    HAO Yanming; LIANG Feifei; ZHANG Xuemin; WANG Fang; WU Yanzhao

    2011-01-01

    Materials with negative thermal expansion have many practical applications.However,these materials are known in only several oxide systems,and when the negative thermal expansion occurs,the contraction is usually small and limited to a narrow temperature range beyond room temperature.For obtaining a compound with negative thermal expansion in broad temperature range,the structural and magnetic properties of Gd2Fe17 compound were investigated by means of X-ray diffraction and magnetization measurements.The Gd2Fe17 compound annealed at 1050 ℃ had a Th2Zn17-type Structure.There existed an anisotropic strong spontaneous magnetostriction and a negative thermal expansion in Gd2Fe17 compound.The average thermal expansion coefficients was α =-7.40×10-6/K in the temperature range of 294-453 K and (α) =-1.80x 10-5/K in 453-534 K,respectively.The spontaneous rnagnetostrictive deformation ωs decreased from 4.34x10-3 to near zero with temperature increasing from 294 to 572 K.The spontaneous linear deformation λc was much larger than λa at the same temperature below about 500 K.

  19. Modeling the thermal deformation of TATB-based explosives. Part 1: Thermal expansion of “neat-pressed” polycrystalline TATB

    Energy Technology Data Exchange (ETDEWEB)

    Luscher, Darby J. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

    2014-05-08

    We detail a modeling approach to simulate the anisotropic thermal expansion of polycrystalline (1,3,5-triamino-2,4,6-trinitrobenzene) TATB-based explosives that utilizes microstructural information including porosity, crystal aspect ratio, and processing-induced texture. This report, the first in a series, focuses on nonlinear thermal expansion of “neat-pressed” polycrystalline TATB specimens which do not contain any binder; additional complexities related to polymeric binder and irreversible ratcheting behavior are briefly discussed, however detailed investigation of these aspects are deferred to subsequent reports. In this work we have, for the first time, developed a mesoscale continuum model relating the thermal expansion of polycrystal TATB specimens to their microstructural characteristics. A self-consistent homogenization procedure is used to relate macroscopic thermoelastic response to the constitutive behavior of single-crystal TATB. The model includes a representation of grain aspect ratio, porosity, and crystallographic texture attributed to the consolidation process. A quantitative model is proposed to describe the evolution of preferred orientation of graphitic planes in TATB during consolidation and an algorithm constructed to develop a discrete representation of the associated orientation distribution function. Analytical and numerical solutions using this model are shown to produce textures consistent with previous measurements and characterization for isostatic and uniaxial “die-pressed” specimens. Predicted thermal strain versus temperature for textured specimens are shown to be in agreement with corresponding experimental measurements. Using the developed modeling approach, several simulations have been run to investigate the influence of microstructure on macroscopic thermal expansion behavior. Results from these simulations are used to identify qualitative trends. Implications of the identified trends are discussed in the context of

  20. Ba-filled Ni-Sb-Sn based skutterudites with anomalously high lattice thermal conductivity.

    Science.gov (United States)

    Paschinger, W; Rogl, G; Grytsiv, A; Michor, H; Heinrich, P R; Müller, H; Puchegger, S; Klobes, B; Hermann, R P; Reinecker, M; Eisenmenger-Sitter, Ch; Broz, P; Bauer, E; Giester, G; Zehetbauer, M; Rogl, P F

    2016-07-05

    Novel filled skutterudites BayNi4Sb12-xSnx (ymax = 0.93) have been prepared by arc melting followed by annealing at 250, 350 and 450 °C up to 30 days in vacuum-sealed quartz vials. Extension of the homogeneity region, solidus temperatures and structural investigations were performed for the skutterudite phase in the ternary Ni-Sn-Sb and in the quaternary Ba-Ni-Sb-Sn systems. Phase equilibria in the Ni-Sn-Sb system at 450 °C were established by means of Electron Probe Microanalysis (EPMA) and X-ray Powder Diffraction (XPD). With rather small cages Ni4(Sb,Sn)12, the Ba-Ni-Sn-Sb skutterudite system is perfectly suited to study the influence of filler atoms on the phonon thermal conductivity. Single-phase samples with the composition Ni4Sb8.2Sn3.8, Ba0.42Ni4Sb8.2Sn3.8 and Ba0.92Ni4Sb6.7Sn5.3 were used to measure their physical properties, i.e. temperature dependent electrical resistivity, Seebeck coefficient and thermal conductivity. The resistivity data demonstrate a crossover from metallic to semiconducting behaviour. The corresponding gap width was extracted from the maxima in the Seebeck coefficient data as a function of temperature. Single crystal X-ray structure analyses at 100, 200 and 300 K revealed the thermal expansion coefficients as well as Einstein and Debye temperatures for Ba0.73Ni4Sb8.1Sn3.9 and Ba0.95Ni4Sb6.1Sn5.9. These data were in accordance with the Debye temperatures obtained from the specific heat (4.4 K < T < 140 K) and Mössbauer spectroscopy (10 K < T < 290 K). Rather small atom displacement parameters for the Ba filler atoms indicate a severe reduction in the "rattling behaviour" consistent with the high levels of lattice thermal conductivity. The elastic moduli, collected from Resonant Ultrasonic Spectroscopy ranged from 100 GPa for Ni4Sb8.2Sn3.8 to 116 GPa for Ba0.92Ni4Sb6.7Sn5.3. The thermal expansion coefficients were 11.8 × 10(-6) K(-1) for Ni4Sb8.2Sn3.8 and 13.8 × 10(-6) K(-1) for Ba0.92Ni4Sb6.7Sn5.3. The room temperature Vickers

  1. Thermal Expansion and Thermal Conductivity Behaviors of Al-Si/SiC/graphite Hybrid Metal Matrix Composites (MMCs

    Directory of Open Access Journals (Sweden)

    S. Cem OKUMUS

    2012-12-01

    Full Text Available Aluminum-silicon based hybrid composites reinforced with silicon carbide and graphite particles were prepared by liquid phase particle mixing (melt stirring and squeeze casting. The thermal expansion and thermal conductivity behaviors of hybrid composites with various graphite contents (5.0; 7.5; 10 wt.% and different silicon carbide particle sizes (45 µm and 53 µm were investigated. Results indicated that increasing the graphite content improved the dimensional stability, and there was no obvious variation between the thermal expansion behaviors of the 45 µm and the 53 µm silicon carbide reinforced composites. The thermal conductivity of hybrid composites was reduced due to the enrichment of the graphite component.DOI: http://dx.doi.org/10.5755/j01.ms.18.4.3093

  2. Thermal Expansion of LaCoO3

    Institute of Scientific and Technical Information of China (English)

    闫柏军; 张家芸; 刘建华

    2004-01-01

    High-temperature X-ray diffraction(HTXRD)measurements of LaCoO3 powder was carried out in a temperature range from 298 to 1273 K.The experimental data obtained were adopted to evaluate the lattice parameters and cell volume.In this temperature range,the linear and volume expansion coefficients calculated using these cell parameters are 24.160~23.610×10-6·K-1 and 59.601~63.218×10-6·K-1 respectively.There is no discontinuity found in the cell parameters through the proposed first-order transition at 1210 K.

  3. Dynamic thermal expansivity of liquids near the glass transition.

    Science.gov (United States)

    Niss, Kristine; Gundermann, Ditte; Christensen, Tage; Dyre, Jeppe C

    2012-04-01

    Based on previous works on polymers by Bauer et al. [Phys. Rev. E 61, 1755 (2000)], this paper describes a capacitative method for measuring the dynamical expansion coefficient of a viscous liquid. Data are presented for the glass-forming liquid tetramethyl tetraphenyl trisiloxane (DC704) in the ultraviscous regime. Compared to the method of Bauer et al., the dynamical range has been extended by making time-domain experiments and by making very small and fast temperature steps. The modeling of the experiment presented in this paper includes the situation in which the capacitor is not full because the liquid contracts when cooling from room temperature down to around the glass-transition temperature, which is relevant when measuring on a molecular liquid rather than a polymer.

  4. Effect of heat treatment on the thermal expansion coefficient of austempered ductile iron

    Energy Technology Data Exchange (ETDEWEB)

    Tadayon saidi, M. [Dept. Metallurgy-Karaj Azad Univ.-Karaj (Iran); Baghersaie, N. [Tehran Center, Control Dept., Eng. Research Inst., Ministry of Jihad Agriculture (Iran); Varahram, N. [RAZI Metallurgical Research Inst.-Tehran (Iran)

    2005-07-01

    Austempered ductile iron provide a unique combination of strength and toughness coupled with excellent design flexibility for automotive application as compared to forged or cast steels. Some material properties such as thermal expansion coefficient and its influence in final machining tolerance is a matter of discussion in the automotive industry. In this study the effect of heart treatment cycle on the microstructure and thermal expansion of ADI was investigated. Samples were austempered at 275 C and 375 C for one hour and then dilatometric test carried out in the temperature range of 50 C to 350 C, then the result was compared with the thermal expansion coefficient of forged steel. Microstructure and mechanical investigations were used to the assurance of these results. The results indicate that replacing of forged steel with ADI due to lower cost production and reduction in weight is possible if the correct tolerance were selected. (orig.)

  5. Anisotropic thermal expansion of Ni, Pd and Pt germanides and silicides

    Science.gov (United States)

    Geenen, F. A.; Knaepen, W.; Moens, F.; Brondeel, L.; Leenaers, A.; Van den Berghe, S.; Detavernier, C.

    2016-07-01

    Silicon or germanium-based transistors are nowadays used in direct contact with silicide or germanide crystalline alloys for semiconductor device applications. Since these compounds are formed at elevated temperatures, accurate knowledge of the thermal expansion of both substrate and the contact is important to address temperature depending effects such as thermal stress. Here we report the linear coefficients of thermal expansion of Ni-, Pd- and Pt-based mono-germanides, mono-silicides and di-metal-silicides as determined by powder-based x-ray diffraction between 300 and 1225 K. The investigated mono-metallic compounds, all sharing the MnP crystal structure, as well as Pd2Si and Pt2Si exhibit anisotropic expansion. By consequence, this anisotropic behaviour should be taken into account for evaluating the crystal unit’s cell at elevated temperatures.

  6. Phase diagram and thermal expansion measurements on the system URu2-xFexSi2.

    Science.gov (United States)

    Ran, Sheng; Wolowiec, Christian T; Jeon, Inho; Pouse, Naveen; Kanchanavatee, Noravee; White, Benjamin D; Huang, Kevin; Martien, Dinesh; DaPron, Tyler; Snow, David; Williamsen, Mark; Spagna, Stefano; Riseborough, Peter S; Maple, M Brian

    2016-11-22

    Thermal expansion, electrical resistivity, magnetization, and specific heat measurements were performed on URu2-xFexSi2 single crystals for various values of Fe concentration x in both the hidden-order (HO) and large-moment antiferromagnetic (LMAFM) regions of the phase diagram. Our results show that the paramagnetic (PM) to HO and LMAFM phase transitions are manifested differently in the thermal expansion coefficient. The uniaxial pressure derivatives of the HO/LMAFM transition temperature T0 change dramatically when crossing from the HO to the LMAFM phase. The energy gap also changes consistently when crossing the phase boundary. In addition, for Fe concentrations at xc ≈ 0.1, we observe two features in the thermal expansion upon cooling, one that appears to be associated with the transition from the PM to the HO phase and another one at lower temperature that may be due to the transition from the HO to the LMAFM phase.

  7. Cryogenic abnormal thermal expansion properties of carbon-doped La(Fe,Si)13 compounds.

    Science.gov (United States)

    Li, Shaopeng; Huang, Rongjin; Zhao, Yuqiang; Wang, Wei; Li, Laifeng

    2015-12-14

    Recently, La(Fe,Si)13-based compounds have attracted much attention due to their isotropic and tunable abnormal thermal expansion (ATE) properties as well as bright prospects for practical applications. In this research, we have prepared cubic NaZn13-type carbon-doped La(Fe,Si)13 compounds by the arc-melting method, and their ATE and magnetic properties were investigated by means of variable-temperature X-ray diffraction, strain gauge and the physical property measurement system (PPMS). The experimental results indicate that both micro and macro negative thermal expansion (NTE) behaviors gradually weaken with the increase of interstitial carbon atoms. Moreover, the temperature region with the most remarkable NTE properties has been broadened and near zero thermal expansion (NZTE) behavior occurs in the bulk carbon-doped La(Fe,Si)13 compounds.

  8. Thermal expansion anomaly and magnetic properties of Nd2AlFe11Mn5 compound

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    Materials with negative thermal expansion have many important applications such as constituents of composite materials designed to .reduce their overall thermal expansion. The structural and magnetic properties of Nd2AlFe11Mn5 compound were investigated by means of X-ray diffraction and magnetization measurements. The result shows that the Nd2AlFe11Mn5 compound crystallizes in a rhomhedral Th2Zn17-type structure. The Curie temperature Tc is about 150 K. The negative thermal expansion coefficient of Nd2AlFe11Mn5 compound is found by X-ray diffraction in temperature range of 122-203 K. There exists an anisotropic and strong positive spontaneous magnetostriction in Nd2AlFe11Mn5 compound. The magnetostriction deformations were discussed.

  9. Effectively control negative thermal expansion of single-phase ferroelectrics of PbTiO3-(Bi,La)FeO3 over a giant range.

    Science.gov (United States)

    Chen, Jun; Wang, Fangfang; Huang, Qingzhen; Hu, Lei; Song, Xiping; Deng, Jinxia; Yu, Ranbo; Xing, Xianran

    2013-01-01

    Control of negative thermal expansion is a fundamentally interesting topic in the negative thermal expansion materials in order for the future applications. However, it is a challenge to control the negative thermal expansion in individual pure materials over a large scale. Here, we report an effective way to control the coefficient of thermal expansion from a giant negative to a near zero thermal expansion by means of adjusting the spontaneous volume ferroelectrostriction (SVFS) in the system of PbTiO3-(Bi,La)FeO3 ferroelectrics. The adjustable range of thermal expansion contains most negative thermal expansion materials. The abnormal property of negative or zero thermal expansion previously observed in ferroelectrics is well understood according to the present new concept of spontaneous volume ferroelectrostriction. The present studies could be useful to control of thermal expansion of ferroelectrics, and could be extended to multiferroic materials whose properties of both ferroelectricity and magnetism are coupled with thermal expansion.

  10. Noninvasive temperature estimation by detecting echo-strain change including thermal expansion

    Institute of Scientific and Technical Information of China (English)

    Ma Yong; Zhang Dong; Gong Xiu-Fen; Liu Xiao-Zhou; Ma Qing-Yu; Qiu Yuan-Yuan

    2007-01-01

    This article studies the feasibility of noninvasive temperature estimation by detecting echo-strain including thermal expansion in therapeutic ultrasound treatment. This technique evaluates distributions of echo-strain and temperature inside the tissue by detecting echo signals pre- and post-heating, in combination with the temperature dependence of sound speed and thermal expansion. In the computer simulation and experimental study, echo signals pre- and postheating are acquired and then the temperature elevation is evaluated by correlation analysis. Results demonstrate that this technique can effectively extend the measured temperature range up to 75℃ with an accuracy of ±2 ℃.

  11. Fiber-content dependency of the optical transparency and thermal expansion of bacterial nanofiber reinforced composites

    Science.gov (United States)

    Nogi, Masaya; Ifuku, Shinsuke; Abe, Kentaro; Handa, Keishin; Nakagaito, Antonio Norio; Yano, Hiroyuki

    2006-03-01

    We produced transparent nanocomposite reinforced with bacterial cellulose having a wide range of fiber contents, from 7.4to66.1wt%, by the combination of heat drying and organic solvent exchange methods. The addition of only 7.4wt% of bacterial cellulose nanofibers, which deteriorated light transmittance by only 2.4%, was able to reduce the coefficient of thermal expansion of acrylic resin from 86×10-6to38×10-6K-1. As such, the nanofiber network of bacterial cellulose has an extraordinary potential as a reinforcement to obtain optically transparent and low thermal expansion materials.

  12. Development of Zero Coefficient of Thermal Expansion composite tubes for stable space structures

    Science.gov (United States)

    Strock, John D.

    1992-09-01

    Advanced composite materials are well suited for stable space structures due to their low Coefficient of Thermal Expansion (CTE), high stiffness and light weight. For a given design application, composite hardware can be tailored for strength, stiffness, CTE, and Coefficient of Moisture Expansion (CME). Computer modeling and laminate testing of high modulus graphite/epoxy tubes were evaluated for compressive strength, stiffness, CTE, CME and microcracking. Thermal cycling and microcracking effects on CTE were evaluated. Thin graphite/epoxy plies exhibited reduced microcracking. A zero CTE thin wall tube design resulted from the development program. Recent work on low moisture absorption resin systems is also discussed.

  13. Thermo-optically driven adaptive mirror based on thermal expansion: preparation and resolution

    Science.gov (United States)

    Reinert, Felix; Lüthy, W.

    2005-12-01

    A thermo-optically driven adaptive mirror is presented. It is based on the thermal expansion of a thin film heated with a light pattern. We describe a procedure for the preparation of a silicon elastomer with a high-quality optical surface. This material, Sylgard 184, has a high linear thermal expansion coefficient of 3.1μ10-4 K-1. Surface modulations are recorded in an interferometer. Modulations of 350 nm result at an intensity of 370 mW/cm2. The resolution is measured with a line pattern. The contrast drops to 30 % at 1.6 line pairs per millimeter (lp/mm).

  14. Thermal expansion in dysprosium tungstate Dy10W2O21

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The complex oxide Dy10W2O21 was synthesized by a solid-state reaction and isolated in cubic symmetry by an X-ray diffractometry (XRD) method. Differential scanning calorimetry (DSC) measurements show that the compound is thermodynamically stable. The intrinsic thermal expansion coefficients were determined by extra-power powder Xray diffractometry from room temperature to 1000 ℃: linear coefficient α = 1.07 × 10-5 ℃-1 and bulk coefficient β=3.20 × 10-5℃-1. Dilatometry was used to measure the extrinsic thermal expansion coefficient (9.2 × 10-6℃-1).

  15. Thermal expansion and magnetostriction in CeRh3B2

    Science.gov (United States)

    Takeuchi, T.; Thamizhavel, A.; Okubo, T.; Yamada, M.; Inada, Y.; Galatanu, A.; Yamamoto, E.; O¯nuki, Y.

    2004-05-01

    Thermal expansion and magnetostriction measurements have been performed on a single crystal CeRh3B2 with an unusually high Curie temperature TC~120K. The thermal expansion coefficients show a weak anomaly at TC and characteristic positive and negative peaks around 150K for [0001] and [101¯0], respectively. The magnetostriction at 4.2K for the field along the basal plane is very small, with an order of 10-5, suggesting a localized nature of Ce-4f moments.

  16. Thermal Expansion and Diffusion Coefficients of Carbon Nanotube-Polymer Composites

    Science.gov (United States)

    Wei, Chengyu; Srivastava, Deepak; Cho, Kyeongjae; Biegel, Bryan (Technical Monitor)

    2001-01-01

    Classical molecular dynamics (MD) simulations employing Brenner potential for intra-nanotube interactions and van der Waals forces for polymer-nanotube interface have been used to investigate thermal expansion and diffusion characteristics of carbon nanotube-polyethylene composites. Addition of carbon nanotubes to polymer matrix is found to significantly increase the glass transition temperature Tg, and thermal expansion and diffusion coefficients in the composite above Tg. The increase has been attributed to the temperature dependent increase of the excluded volume for the polymer chains, and the findings could have implications in the composite processing, coating and painting applications.

  17. The effect of water on the thermal expansion behavior of FM5055 carbon phenolic

    Science.gov (United States)

    Sullivan, Roy M.

    1995-01-01

    The effect of water on the thermal expansion behavior of FM5055 carbon phenolic is studied using a theory of mixtures approach. A partial pressure expression for the water constituent was obtained based upon certain assumptions regarding the thermodynamic state of water as it resides in the free volumes of the polymer. A simple constitutive model is used to simulate the polymer strain due to the application of the partial pressure of water. The resulting theory is applied to model the effect of moisture on the thermal expansion of FM5055 carbon phenolic specimens. The application of the theory results in calculated strains which were in close agreement with the measured strains.

  18. Relation between thermal expansion and interstitial formation energy in pure Fe and Cr

    Energy Technology Data Exchange (ETDEWEB)

    Wallenius, Janne [Department of Nuclear and Reactor Physics, KTH, AlbaNova University Centre, Stockholm 10691 (Sweden) and Department of Neutron Research, Uppsala University, Uppsala (Sweden)]. E-mail: janne@neutron.kth.se; Olsson, Paer [Department of Neutron Research, Uppsala University, Uppsala (Sweden); Lagerstedt, Christina [Department of Nuclear and Reactor Physics, KTH, AlbaNova University Centre, Stockholm 10691 (Sweden)

    2005-01-01

    By fitting a potential of modified Finnis-Sinclair type to the thermal expansion of ferromagnetic Fe and paramagnetic Cr, stability of the <1 1 0> self-interstitial atom is obtained. The resulting potentials are relatively hard, yielding high SIA formation energies. Less hard potentials give lower interstitial formation energy, but predict too small thermal expansion. We also show that the formation energy of the <1 1 1> SIA depends on distances in-between the 2nd and 3rd neighbour. By raising the value of the pair potential in this region, the energy difference with respect to the <110> configuration calculated with VASP in the PAW approximation can be reproduced.

  19. Analysis of thermal expansion effects on leakage in self-sealed journal bearings

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    This paper, based on a simplified model, researched the problem of liquid lubricantleakage caused by thermal expansion effects in a self-sealed journal bearing, The analysis indi-cated that mismatch between thermal expansion coefficient of oil-holding-space in bearing, σT, andthat of liquid lubricant, αoi, is a subtle factor inducing leakage when bearing temperature varies.Measures like properly selecting liquid lubricant and carefully designing bearing structure could betaken to reduce the leakage by matching αT and αoil, Several such ideas concerning bearing mate-rial choosing and structure designing were presented.

  20. Micro-Structured Two-Component 3D Metamaterials with Negative Thermal-Expansion Coefficient from Positive Constituents

    Science.gov (United States)

    Qu, Jingyuan; Kadic, Muamer; Naber, Andreas; Wegener, Martin

    2017-01-01

    Controlling the thermal expansion of materials is of great technological importance. Uncontrolled thermal expansion can lead to failure or irreversible destruction of structures and devices. In ordinary crystals, thermal expansion is governed by the asymmetry of the microscopic binding potential, which cannot be adjusted easily. In artificial crystals called metamaterials, thermal expansion can be controlled by structure. Here, following previous theoretical work, we fabricate three-dimensional (3D) two-component polymer micro-lattices by using gray-tone laser lithography. We perform cross-correlation analysis of optical microscopy images taken at different sample temperatures. The derived displacement-vector field reveals that the thermal expansion and resulting bending of the bi-material beams leads to a rotation of the 3D chiral crosses arranged onto a 3D checkerboard pattern within one metamaterial unit cell. These rotations can compensate the expansion of the all positive constituents, leading to an effectively near-zero thermal length-expansion coefficient, or over-compensate the expansion, leading to an effectively negative thermal length-expansion coefficient. This evidences a striking level of thermal-expansion control.

  1. Effectively control negative thermal expansion of single-phase ferroelectrics of PbTiO3-(Bi,La)FeO3 over a giant range

    OpenAIRE

    Chen, Jun; Wang, Fangfang; Huang, Qingzhen; Hu, Lei; Song, Xiping; Deng, Jinxia; Yu, Ranbo; Xing, Xianran

    2013-01-01

    Control of negative thermal expansion is a fundamentally interesting topic in the negative thermal expansion materials in order for the future applications. However, it is a challenge to control the negative thermal expansion in individual pure materials over a large scale. Here, we report an effective way to control the coefficient of thermal expansion from a giant negative to a near zero thermal expansion by means of adjusting the spontaneous volume ferroelectrostriction (SVFS) in the syste...

  2. Anomalously Slow Cross Symmetry Phase Relaxation, Thermalized Non-Equilibrated Matter and Quantum Computing Beyond the Quantum Chaos Border

    Directory of Open Access Journals (Sweden)

    T.H. Seligman

    2006-02-01

    Full Text Available Thermalization in highly excited quantum many-body system does not necessarily mean a complete memory loss of the way the system was formed. This effect may pave a way for a quantum computing, with a large number of qubits $nsimeq 100-1000$, far beyond the quantum chaos border. One of the manifestations of such a thermalized non-equilibrated matter is revealed by a strongasymmetry around 90$^circ $ c.m. of evaporating proton yield in the Bi($gamma$,p photonuclear reaction. The effect is described in terms of anomalously slow cross symmetry phase relaxation in highly excited quantum many-body systems withexponentially large Hilbert space dimensions. In the above reaction this phase relaxation is about eight orders of magnitude slower than energy relaxation (thermalization.

  3. Anomalously Slow Cross Symmetry Phase Relaxation, Thermalized Non-Equilibrated Matter and Quantum Computing Beyond the Quantum Chaos Border

    Science.gov (United States)

    Bienert, M.; Flores, J.; Kun, S. Yu.; Seligman, T. H.

    2006-02-01

    Thermalization in highly excited quantum many-body system does not necessarily mean a complete memory loss of the way the system was formed. This effect may pave a way for a quantum computing, with a large number of qubits n ≈ 100-1000, far beyond the quantum chaos border. One of the manifestations of such a thermalized non-equilibrated matter is revealed by a strong asymmetry around 90° c.m. of evaporating proton yield in the Bi(γ,p) photonuclear reaction. The effect is described in terms of anomalously slow cross symmetry phase relaxation in highly excited quantum many-body systems with exponentially large Hilbert space dimensions. In the above reaction this phase relaxation is about eight orders of magnitude slower than energy relaxation (thermalization).

  4. Anomalously Slow Cross Symmetry Phase Relaxation, Thermalized Non-Equilibrated Matter and Quantum Computing Beyond the Quantum Chaos Border

    CERN Document Server

    Bienert, M; Kun, S Yu; Seligman, T H

    2006-01-01

    Thermalization in highly excited quantum many-body system does not necessarily mean a complete memory loss of the way the system was formed. This effect may pave a way for a quantum computing, with a large number of qubits $n\\simeq 100$--1000, far beyond the quantum chaos border. One of the manifestations of such a thermalized non-equilibrated matter is revealed by a strong asymmetry around 90$^\\circ $ c.m. of evaporating proton yield in the Bi($\\gamma$,p) photonuclear reaction. The effect is described in terms of anomalously slow cross symmetry phase relaxation in highly excited quantum many-body systems with exponentially large Hilbert space dimensions. In the above reaction this phase relaxation is about eight orders of magnitude slower than energy relaxation (thermalization).

  5. Comparison of the Thermal Expansion Behavior of Several Intermetallic Silicide Alloys Between 293 and 1523 K

    Science.gov (United States)

    Raj, Sai V.

    2014-01-01

    Thermal expansion measurements were conducted on hot-pressed CrSi(sub 2), TiSi(sub 2), W Si(sub 2) and a two-phase Cr-Mo-Si intermetallic alloy between 293 and 1523 K during three heat-cool cycles. The corrected thermal expansion, (L/L(sub 0)(sub thermal), varied with the absolute temperature, T, as (deltaL/L(sub 0)(sub thermal) = A(T-293)(sup 3) + B(T-293)(sup 2) + C(T-293) + D, where A, B, C and D are regression constants. Excellent reproducibility was observed for most of the materials after the first heat-up cycle. In some cases, the data from the first heatup cycle deviated from those determined in the subsequent cycles. This deviation was attributed to the presence of residual stresses developed during processing, which are relieved after the first heat-up cycle.

  6. Unravelling the fundamentals of thermal and chemical expansion of BaCeO3 from first principles phonon calculations.

    Science.gov (United States)

    Løken, Andreas; Haugsrud, Reidar; Bjørheim, Tor S

    2016-11-16

    Differentiating chemical and thermal expansion is virtually impossible to achieve experimentally. While thermal expansion stems from a softening of the phonon spectra, chemical expansion depends on the chemical composition of the material. In the present contribution, we, for the first time, completely decouple thermal and chemical expansion through first principles phonon calculations on BaCeO3, providing new fundamental insights to lattice expansion. We assess the influence of defects on thermal expansion, and how this in turn affects the interpretation of chemical expansion and defect thermodynamics. The calculations reveal that the linear thermal expansion coefficient is lowered by the introduction of oxygen vacancies being 10.6 × 10(-6) K(-1) at 300 K relative to 12.2 × 10(-6) K(-1) for both the protonated and defect-free bulk lattice. We further demonstrate that the chemical expansion coefficient upon hydration varies with temperature, ranging from 0.070 to 0.115 per mole oxygen vacancy. Ultimately, we find that, due to differences in the thermal expansion coefficients under dry and wet conditions, the chemical expansion coefficients determined experimentally are grossly underestimated - around 55% lower in the case of 10 mol% acceptor doped BaCeO3. Lastly, we evaluate the effect of these volume changes on the vibrational thermodynamics.

  7. First-principles description of anomalously low lattice thermal conductivity in thermoelectric Cu-Sb-Se ternary semiconductors

    Science.gov (United States)

    Zhang, Yongsheng; Skoug, Eric; Cain, Jeffrey; Ozoliņš, Vidvuds; Morelli, Donald; Wolverton, C.

    2012-02-01

    Experimental measurements have recently shown that Cu3SbSe3 exhibits anomalously low and nearly temperature-independent lattice thermal conductivity, whereas Cu3SbSe4 does not exhibit this anomalous behavior. To understand this strong distinction between these two seemingly similar compounds, we perform density functional theory calculations of the vibrational properties of these two semiconductors within the quasiharmonic approximation. We observe strikingly different behavior in the two compounds: almost all the acoustic-mode Grüneisen parameters are negative in Cu3SbSe4, whereas almost all are positive in Cu3SbSe3 throughout their respective Brillouin zones. The average of the square of the Grüneisen parameter for the acoustic mode in Cu3SbSe3 is larger than that of Cu3SbSe4, which theoretically confirms that Cu3SbSe3 has a stronger lattice anharmonicity than Cu3SbSe4. The soft frequency and high Grüneisen parameters in Cu3SbSe3 arise from the electrostatic repulsion between the lone s2 pair at Sb sites and the bonding charge in Sb-Se bonds. Using our first-principles-determined longitudinal and transverse acoustic-mode Grüneisen parameters, zone-boundary frequencies, and phonon group velocities, we calculate the lattice thermal conductivity using the Debye-Callaway model. The theoretical thermal conductivity is in good agreement with the experimental measurements.

  8. Millisecond dynamics of thermal expansion of mechanically controllable break junction electrodes studied in the tunneling regime

    Science.gov (United States)

    Kolesnychenko, O. Yu.; Toonen, A. J.; Shklyarevskii, O. I.; van Kempen, H.

    2001-10-01

    The thermal expansion dynamics of W, Pt-Ir, and Au mechanically controllable break junction electrodes was studied in the millisecond range. By measuring a transient tunnel current as a function of time, we found that, at low temperatures, the electrode elongation Δs˜t1/2 due to the large values of thermal diffusivity of metals. The magnitude of Δs varies in direct proportion to the power P dissipated in the electrodes.

  9. Thermal expansion compensator having an elastic conductive element bonded to two facing surfaces

    Science.gov (United States)

    Determan, William (Inventor); Matejczyk, Daniel Edward (Inventor)

    2012-01-01

    A thermal expansion compensator is provided and includes a first electrode structure having a first surface, a second electrode structure having a second surface facing the first surface and an elastic element bonded to the first and second surfaces and including a conductive element by which the first and second electrode structures electrically and/or thermally communicate, the conductive element having a length that is not substantially longer than a distance between the first and second surfaces.

  10. A review on the flexural mode of graphene: lattice dynamics, thermal conduction, thermal expansion, elasticity and nanomechanical resonance.

    Science.gov (United States)

    Jiang, Jin-Wu; Wang, Bing-Shen; Wang, Jian-Sheng; Park, Harold S

    2015-03-04

    Single-layer graphene is so flexible that its flexural mode (also called the ZA mode, bending mode, or out-of-plane transverse acoustic mode) is important for its thermal and mechanical properties. Accordingly, this review focuses on exploring the relationship between the flexural mode and thermal and mechanical properties of graphene. We first survey the lattice dynamic properties of the flexural mode, where the rigid translational and rotational invariances play a crucial role. After that, we outline contributions from the flexural mode in four different physical properties or phenomena of graphene-its thermal conductivity, thermal expansion, Young's modulus and nanomechanical resonance. We explain how graphene's superior thermal conductivity is mainly due to its three acoustic phonon modes at room temperature, including the flexural mode. Its coefficient of thermal expansion is negative in a wide temperature range resulting from the particular vibration morphology of the flexural mode. We then describe how the Young's modulus of graphene can be extracted from its thermal fluctuations, which are dominated by the flexural mode. Finally, we discuss the effects of the flexural mode on graphene nanomechanical resonators, while also discussing how the essential properties of the resonators, including mass sensitivity and quality factor, can be enhanced.

  11. Lattice thermal expansion and anisotropic displacements in -sulfur from diffraction experiments and first-principles theory.

    Science.gov (United States)

    George, Janine; Deringer, Volker L; Wang, Ai; Müller, Paul; Englert, Ulli; Dronskowski, Richard

    2016-12-21

    Thermal properties of solid-state materials are a fundamental topic of study with important practical implications. For example, anisotropic displacement parameters (ADPs) are routinely used in physics, chemistry, and crystallography to quantify the thermal motion of atoms in crystals. ADPs are commonly derived from diffraction experiments, but recent developments have also enabled their first-principles prediction using periodic density-functional theory (DFT). Here, we combine experiments and dispersion-corrected DFT to quantify lattice thermal expansion and ADPs in crystalline α-sulfur (S8), a prototypical elemental solid that is controlled by the interplay of covalent and van der Waals interactions. We begin by reporting on single-crystal and powder X-ray diffraction measurements that provide new and improved reference data from 10 K up to room temperature. We then use several popular dispersion-corrected DFT methods to predict vibrational and thermal properties of α-sulfur, including the anisotropic lattice thermal expansion. Hereafter, ADPs are derived in the commonly used harmonic approximation (in the computed zero-Kelvin structure) and also in the quasi-harmonic approximation (QHA) which takes the predicted lattice thermal expansion into account. At the PPBE+D3(BJ) level, the QHA leads to excellent agreement with experiments. Finally, more general implications of this study for theory and experiment are discussed.

  12. Comparison of High Temperature Crystal Lattice and Bulk Thermal Expansion Measurements of LGT Single Crystal

    Energy Technology Data Exchange (ETDEWEB)

    Beaucage, Timothy R [University of Maine; Beenfeldt, Eric P [University of Maine; Speakman, Scott A [ORNL; Porter, Wallace D [ORNL; Payzant, E Andrew [ORNL; Pereira da Cunha, Mauricio [University of Maine

    2006-01-01

    Among the langasite family of crystals (LGX), the three most popular materials are langasite (LGS, La3Ga5SiO14), langatate (LGT, La3Ga5.5Ta0.5O14) and langanite (LGN, La3Ga5.5Nb0.5O14). The LGX crystals have received significant attention for acoustic wave (AW) device applications due to several properties, which include: (1) piezoelectric constants about two and a half times those of quartz, thus allowing the design of larger bandwidth filters; (2) existence of temperature compensated orientations; (3) high density, with potential for reduced vibration and acceleration sensitivity; and (4) possibility of operation at high temperatures, since the LGX crystals do not present phase changes up to their melting point above 1400degC. The LGX crystals' capability to operate at elevated temperatures calls for an investigation on the growth quality and the consistency of these materials' properties at high temperature. One of the fundamental crystal properties is the thermal expansion coefficients in the entire temperature range where the material is operational. This work focuses on the measurement of the LGT thermal expansion coefficients from room temperature (25degC) to 1200degC. Two methods of extracting the thermal expansion coefficients have been used and compared: (a) dual push-rod dilatometry, which provides the bulk expansion; and (b) x-ray powder diffraction, which provides the lattice expansion. Both methods were performed over the entire temperature range and considered multiple samples taken from <001> Czochralski grown LGT material. The thermal coefficients of expansion were extracted by approximating each expansion data set to a third order polynomial fit over three temperature ranges reported in this work: 25degC to 400degC, 400degC to 900degC, 900degC to 1200degC. An accuracy of fit better than 35ppm for the bulk expansion and better than 10ppm for the lattice expansion have been obtained with the aforementioned polynomial fitting. The

  13. Composition-tuning in a solid-state electrotransport furnace with active thermal expansion compensation.

    Science.gov (United States)

    Schmehr, J L; Whitley, W; Huxley, A D

    2016-12-01

    A new solid-state electrotransport (SSE) apparatus for refining ultra-pure single crystals of metallic compounds under ultra-high vacuum is described. The setup employs a novel thermal expansion compensation mechanism to minimize mechanical stress on the sample during refinement with cold clamps for contamination-less purification at elevated temperatures. The apparatus is designed to tune the composition of initially slightly off-stoichiometric samples. The expansion compensation and stress-free operation were tested by recording the thermal expansion of elemental cerium in a treatment up to 655 °C. SSE refinement was then performed on a high-quality single crystal of U6Fe resulting in a 50% increase of its residual resistivity ratio to the highest value obtained for a single crystal to date.

  14. Composition-tuning in a solid-state electrotransport furnace with active thermal expansion compensation

    Science.gov (United States)

    Schmehr, J. L.; Whitley, W.; Huxley, A. D.

    2016-12-01

    A new solid-state electrotransport (SSE) apparatus for refining ultra-pure single crystals of metallic compounds under ultra-high vacuum is described. The setup employs a novel thermal expansion compensation mechanism to minimize mechanical stress on the sample during refinement with cold clamps for contamination-less purification at elevated temperatures. The apparatus is designed to tune the composition of initially slightly off-stoichiometric samples. The expansion compensation and stress-free operation were tested by recording the thermal expansion of elemental cerium in a treatment up to 655 °C. SSE refinement was then performed on a high-quality single crystal of U6Fe resulting in a 50% increase of its residual resistivity ratio to the highest value obtained for a single crystal to date.

  15. Lithium aluminosilicate reinforced with carbon nanofiber and alumina for controlled-thermal-expansion materials.

    Science.gov (United States)

    Borrell, Amparo; García-Moreno, Olga; Torrecillas, Ramón; García-Rocha, Victoria; Fernández, Adolfo

    2012-02-01

    Materials with a very low or tailored thermal expansion have many applications ranging from cookware to the aerospace industry. Among others, lithium aluminosilicates (LAS) are the most studied family with low and negative thermal expansion coefficients. However, LAS materials are electrical insulators and have poor mechanical properties. Nanocomposites using LAS as a matrix are promising in many applications where special properties are achieved by the addition of one or two more phases. The main scope of this work is to study the sinterability of carbon nanofiber (CNFs)/LAS and CNFs/alumina/LAS nanocomposites, and to adjust the ratio among components for obtaining a near-zero or tailored thermal expansion. Spark plasma sintering of nanocomposites, consisting of commercial CNFs and alumina powders and an ad hoc synthesized β-eucryptite phase, is proposed as a solution to improving mechanical and electrical properties compared with the LAS ceramics obtained under the same conditions. X-ray diffraction results on phase compositions and microstructure are discussed together with dilatometry data obtained in a wide temperature range (-150 to 450 °C). The use of a ceramic LAS phase makes it possible to design a nanocomposite with a very low or tailored thermal expansion coefficient and exceptional electrical and mechanical properties.

  16. Thermal expansion of the magnetorefrigerant Gd5(Si,Ge)4

    NARCIS (Netherlands)

    Brück, E.H.; Nazih, M.; de Visser, A.; Zhang, L.; Tegus, O.

    2003-01-01

    We report thermal expansion measurements carried out on a single-crystal of the giant magnetocaloric effect material Gd5(Si0.43Ge0.57)4. At the magneto-structural phase transition at T0~240 K, large steps in the relative length change ÄL/L along the principle crystallographic axes are observed. The

  17. Lithium aluminosilicate reinforced with carbon nanofiber and alumina for controlled-thermal-expansion materials

    Science.gov (United States)

    Borrell, Amparo; García-Moreno, Olga; Torrecillas, Ramón; García-Rocha, Victoria; Fernández, Adolfo

    2012-02-01

    Materials with a very low or tailored thermal expansion have many applications ranging from cookware to the aerospace industry. Among others, lithium aluminosilicates (LAS) are the most studied family with low and negative thermal expansion coefficients. However, LAS materials are electrical insulators and have poor mechanical properties. Nanocomposites using LAS as a matrix are promising in many applications where special properties are achieved by the addition of one or two more phases. The main scope of this work is to study the sinterability of carbon nanofiber (CNFs)/LAS and CNFs/alumina/LAS nanocomposites, and to adjust the ratio among components for obtaining a near-zero or tailored thermal expansion. Spark plasma sintering of nanocomposites, consisting of commercial CNFs and alumina powders and an ad hoc synthesized β-eucryptite phase, is proposed as a solution to improving mechanical and electrical properties compared with the LAS ceramics obtained under the same conditions. X-ray diffraction results on phase compositions and microstructure are discussed together with dilatometry data obtained in a wide temperature range (-150 to 450 °C). The use of a ceramic LAS phase makes it possible to design a nanocomposite with a very low or tailored thermal expansion coefficient and exceptional electrical and mechanical properties.

  18. Lithium aluminosilicate reinforced with carbon nanofiber and alumina for controlled-thermal-expansion materials

    Directory of Open Access Journals (Sweden)

    Amparo Borrell, Olga García-Moreno, Ramón Torrecillas, Victoria García-Rocha and Adolfo Fernández

    2012-01-01

    Full Text Available Materials with a very low or tailored thermal expansion have many applications ranging from cookware to the aerospace industry. Among others, lithium aluminosilicates (LAS are the most studied family with low and negative thermal expansion coefficients. However, LAS materials are electrical insulators and have poor mechanical properties. Nanocomposites using LAS as a matrix are promising in many applications where special properties are achieved by the addition of one or two more phases. The main scope of this work is to study the sinterability of carbon nanofiber (CNFs/LAS and CNFs/alumina/LAS nanocomposites, and to adjust the ratio among components for obtaining a near-zero or tailored thermal expansion. Spark plasma sintering of nanocomposites, consisting of commercial CNFs and alumina powders and an ad hoc synthesized β-eucryptite phase, is proposed as a solution to improving mechanical and electrical properties compared with the LAS ceramics obtained under the same conditions. X-ray diffraction results on phase compositions and microstructure are discussed together with dilatometry data obtained in a wide temperature range (−150 to 450 °C. The use of a ceramic LAS phase makes it possible to design a nanocomposite with a very low or tailored thermal expansion coefficient and exceptional electrical and mechanical properties.

  19. How important is thermal expansion for predicting molecular crystal structures and thermochemistry at finite temperatures?

    Science.gov (United States)

    Heit, Yonaton N; Beran, Gregory J O

    2016-08-01

    Molecular crystals expand appreciably upon heating due to both zero-point and thermal vibrational motion, yet this expansion is often neglected in molecular crystal modeling studies. Here, a quasi-harmonic approximation is coupled with fragment-based hybrid many-body interaction calculations to predict thermal expansion and finite-temperature thermochemical properties in crystalline carbon dioxide, ice Ih, acetic acid and imidazole. Fragment-based second-order Möller-Plesset perturbation theory (MP2) and coupled cluster theory with singles, doubles and perturbative triples [CCSD(T)] predict the thermal expansion and the temperature dependence of the enthalpies, entropies and Gibbs free energies of sublimation in good agreement with experiment. The errors introduced by neglecting thermal expansion in the enthalpy and entropy cancel somewhat in the Gibbs free energy. The resulting ∼ 1-2 kJ mol(-1) errors in the free energy near room temperature are comparable to or smaller than the errors expected from the electronic structure treatment, but they may be sufficiently large to affect free-energy rankings among energetically close polymorphs.

  20. Molecular Dynamics Study of a Thermal Expansion Coefficient: Ti Bulk with an Elastic Minimum Image Method

    Institute of Scientific and Technical Information of China (English)

    Yakup Hundur; Rainer Hippler; Ziya B. Güven(c)

    2006-01-01

    @@ Linear thermal expansion coefficient (TEC) of Ti bulk is investigated by means of molecular dynamics simulation.The elastic minimum image convention of periodic boundary conditions is introduced to allow the bulk to adjust its size according to the new fixed temperature. The TEC and the specific heat of Ti are compared to the available theoretical and experimental data.

  1. Thermal expansion of vitrified blood vessels permeated with DP6 and synthetic ice modulators.

    Science.gov (United States)

    Eisenberg, David P; Taylor, Michael J; Jimenez-Rios, Jorge L; Rabin, Yoed

    2014-06-01

    This study provides thermal expansion data for blood vessels permeated with the cryoprotective cocktail DP6, when combined with selected synthetic ice modulators (SIMs): 12% polyethylene glycol 400, 6% 1,3-cyclohexanediol, and 6% 2,3-butanediol. The general classification of SIMs includes molecules that modulate ice nucleation and growth, or possess properties of stabilizing the amorphous state, by virtue of their chemical structure and at concentrations that are not explained on a purely colligative basis. The current study is part of an ongoing effort to characterize thermo-mechanical effects on structural integrity of cryopreserved materials, where thermal expansion is the driving mechanism to thermo-mechanical stress. This study focuses on the lower part of the cryogenic temperature range, where the cryoprotective agent (CPA) behaves as a solid for all practical applications. By combining results obtained in the current study with literature data on the thermal expansion in the upper part of the cryogenic temperature range, unified thermal expansion curves are presented.

  2. The thermal expansion of a face-centered cubic lattice with central two-body interactions

    NARCIS (Netherlands)

    Bicknese, V.

    1965-01-01

    The thermal expansion e is calculated by minimizing the free energy, including the cubic and quartic phonon-interaction terms. The free energy is expanded to third order in e. The work is closely related to that of Maradudin and Maradudin, Flinn and Coldwell-Horsfall. The resulting formulas are appl

  3. Autofrettage to Counteract Coefficient of Thermal Expansion Mismatch in Cryogenic Pressurized Pipes with Metallic Liners

    Science.gov (United States)

    Wen, Ed; Barbero, Ever; Tygielski, Phlip; Turner, James E. (Technical Monitor)

    2001-01-01

    Composite feedlines with metal liners have the potential to reduce weight/cost while providing the same level of permeation resistance and material compatibility of all-metal feedlines carrying cryogenic propellants in spacecraft. The major technical challenges are the large difference in Coefficient of Thermal Expansion between the liner and the composite, and the manufacturing method required to make a very thin liner with the required strength and dimensional tolerance. This study investigates the use of autofrettage (compressive preload) to counteract Coefficient of Thermal Expansion when pre-pressurization procedures cannot be used to solve this problem. Promising materials (aluminum 2219, Inconel 718, nickel, nickel alloy) and manufacturing techniques (chemical milling, electroplating) are evaluated to determine the best liner candidates. Robust, autofrettaged feedlines with a low Coefficient of Thermal Expansion liner (Inconel 718 or nickel alloy) are shown to successfully counteract mismatch at LOX temperature. A new concept, autofrettage by temperature, is introduced for high Coefficient of Thermal Expansion materials (aluminum and pure nickel) where pressure cannot be used to add compressive preload.

  4. Supramolecular-jack-like guest in ultramicroporous crystal for exceptional thermal expansion behaviour.

    Science.gov (United States)

    Zhou, Hao-Long; Zhang, Yue-Biao; Zhang, Jie-Peng; Chen, Xiao-Ming

    2015-04-21

    The dynamic behaviours of host frameworks and guest molecules have received much attention for their great relevance with smart materials, but little has been developed to control or understand the host-guest interplay. Here we show that the confined guest can utilize not only molecular static effects but also bulk dynamic properties to control the host dynamics. By virtue of the three-dimensional hinge-like framework and quasi-discrete ultramicropores, a flexible porous coordination polymer exhibits not only drastic guest-modulation effect of the thermal expansion magnitude (up to 422 × 10(-6) K(-1)) and even the anisotropy but also records positive/negative thermal expansion coefficients of +482/-218 × 10(-6) K(-1). Moreover, single-crystal X-ray diffraction analyses demonstrate that the jack-like motion of the guest supramolecular dimers, being analogous to the anisotropic thermal expansion of bulk van der Waals solids, is crucial for changing the flexibility mode and thermal expansion behaviour of the crystal.

  5. Calculation of Thermal Expansion Coefficients of Pure Elements and their Alloys

    Science.gov (United States)

    Abel, Phillip; Bozzolo, Guillermo; Huff, Dennis (Technical Monitor)

    2002-01-01

    A simple algorithm for computing the coefficient of thermal expansion of pure elements and their alloys, based on features of the binding energy curve, is introduced. The BFS method for alloys is used to determine the binding energy curves of intermetallic alloys and Ni-base superalloys.

  6. Supramolecular-jack-like guest in ultramicroporous crystal for exceptional thermal expansion behaviour

    Science.gov (United States)

    Zhou, Hao-Long; Zhang, Yue-Biao; Zhang, Jie-Peng; Chen, Xiao-Ming

    2015-04-01

    The dynamic behaviours of host frameworks and guest molecules have received much attention for their great relevance with smart materials, but little has been developed to control or understand the host-guest interplay. Here we show that the confined guest can utilize not only molecular static effects but also bulk dynamic properties to control the host dynamics. By virtue of the three-dimensional hinge-like framework and quasi-discrete ultramicropores, a flexible porous coordination polymer exhibits not only drastic guest-modulation effect of the thermal expansion magnitude (up to 422 × 10-6 K-1) and even the anisotropy but also records positive/negative thermal expansion coefficients of +482/-218 × 10-6 K-1. Moreover, single-crystal X-ray diffraction analyses demonstrate that the jack-like motion of the guest supramolecular dimers, being analogous to the anisotropic thermal expansion of bulk van der Waals solids, is crucial for changing the flexibility mode and thermal expansion behaviour of the crystal.

  7. Thermal Expansion and Swelling of Cured Epoxy Resin Used in Graphite/Epoxy Composite

    Science.gov (United States)

    Adamson, M. J.

    1979-01-01

    The thermal expansion and swelling of resin material as influenced by variations in temperature during moisture absorption is discussed. Comparison measurements using composites constructed of graphite fibers and each of two epoxy resin matrices are included. Polymer theory relative to these findings is discussed and modifications are proposed.

  8. Structure and thermal expansion of the tungsten bronze Pb₂KNb₅O₁₅.

    Science.gov (United States)

    Lin, Kun; Wu, Hui; Wang, Fangfang; Rong, Yangchun; Chen, Jun; Deng, Jinxia; Yu, Ranbo; Fang, Liang; Huang, Qingzhen; Xing, Xianran

    2014-05-21

    The structure and thermal expansion behavior of the tetragonal tungsten bronze oxide Pb2KNb5O15 were investigated by neutron powder diffraction and high-temperature X-ray diffraction. Below the Curie temperature, T(C) (orthorhombic phase, T(C) ≈ 460 °C), the cell parameters a and c increase with temperature, while b decreases. The thermal expansion coefficients are α(a) = 1.29 × 10(-5) °C(-1), α(b) = -1.56 × 10(-5) °C(-1), and α(c) = 1.62 × 10(-5) °C(-1). Temperature-dependent second harmonic generation (SHG), dielectric, and polarization-electrical field (P-E) hysteresis loop measurements were performed to study the symmetry and electric properties. We show that the distortion and cooperative rotation of NbO6 octahedrons are directly responsible for the negative thermal expansion coefficient along the polar b axis. It is suggested that Pb-O covalency, especially in the large and asymmetric pentagonal prisms, may be related to orthorhombic distortion and abnormal spontaneous polarization along the b axis. This study shows that tungsten bronze families are possible candidates for exploring negative thermal expansion materials.

  9. Atomistic Modeling of the Negative Thermal Expansion in δ- Plutonium  Based on the Two-State Description

    Directory of Open Access Journals (Sweden)

    Steven M. Valone

    2012-06-01

    Full Text Available The δ phase  of plutonium with the fcc structure exhibits an unusual negative thermal expansion (NTE over its narrow  temperature range of stability, 593–736 K. An accurate description  of the anomalous high-temperature volume effect of plutonium  goes beyond the current capability  of electronic-structure  calculations.  We propose an atomistic scheme to model the thermodynamic properties of δ-Pu based on the two-state model of Weiss for the Invar alloys, inspired by the simple free-energy analysis previously conducted by Lawson et al. The two-state mechanism is incorporated into the atomistic description of a many-body  interacting  system.  Two modified  embedded atom method potentials are employed to represent the binding energies of two competing  electronic  states in δ-Pu. We demonstrate how the NTE takes place in δ-Pu by means of Monte Carlo simulations implemented with the two-state mechanism.

  10. Waste Package Outer Barrier Stress Due to Thermal Expansion with Various Barrier Gap Sizes

    Energy Technology Data Exchange (ETDEWEB)

    M. M. Lewis

    2001-11-27

    The objective of this activity is to determine the tangential stresses of the outer shell, due to uneven thermal expansion of the inner and outer shells of the current waste package (WP) designs. Based on the results of the calculation ''Waste Package Barrier Stresses Due to Thermal Expansion'', CAL-EBS-ME-000008 (ref. 10), only tangential stresses are considered for this calculation. The tangential stresses are significantly larger than the radial stresses associated with thermal expansion, and at the WP outer surface the radial stresses are equal to zero. The scope of this activity is limited to determining the tangential stresses the waste package outer shell is subject to due to the interference fit, produced by having two different shell coefficients of thermal expansions. The inner shell has a greater coefficient of thermal expansion than the outer shell, producing a pressure between the two shells. This calculation is associated with Waste Package Project. The calculations are performed for the 21-PWR (pressurized water reactor), 44-BWR (boiling water reactor), 24-BWR, 12-PWR Long, 5 DHLW/DOE SNF - Short (defense high-level waste/Department of Energy spent nuclear fuel), 2-MCO/2-DHLW (multi-canister overpack), and Naval SNF Long WP designs. The information provided by the sketches attached to this calculation is that of the potential design for the types of WPs considered in this calculation. This calculation is performed in accordance with the ''Technical Work Plan for: Waste Package Design Description for SR (Ref.7). The calculation is documented, reviewed, and approved in accordance with AP-3.12Q, Calculations (Ref.1).

  11. Carbon-based torsional and tensile artificial muscles driven by thermal expansion (presentation video)

    Science.gov (United States)

    Haines, Carter S.; Lima, Márcio D.; Li, Na; Spinks, Geoffrey M.; Foroughi, Javad; Madden, John D. W.; Kim, Shi-Hyeong; Fang, Shaoli; Jung de Andrade, Monica; Göktepe, Fatma; Göktepe, Ozer; Mirvakili, Seyed M.; Naficy, Sina; Lepró, Xavier; Oh, Jiyoung; Kozlov, Mikhail E.; Kim, Seon Jeong; Xu, Xiuru; Swedlove, Benjamin J.; Wallace, Gordon G.; Baughman, Ray H.

    2014-03-01

    High-performance artificial muscles have been produced from fibers having highly anisotropic thermal expansion. Inserting twist into these precursor fibers enables thermally-driven torsional actuation and can cause the formation of helical coils. Such coiled structures provide giant-stroke tensile actuation exceeding the 20% in-vivo contraction of natural muscles. This contraction is highly reversible, with over one million cycles demonstrated, and can occur without the hysteresis that plagues competing shape-memory and piezoelectric muscles. Several materials and composites are investigated, including low-cost, commercially-available muscle precursors, potentially facilitating thermally-responsive textiles that change porosity to provide wearer comfort.

  12. Debye temperature, thermal expansion, and heat capacity of TcC up to 100 GPa

    Energy Technology Data Exchange (ETDEWEB)

    Song, T., E-mail: songting@mail.lzjtu.cn [School of Mathematics and Physics, Lanzhou Jiaotong University, Lanzhou 730070 (China); School of Material Science and Engineering, Lanzhou University of Technology, Lanzhou 730050 (China); Ma, Q. [School of Material Science and Engineering, Lanzhou University of Technology, Lanzhou 730050 (China); Tian, J.H. [School of Mathematics and Physics, Lanzhou Jiaotong University, Lanzhou 730070 (China); Liu, X.B. [School of Physics and Information Science, Tianshui Normal University, Tianshui 741000 (China); Ouyang, Y.H.; Zhang, C.L.; Su, W.F. [School of Mathematics and Physics, Lanzhou Jiaotong University, Lanzhou 730070 (China)

    2015-01-15

    Highlights: • A number of thermodynamic properties of rocksalt TcC are investigated for the first time. • The quasi-harmonic Debye model is applied to take into account the thermal effect. • The pressure and temperature up to about 100 GPa and 3000 K, respectively. - Abstract: Debye temperature, thermal expansion coefficient, and heat capacity of ideal stoichiometric TcC in the rocksalt structure have been studied systematically by using ab initio plane-wave pseudopotential density functional theory method within the generalized gradient approximation. Through the quasi-harmonic Debye model, in which the phononic effects are considered, the dependences of Debye temperature, thermal expansion coefficient, constant-volume heat capacity, and constant-pressure heat capacity on pressure and temperature are successfully predicted. All the thermodynamic properties of TcC with rocksalt phase have been predicted in the entire temperature range from 300 to 3000 K and pressure up to 100 GPa.

  13. Degradation Of Environmental Barrier Coatings (EBC) Due To Chemical and Thermal Expansion Incompatibility

    Science.gov (United States)

    Lee, Kang N.; King, Deboran (Technical Monitor)

    2001-01-01

    Current environmental barrier coatings (EBCs) consist of multiple layers, with each layer having unique properties to meet the various requirements for successful EBCs. As a result, chemical and thermal expansion compatibility between layers becomes an important issue to maintaining durability. Key constituents in current EBCs are mullite (3Al2O3-2SiO2), BSAS (BaO(1-x)-SrO(x)-Al2O3-2SiO2), and YSZ (ZrO2-8 wt.% Y2O3). The mullite-BSAS combination appears benign although significant diffusion occurs. Mullite-YSZ and BSAS-YSZ combinations do not react up to 1500 C. Thermally grown SiO2- BSAS and mullite-BSAS-YSZ combinations are most detrimental, forming low melting glasses. Thermal expansion mismatch between YSZ and mullite or BSAS causes severe cracking and delamination.

  14. Effect of high thermal expansion glass infiltration on mechanical properties of alumina–zirconia composite

    Indian Academy of Sciences (India)

    A Balakrishnan; B B Panigrahi; K P Sanosh; Min-Cheol Chu; T N Kim; Seong-Jai Cho

    2009-08-01

    This work studies the effect on the mechanical properties of alumina-10 wt% zirconia (3 mol% yttria stabilized) composite by infiltrating glass of a higher thermal expansion (soda lime glass) on the surface at high temperature. The glass improved the strength of composite at room temperature as well as at high temperature. This could be attributed to the drastic drop in the coefficient of thermal expansion due to the compositional change in the soda lime glass during infiltration. There was a significant improvement in the Weibull modulus after glass infiltration. Glass infiltrated samples showed better thermal shock resistance. The magnitude of strength increment was found to be in the order of the surface residual stress generated by thermo-elastic properties mismatch between the composite and the penetrated glass.

  15. EFFECTS OF HEAT TREATMENT ON THE THERMAL EXPANSION BEHAVIOR OF SiC WHISKER REINFORCED ALUMINUM COMPOSITE

    Institute of Scientific and Technical Information of China (English)

    M. Hu; W.D. Fei; W.L. Li; C.K. Yao

    2001-01-01

    The thermal expansion behaviors of SiC whisker reinforced commercially pure aluminum composites subjected to different heat treatments were studied. The results indicated that the thermal expansion behaviors were greatly affected by heat treatment.To explain the results, the microstructures and thermal mismatch stresses in the matrix of the composite were examined by the transmission electron microscope and Xray diffraction, respectively. The dislocation density and thermal mismatch stresses in the matrix of the composites water quenched from 600°C are much higher than that of the composite slowly cooled from 600°C. The analysis suggested that the coefficients of thermal expansion (CTE) are closely related to the change of thermal mismatch stresses and yield strength of the matrix of the composite. The comparison of the coefficients of thermal expansion between experiments and calculations suggested that the temperature behaviors of CTE of SiCw/Al composite agree better with those of Kerner's model within lower temperature range.

  16. Impact of metallophilicity on "colossal" positive and negative thermal expansion in a series of isostructural dicyanometallate coordination polymers.

    Science.gov (United States)

    Korcok, Jasmine L; Katz, Michael J; Leznoff, Daniel B

    2009-04-08

    Five isostructural dicyanometallate coordination polymers containing metallophilic interactions (In[M(CN)(2)](3) (M = Ag, Au), KCd[M(CN)(2)](3), and KNi[Au(CN)(2)](3)) were synthesized and investigated by variable-temperature powder X-ray diffraction to probe their thermal expansion properties. The compounds have a trigonal unit cell and show positive thermal expansion (PTE) in the ab plane, where Kagome sheets of M atoms reside, and negative thermal expansion (NTE) along the trigonal c axis, perpendicular to these sheets. The magnitude of thermal expansion is unusually large in all cases (40 x 10(-6) K(-1) thermal expansion of the series (alpha(a) = 105(2) x 10(-6) K(-1), alpha(c) = -84(2) x 10(-6) K(-1) at 295 K), while systems containing stronger Au-Au interactions show relatively reduced thermal expansion. Thus, it appears that strong metallophilic interactions hinder colossal thermal expansion behavior. Additionally, the presence of K(+) counterions also reduces the magnitude of thermal expansion.

  17. Abnormal thermal expansion properties of cubic NaZn13-type La(Fe,Al)13 compounds.

    Science.gov (United States)

    Li, Wen; Huang, Rongjin; Wang, Wei; Zhao, Yuqiang; Li, Shaopeng; Huang, Chuanjun; Li, Laifeng

    2015-02-28

    The cubic NaZn13-type La(Fe,Al)13 compounds were synthesized, and their linear thermal expansion properties were investigated in the temperature range of 4.2-300 K. It was found that these compounds exhibit abnormal thermal expansion behavior, i.e., pronounced negative thermal expansion (NTE) or zero thermal expansion (ZTE) behavior, below the Curie temperature due to the magnetovolume effect (MVE). Moreover, in the La(Fe,Al)13 compounds, the modification of the coefficient of thermal expansion (CTE) as well as the abnormal thermal expansion (ATE) temperature-window is achieved through optimizing the proportion of Fe and Al. Typically, the average CTE of the LaFe13-xAlx compounds with x = 1.8 reaches as large as -10.47 × 10(-6) K(-1) between 100 and 225 K (ΔT = 125 K). Also, the ZTE temperature-window of the LaFe13-xAlx compounds with x = 2.5 and x = 2.7 could be broadened to 245 K (from 5 to 250 K). Besides, the magnetic properties of these compounds were measured and correlated with the abnormal thermal expansion behavior. The present results highlight the potential application of such La(Fe,Al)13 compounds with abnormal thermal expansion properties in cryogenic engineering.

  18. Near-Zero Thermal Expansion and High Ultraviolet Transparency in a Borate Crystal of Zn4 B6 O13.

    Science.gov (United States)

    Jiang, Xingxing; Molokeev, Maxim S; Gong, Pifu; Yang, Yi; Wang, Wei; Wang, Shuaihua; Wu, Shaofan; Wang, Yingxia; Huang, Rongjin; Li, Laifeng; Wu, Yicheng; Xing, Xianran; Lin, Zheshuai

    2016-09-01

    Intrinsic isotropic near-zero thermal expansion is discovered in borate crystal Zn4 B6 O13 with high transparency in the ultraviolet region. First-principles calculations demonstrate that the very low thermal expansion originates mainly from the invariability of the solid [B24 O48 ] truncated octahedra that are fixed by the [Zn4 O13 ] clusters in the ZBO structure.

  19. Estimating the thermal expansion coefficient of graphene: the role of graphene-substrate interactions.

    Science.gov (United States)

    Shaina, P R; George, Lijin; Yadav, Vani; Jaiswal, Manu

    2016-03-02

    The temperature-dependent thermal expansion coefficient of graphene is estimated for as-grown chemical vapor deposited graphene using temperature-dependent Raman spectroscopy. For as-grown graphene on copper, the extent of thermal expansion mismatch between substrate and the graphene layer is significant across the entire measured temperature interval, T  =  90-300 K. This mismatch induces lattice strain in graphene. However, graphene grown on copper substrates has a unique morphology in the form of quasi-periodic nanoripples. This crucially influences the profile of the strain in the graphene membrane, which is uniaxial. An estimate of the thermal expansion coefficient of grapheme α(T) is obtained after consideration of this strain profile and after incorporating temperature-dependent Grüneisen parameter corrections. The value of α(T), is found to be negative (average value, -3.75  ×  10(-6) K(-1)) for the entire temperature range and it approaches close to zero for T  expansion and anharmonic contributions, and the data suggests limited interfacial interaction with the substrate.

  20. Faraday anomalous dispersion optical tuners

    Science.gov (United States)

    Wanninger, P.; Valdez, E. C.; Shay, T. M.

    1992-01-01

    Common methods for frequency stabilizing diode lasers systems employ gratings, etalons, optical electric double feedback, atomic resonance, and a Faraday cell with low magnetic field. Our method, the Faraday Anomalous Dispersion Optical Transmitter (FADOT) laser locking, is much simpler than other schemes. The FADOT uses commercial laser diodes with no antireflection coatings, an atomic Faraday cell with a single polarizer, and an output coupler to form a compound cavity. This method is vibration insensitive, thermal expansion effects are minimal, and the system has a frequency pull in range of 443.2 GHz (9A). Our technique is based on the Faraday anomalous dispersion optical filter. This method has potential applications in optical communication, remote sensing, and pumping laser excited optical filters. We present the first theoretical model for the FADOT and compare the calculations to our experimental results.

  1. Evolutionarily Conserved Pattern of Interactions in a Protein Revealed by Local Thermal Expansion Properties.

    Science.gov (United States)

    Dellarole, Mariano; Caro, Jose A; Roche, Julien; Fossat, Martin; Barthe, Philippe; García-Moreno E, Bertrand; Royer, Catherine A; Roumestand, Christian

    2015-07-29

    The way in which the network of intramolecular interactions determines the cooperative folding and conformational dynamics of a protein remains poorly understood. High-pressure NMR spectroscopy is uniquely suited to examine this problem because it combines the site-specific resolution of the NMR experiments with the local character of pressure perturbations. Here we report on the temperature dependence of the site-specific volumetric properties of various forms of staphylococcal nuclease (SNase), including three variants with engineered internal cavities, as measured with high-pressure NMR spectroscopy. The strong temperature dependence of pressure-induced unfolding arises from poorly understood differences in thermal expansion between the folded and unfolded states. A significant inverse correlation was observed between the global thermal expansion of the folded proteins and the number of strong intramolecular hydrogen bonds, as determined by the temperature coefficient of the backbone amide chemical shifts. Comparison of the identity of these strong H-bonds with the co-evolution of pairs of residues in the SNase protein family suggests that the architecture of the interactions detected in the NMR experiments could be linked to a functional aspect of the protein. Moreover, the temperature dependence of the residue-specific volume changes of unfolding yielded residue-specific differences in expansivity and revealed how mutations impact intramolecular interaction patterns. These results show that intramolecular interactions in the folded states of proteins impose constraints against thermal expansion and that, hence, knowledge of site-specific thermal expansivity offers insight into the patterns of strong intramolecular interactions and other local determinants of protein stability, cooperativity, and potentially also of function.

  2. Thermal expansion behavior of KZr2P3O12-SrZr4P6O24 ceramics

    Institute of Scientific and Technical Information of China (English)

    张彪; 郭景坤; 诸培南

    1996-01-01

    The relationships between thermal expansion and density,microcracking,stress and phase transition in K1/2Sr1/4Zr2P3O12(K2) and with K2 containing 2 mass fraction of MgO (K2M2) have been studied.The materials showed a little thermal expansion anisotropy,hysteresis,and microcracking Thermal shock-induced cracks resulted in a decrease of the coefficient of thermal expansion.Phase transition caused crack healing resulting in a decrease in specimen size.

  3. The effect of grain size and film thickness on the thermal expansion coefficient of copper thin films.

    Science.gov (United States)

    Hwang, Seulgi; Kim, Youngman

    2011-02-01

    Cu thin films underwent thermal cycling to determine their coefficient of thermal expansion (CTE). The thermal stress of the Cu thin films with various microstructures (different grain size and film thickness) was measured using a curvature measurement system. The thermal expansion coefficients of the films were obtained from the slope of the stress-temperature curve with the knowledge of the Young's modulus and Poisson's ratio. The change in thermal stress with temperature of the Cu thin films tended to decrease with increasing grain size, resulting in an increase in the CTE. The thickness of Cu thin film had little effect on the thermal stress or the CTE.

  4. Measurement of thermal expansion coefficient of graphene diaphragm using optical fiber Fabry-Perot interference

    Science.gov (United States)

    Li, Cheng; Liu, Qianwen; Peng, Xiaobin; Fan, Shangchun

    2016-07-01

    Application of the Fabry-Perot (FP) interference method for determining the coefficient of thermal expansion (CTE) of a graphene diaphragm is investigated in this paper. A miniature extrinsic FP interferometric (EFPI) sensor was fabricated by using an approximate 8-layer graphene diaphragm. The extremely thin diaphragm was transferred onto the endface of a ferrule with an inner diameter of 125 μm, and van der Waals interactions between the graphene diaphragm and its substrate created a low finesse FP interferometer with a cavity length of 36.13 μm. Double reference FP cavities using two cleaved optical fibers as reflectors were also constructed to differentially cancel the thermal expansion effects of the trapped gas and adhesive material. A temperature test demonstrated an approximate cavity length change of 166.1 nm °C-1 caused by film thermal expansion in the range of 20-60 °C. Then along with the established thermal deformation model of the suspended circular diaphragm, the calculated CTE ranging from  -9.98  ×  10-6 K-1 to  -2.09  ×  10-6 K-1 conformed well to the previously measured results. The proposed method would be applicable in other types of elastic materials as the sensitive diaphragm of an EFPI sensor over a wide temperature range.

  5. Large negative thermal expansion of a polymer driven by a submolecular conformational change.

    Science.gov (United States)

    Shen, Xingyuan; Viney, Christopher; Johnson, Erin R; Wang, Changchun; Lu, Jennifer Q

    2013-12-01

    Mechanoresponsive polymers hold great technological potential in drug delivery, 'smart' optical systems and microelectromechanical systems. However, hysteresis and fatigue (associated with large-scale polymer chain rearrangement) are often problematic. Here, we describe a polyarylamide film that contains s-dibenzocyclooctadiene (DBCOD), which can generate unconventional and completely reversible thermal contraction under low-energy stimulation. The films exhibit a giant negative thermal expansion coefficient of approximately -1,200 ppm K(-1) at ambient or near-ambient temperatures, much higher than any known negative-thermal-expansion materials under similar operating conditions. Mechanical characterization, calorimetry, spectroscopic analysis and density-functional theory calculations all point to the conformational change of the DBCOD moiety, from the thermodynamic global energy minimum (twist-boat) to a local minimum (chair), as the origin of this abnormal thermal shrinkage. This newly identified, low-energy-driven, thermally agile molecular subunit opens a new pathway to creating near-infrared-based macromolecular switches and motors, and for ambient thermal energy storage and conversion.

  6. Effects of in-plane stiffness and charge transfer on thermal expansion of monolayer transition metal dichalcogenide

    Institute of Scientific and Technical Information of China (English)

    王占雨; 周艳丽; 王雪青; 王飞; 孙强; 郭正晓; 贾瑜

    2015-01-01

    Temperature dependence of lattice constants is studied by using first-principles calculations to determine the effects of in-plane stiffness and charge transfer on the thermal expansions of monolayer semiconducting transition metal dichalco-genides. Unlike the corresponding bulk material, our simulations show that monolayer MX2 (M=Mo and W;X=S, Se, and Te) exhibits a negative thermal expansion at low temperatures, induced by the bending modes. Transition from con-traction to expansion at higher temperatures is observed. Interestingly, the thermal expansion can be tailored regularly by alteration of M or X atom. Detailed analysis shows that the positive thermal expansion coefficient is determined mainly by the in-plane stiffness, which can be expressed by a simple relationship. Essentially the regularity of this change can be attributed to the difference in charge transfer between the different elements. These findings should be applicable to other two-dimensional systems.

  7. Removal properties of low-thermal-expansion materials with rotating-sphere elastic emission machining

    Directory of Open Access Journals (Sweden)

    Masahiko Kanaoka et al

    2007-01-01

    Full Text Available Optical mirrors used in extreme ultraviolet lithography systems require a figure accuracy and a roughness of about 0.1 nm rms. In addition, mirror substrates must be low-thermal-expansion materials. Thus, in this study, we processed two low-thermal-expansion materials, ULE [K. Hrdina, B. Hanson, P. Fenn, R. Sabia, Proc. SPIE 4688 (2002 454.] (Corning Inc. and Zerodur [I. Mitra, M.J. Davis, J. Alkemper, Rolf Müller, H. Kohlmann, L. Aschke, E. Mörsen, S. Ritter, H. Hack, W. Pannhorst, Proc. SPIE 4688 (2002 462.] (SCHOTT AG, with elastic emission machining (EEM in order to evaluate the removal properties. Consequently, we successfully calculated the respective removal rates, because removal volumes were found to be proportional to process times in EEM. Moreover, we demonstrated that the surface roughness of Zerodur is reduced to 0.1 nm rms in the spatial wavelength range from 100 μm to 1 mm.

  8. Two-dimensional nanoscale correlations in the strong negative thermal expansion material ScF3

    Science.gov (United States)

    Handunkanda, Sahan U.; Occhialini, Connor A.; Said, Ayman H.; Hancock, Jason N.

    2016-12-01

    We present diffuse x-ray scattering data on the strong negative thermal expansion (NTE) material ScF3 and find that two-dimensional nanoscale correlations exist at momentum-space regions associated with possibly rigid rotations of the perovskite octahedra. We address the extent to which rigid octahedral motion describes the dynamical fluctuations behind NTE by generalizing a simple model supporting a single floppy mode that is often used to heuristically describe instances of NTE. We find this model has tendencies toward dynamic inhomogeneities and its application to recent and existing experimental data suggest an intricate link between the nanometer correlation length scale, the energy scale for octahedral tilt fluctuations, and the coefficient of thermal expansion in ScF3. We then investigate the breakdown of the rigid limit and propose a resolution to an outstanding debate concerning the role of molecular rigidity in strong NTE materials.

  9. Large magnetostriction and negative thermal expansion in the frustrated antiferromagnet ZnCr2Se4.

    Science.gov (United States)

    Hemberger, J; von Nidda, H-A Krug; Tsurkan, V; Loidl, A

    2007-04-06

    A detailed investigation of ZnCr2Se4 is presented which is dominated by strong ferromagnetic exchange but orders antiferromagnetically at TN=21 K. Specific heat and thermal expansion exhibit sharp first-order anomalies at the antiferromagnetic transition. TN is shifted to lower temperatures by external magnetic fields and finally is fully suppressed by a field of 65 kOe. The relative length change DeltaL/L(T) is unusually large and exhibits negative thermal expansion alpha below 75 K down to TN indicating strong frustration of the lattice. Magnetostriction DeltaL/L(H) reveals large values comparable to giant magnetostrictive materials. These results point to a spin-driven origin of the structural instability at TN explained in terms of competing ferromagnetic and antiferromagnetic exchange interactions.

  10. Preparation and Characteristic of Glass-Ceramics with Super Low Thermal Expansion Coefficient

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    The preparation technics of glass-ceramics with super low coefficient of thermal expansion containing β-quartz solid solution as a main crystal phase based on the glass in the system Li2O-Al2O3-SiO2 was introduced. The composition of base glass, technics of melting and heat treatment effecting on characteristic of glass-ceramics was described. Specimens were prepared by melting, anneal and controlled two steps heat treatment. Crystal phase, microstructure and elementary distributing were studied by using XRD, SEM and EDS respectively. Prepared specimens show excellent transparency and super low thermal expansion coefficient of 2×10-8 ·K-1, which reaches international advanced level.

  11. Influence of phosphorus on oxidation behavior of low thermal expansion superalloy IN909 at 650 ℃

    Institute of Scientific and Technical Information of China (English)

    SUN Ya-ru; SUN Wen-ru; HOU Gui-chen; GUO Shou-ren; LIU Zheng; HU Zhuang-qi; N. K. PARK

    2006-01-01

    The effect of phosphorus on the oxidation resistance of low thermal expansion alloy IN909 was studied. The composition and structure of the oxidation layer were analyzed. It is found that the oxidation initiates at the grain boundaries. During the oxidation, Fe atoms diffuse toward the surface and form the outside oxidation layer as the oxide of iron. The transition oxidation layer lies between the oxidation layer and the matrix which is enriched with Nb, Ti and Si, forming FeTiO5, Nb2O5, Fe2SiO4 and TiO2. Phosphorus hardly influences the thermal expansion coefficient of IN909 alloy. However, it increases the formation of ε phase at the boundary of the transition oxidation layer and matrix. As a result, the oxidation rate is decreased efficiently because the ε phase inhibits the diffusion of the element such as iron from the matrix to the oxidation layer.

  12. Buckling Behavior of Long Anisotropic Plates Subjected to Elastically Restrained Thermal Expansion and Contraction

    Science.gov (United States)

    Nemeth, Michael P.

    2004-01-01

    An approach for synthesizing buckling results for thin balanced and unbalanced symmetric laminates that are subjected to uniform heating or cooling and elastically restrained against thermal expansion or contraction is presented. This approach uses a nondimensional analysis for infinitely long, flexural anisotropic plates that are subjected to combined mechanical loads. In addition, stiffness-weighted laminate thermal-expansion parameters and compliance coefficients are derived that are used to determine critical temperatures in terms of physically intuitive mechanical-buckling coefficients. Many results are presented for some common laminates that are intended to facilitate a structural designer s transition to the use of the generic buckling design curves. Several curves that illustrate the fundamental parameters used in the analysis are presented, for nine contemporary material systems, that provide physical insight into the buckling response in addition to providing useful design data. Examples are presented that demonstrate the use of the generic design curves.

  13. Uniaxial Negative Thermal Expansion and Mechanical Properties of a Zinc-Formate Framework

    Directory of Open Access Journals (Sweden)

    Hongqiang Gao

    2017-02-01

    Full Text Available The thermal expansion behavior of a metal-formate framework, Zn(HCOO2·2(H2O (1, has been systematically studied via variable temperature single-crystal X-ray diffraction. Our results demonstrate that this formate exhibits significant negative thermal expansion (NTE, −26(2 MK−1 along its c-axis. Detailed structural analyses reveal that the large NTE response is attributed to the ‘hinge-strut’ like framework motion. In addition, the fundamental mechanical properties of framework 1 have been explored via nanoindentation experiments. The measured elastic modulus and hardness properties on the (00-2/(100/(110 facets are 35.5/35.0/27.1 and 2.04/1.83/0.47 GPa, respectively. The stiffness and hardness anisotropy can be correlated well with the underlying framework structure, like its thermoelastic behavior.

  14. Thermal expansion anomaly and spontaneous magnetostriction of Dy2AlFe14Mn2 compound

    Institute of Scientific and Technical Information of China (English)

    WANG Hai-yun; ZHAO Miao; GAO Yan; ZHOU Yan; FU Bin; YAN Da-li

    2006-01-01

    The structure and magnetic properties of Dy2AlFe14Mn2 compound were investigated by X-ray diffractometry and magnetization measurements. Dy2AlFe14Mn2 compound has a hexagonal Th2Ni17-type structure. Zero thermal expansion and negative thermal expansion were found in Dy2AlFe14Mn2 compound in the temperature range from 184 to 264 K, and from 264 to 383 K, respectively, by X-ray dilatometry. The spontaneous magnetostrictive deformations from 104 to 400 K were calculated. The results show that the spontaneous volume magnetostrictive deformation increases firstly with increasing temperature, and then decreases with furtther increasing temperature.

  15. Isobaric thermal expansivity behaviour against temperature and pressure of associating fluids

    Energy Technology Data Exchange (ETDEWEB)

    Navia, Paloma; Troncoso, Jacobo [Departamento de Fisica Aplicada, Facultad de Ciencias de Ourense, Campus As Lagoas, 32004 Ourense (Spain); Romani, Luis, E-mail: romani@uvigo.e [Departamento de Fisica Aplicada, Facultad de Ciencias de Ourense, Campus As Lagoas, 32004 Ourense (Spain)

    2010-01-15

    In order to study the influence of association on the isobaric thermal expansivity, this magnitude has been experimentally determined for a set of associating fluids within the temperature and pressure intervals (278.15 to 348.15) K and (5 to 55) MPa by means of calorimetric measurements. The 1-alcohol series, from methanol to 1-decanol, 2-pentanol, 3-pentanol, and 1-pentylamine were selected. With a view on checking the quality of the experimental data, they are compared with available literature values; good coherence was obtained for most of the studied liquids. The analysis of the experimental results reveals that the association capability presents a strong influence not only on the value of the isobaric thermal expansivity itself, but also on its behaviour against temperature and pressure.

  16. HAYNES 244 alloy – a new 760 ∘C capable low thermal expansion alloy

    Directory of Open Access Journals (Sweden)

    Fahrmann Michael G.

    2014-01-01

    Full Text Available HAYNES® 244TM alloy is a new 760∘C capable, high strength low thermal expansion (CTE alloy. Its nominal chemical composition in weight percent is Ni – 8 Cr – 22.5 Mo – 6 W. Recently, a first mill-scale heat of 244 alloy was melted by Haynes International, and processed to various product forms such as re-forge billet, plate, and sheet. This paper presents key attributes of this new alloy (CTE, strength, low-cycle fatigue performance, oxidation resistance, thermal stability as they pertain to the intended use in rings and seals of advanced gas turbines.

  17. Sound velocity of high-strength polymer with negative thermal expansion coefficient

    Energy Technology Data Exchange (ETDEWEB)

    Nomura, R.; Ueno, M.; Okuda, Y.; Burmistrov, S.; Yamanaka, A

    2003-05-01

    Sound velocities of fiber reinforced plastics (FRPs) were measured along the fiber axis at temperatures between 360 and 77 K. We used two kinds of the high-strength crystalline polymer fibers, polyethylene (Dyneema) and polybenzobisoxazole (Zylon), which have negative thermal expansion coefficients. They also have high thermal conductivities and high resistances for flash over voltage, and are expected as new materials for coil bobbins or spacers at cryogenic temperatures. They have very large sound velocities of about 9000 (m/s) at 77 K, which are 4.5 times larger than that of the ordinary polyethylene fiber.

  18. Thermal expansion in UO2 determined by high-energy X-ray diffraction

    Science.gov (United States)

    Guthrie, M.; Benmore, C. J.; Skinner, L. B.; Alderman, O. L. G.; Weber, J. K. R.; Parise, J. B.; Williamson, M.

    2016-10-01

    Here we present crystallographic analyses of high-energy X-ray diffraction data on polycrystalline UO2 up to the melting temperature. The Rietveld refinements of our X-ray data are in agreement with previous measurements, but are systematically located around the upper bound of their uncertainty, indicating a slightly steeper trend of thermal expansion compared to established values. This observation is consistent with recent first principles calculations.

  19. Thermal expansion of RFeAsO (R=La,Ce,Pr,Sm,Gd)

    Energy Technology Data Exchange (ETDEWEB)

    Klingeler, R; Wang, L; Koehler, U; Behr, G; Hess, C; Buechner, B, E-mail: r.klingeler@ifw-dresden.d [Institute for Solid State Research, IFW Dresden, D-01171 Dresden (Germany)

    2010-01-15

    We present measurements of the thermal expansion coefficient {alpha} of polycrystalline RFeAsO (R = La,Ce,Pr,Sm,Gd). Anomalies at the magnetic ordering transitions indicate a significant magneto-elastic coupling and a negative pressure dependence of T{sub N}. The structural transitions are associated by large anomalies in {alpha}. Rare earth magnetic ordering in CeFeAsO, PrFeAsO, and SmFeAsO yields large positive anomalies at low temperatures.

  20. Thermal expansion of the heavy-fermion superconductor UNi[sub 2]Al[sub 3

    Energy Technology Data Exchange (ETDEWEB)

    Modler, R. (Kernforschungszentrum Karlsruhe GmbH, INFP, Postfach 3640, D-76021 Karlsruhe (Germany)); Lang, M. (Institut fuer Festkoerperphysik, TH Darmstadt, Hochschulstr. 8, D-64289 Darmstadt (Germany)); Geibel, C. (Institut fuer Festkoerperphysik, TH Darmstadt, Hochschulstr. 8, D-64289 Darmstadt (Germany)); Schank, C. (Institut fuer Festkoerperphysik, TH Darmstadt, Hochschulstr. 8, D-64289 Darmstadt (Germany)); Steglich, F. (Institut fuer Festkoerperphysik, TH Darmstadt, Hochschulstr. 8, D-64289 Darmstadt (Germany))

    1994-04-01

    We have investigated the superconducting and the antiferromagnetic transition of polycrystalline UNi[sub 2]Al[sub 3] by means of high-resolution dilatometry. At T[sub c]=0.95 K and T[sub N]=4.6 K the thermal-expansion coefficient [alpha] shows second-order phase-transition anomalies of negative sign. Investigations of the antiferromagnetic transition under magnetic fields indicate a complex magnetic phase diagram reminiscent of that of the Pd homolog. ((orig.))

  1. Structural and Controllable Thermal Expansion Properties of Sc2-xAlxMo3O12

    Institute of Scientific and Technical Information of China (English)

    WU; Mei-mei; CHEN; Dong-feng

    2013-01-01

    Materials with controllable thermal expansion are the subject of fundamental studies because of the important applications in high-precision optical mirrors,fiber optic systems,and electronic materials.Samples Sc2-xAlxMo3O12(x=0.0,0.3,0.7,1.0,1.3,1.7,and 2.0)were prepared by the solid-state reaction,

  2. Phase transitions, prominent dielectric anomalies, and negative thermal expansion in three high thermally stable ammonium magnesium-formate frameworks.

    Science.gov (United States)

    Shang, Ran; Xu, Guan-Cheng; Wang, Zhe-Ming; Gao, Song

    2014-01-20

    We present three Mg-formate frameworks, incorporating three different ammoniums: [NH4][Mg(HCOO)3] (1), [CH3CH2NH3][Mg(HCOO)3] (2) and [NH3(CH2)4NH3][Mg2(HCOO)6] (3). They display structural phase transitions accompanied by prominent dielectric anomalies and anisotropic and negative thermal expansion. The temperature-dependent structures, covering the whole temperature region in which the phase transitions occur, reveal detailed structural changes, and structure-property relationships are established. Compound 1 is a chiral Mg-formate framework with the NH4(+) cations located in the channels. Above 255 K, the NH4(+) cation vibrates quickly between two positions of shallow energy minima. Below 255 K, the cations undergo two steps of freezing of their vibrations, caused by the different inner profiles of the channels, producing non-compensated antipolarization. These lead to significant negative thermal expansion and a relaxor-like dielectric response. In perovskite 2, the orthorhombic phase below 374 K possesses ordered CH3CH2NH3(+) cations in the cubic cavities of the Mg-formate framework. Above 374 K, the structure becomes trigonal, with trigonally disordered cations, and above 426 K, another phase transition occurs and the cation changes to a two-fold disordered state. The two transitions are accompanied by prominent dielectric anomalies and negative and positive thermal expansion, contributing to the large regulation of the framework coupled the order-disorder transition of CH3CH2NH3(+). For niccolite 3, the gradually enhanced flipping movement of the middle ethylene of [NH3(CH2)4NH3](2+) in the elongated framework cavity finally leads to the phase transition with a critical temperature of 412 K, and the trigonally disordered cations and relevant framework change, providing the basis for the very strong dielectric dispersion, high dielectric constant (comparable to inorganic oxides), and large negative thermal expansion. The spontaneous polarizations

  3. First-principles calculations of the diffusion of atomic oxygen in nickel: thermal expansion contribution.

    Science.gov (United States)

    Megchiche, E H; Amarouche, M; Mijoule, C

    2007-07-25

    Within the framework of density functional theory using the projector augmented-wave (PAW) method, we present some energetic properties of atomic oxygen interstitials in crystalline Ni, i.e. the insertion and activation energies of the O diffusion. Concerning the activation energy, two pathways for the migration process are studied. The charge transfer process between atomic oxygen and nickel atoms is analysed in the interstitial sites. We find that the interstitial octahedral site (O site) is lower in energy than the tetrahedral site (T site). The most favourable pathway for the migration between two octahedral sites corresponds to an intermediate metastable state located in a tetrahedral site. Concerning the charge transfers we find that the atomic oxygen ionizes as O(-) and that the electron migrates essentially from the Ni nearest neighbours of atomic oxygen. In addition, the thermal expansion contribution through the dilatation of the solid is studied. When the thermal expansion is introduced, we show that the insertion process is stabilized and that the tetrahedral insertion energy becomes nearly equal to the octahedral ones. However, the activation energy decreases with the dilatation. Taking into account the thermal expansion effects, our results are consistent with the more reliable experimental data.

  4. Buckling Behavior of Long Anisotropic Plates Subjected to Fully Restrained Thermal Expansion

    Science.gov (United States)

    Nemeth, Michael P.

    2003-01-01

    An approach for synthesizing buckling results and behavior for thin, balanced and unbalanced symmetric laminates that are subjected to uniform heating or cooling and which are fully-restrained against thermal expansion or contraction is presented. This approach uses a nondimensional analysis for infinitely long, flexurally anisotropic plates that are subjected to combined mechanical loads and is based on useful nondimensional parameters. In addition, stiffness-weighted laminate thermal-expansion parameters are derived and used to determine critical temperature changes in terms of physically intuitive mechanical buckling coefficients. The effects of membrane orthotropy and anisotropy are included. Many results are presented for some common laminates that are intended to facilitate a structural designer's transition to the use of the generic buckling design curves that are presented in the paper. Several generic buckling design curves are presented that provide physical insight into buckling response and provide useful design data. Examples are presented that demonstrate the use of generic design curves. The analysis approach and generic results indicate the effects and characteristics of laminate thermal expansion, membrane orthotropy and anisotropy, and flexural orthotropy and anisotropy in a very general, unifying manner.

  5. Buckling Behavior of Long Anisotropic Plates Subjected to Elastically Restrained Thermal Expansion

    Science.gov (United States)

    Nemeth, Michael P.

    2002-01-01

    An approach for synthesizing buckling results for, and behavior of, thin balanced and unbalanced symmetric laminates that are subjected to uniform heating or cooling and elastically restrained against thermal expansion or contraction is presented. This approach uses a nondimensional analysis for infinitely long, flexurally anisotropic plates that are subjected to combined mechanical loads and is based on useful nondimensional parameters. In addition, stiffness-weighted laminate thermal-expansion parameters and compliance coefficients are derived that are used to determine critical temperatures in terms of physically intuitive mechanical-buckling coefficients. The effects of membrane orthotropy and membrane anisotropy are included in the general formulation. Many results are presented for some common laminates that are intended to facilitate a structural designer's transition to the use of generic buckling design curves. Several curves that illustrate the fundamental parameters used in the analysis are presented, for nine contemporary material systems, that provide physical insight into the buckling response in addition to providing useful design data. Examples are presented that demonstrate the use of generic design curves. The analysis approach and generic results indicate the effects and characteristics of elastically restrained laminate thermal expansion or contraction, membrane orthotropy and anisotropy, and flexural orthotropy and anisotropy in a very general and unifying manner.

  6. Modeling of the thermal expansion behaviour of ZERODUR at arbitrary temperature profiles

    Science.gov (United States)

    Jedamzik, Ralf; Johansson, Thoralf; Westerhoff, Thomas

    2010-07-01

    Modeling of the thermal expansion behavior of ZERODUR® for the site conditions of the upcoming Extremely Large Telescope's (ELT's) allows an optimized material selection to yield the best performing ZERODUR® for the mirror substrates. The thermal expansion of glass ceramics is a function of temperature and a function of time, due to the structural relaxation behavior of the materials. The application temperature range of the upcoming ELT projects varies depending on the possible construction site between -13°C and +27°C. Typical temperature change rates during the night are in the range between 0.1°C/h and 0.3°C/h. Such temperature change rates are much smaller than the typical economic laboratory measurement rate, therefore the material behavior under these conditions can not be measured directly. SCHOTT developed a model approach to describe the structural relaxation behavior of ZERODUR®. With this model it is possible to precisely predict the thermal expansion behavior of the individual ZERODUR® material batches at any application temperature profile T(t). This paper presents results of the modeling and shows ZERODUR® material behavior at typical temperature profiles of different applications.

  7. Negative thermal expansion due to negative area compressibility in TlGaSe2 semiconductor with layered crystalline structure

    Science.gov (United States)

    Seyidov, MirHasan Yu.; Suleymanov, Rauf A.

    2010-09-01

    We conducted comparison of the original experimental data of the temperature dependences of thermal expansion in crystals with layered crystalline structure. It is shown that in most crystals with layered structure (graphite, boron nitride, GaSe, GaS, and InSe) the effect of negative thermal expansion can be explained by the specific character of the phonon spectra. It was shown, that in contrast to other crystals with layered structure, negative thermal expansion in the layers' plane of TlGaSe2 is the result of negative area compressibility. We demonstrate that the thermal expansion of TlGaSe2 crystals can be controlled by illumination, external electric field, and thermal annealing. The nature of observed effects and a special mechanism of the negative area compressibility in TlGaSe2 crystals are discussed.

  8. Novel quantum criticality in CeRu2Si2 near absolute zero observed by thermal expansion and magnetostriction.

    Science.gov (United States)

    Yoshida, J; Abe, S; Takahashi, D; Segawa, Y; Komai, Y; Tsujii, H; Matsumoto, K; Suzuki, H; Onuki, Y

    2008-12-19

    We report linear thermal expansion and magnetostriction measurements for CeRu2Si2 in magnetic fields up to 52.6 mT and at temperatures down to 1 mK. At high temperatures, this compound showed Landau-Fermi-liquid behavior: The linear thermal expansion coefficient and the magnetostriction coefficient were proportional to the temperature and magnetic field, respectively. In contrast, a pronounced non-Fermi-liquid effect was found below 50 mK. The negative contribution of thermal expansion and magnetostriction suggests the existence of an additional quantum critical point.

  9. Micromechanical Modeling of the Thermal Expansion of Graphite/copper Composites with Nonuniform Microstructure

    Science.gov (United States)

    Bednarcyk, Brett A.; Pindera, Marek-Jerzy

    1994-01-01

    Two micromechanical models were developed to investigate the thermal expansion of graphite/copper (Gr/Cu) composites. The models incorporate the effects of temperature-dependent material properties, matrix inelasticity, initial residual stresses due to processing history, and nonuniform fiber distribution. The first model is based on the multiple concentric cylinder geometry, with each cylinder treated as a two-phase composite with a characteristic fiber volume fractions. By altering the fiber volume fraction of the individual cylinders, unidirectional composites with radially nonuniform fiber distributions can be investigated using this model. The second model is based on the inelastic lamination theory. By varying the fiber content in the individual laminae, composites with nonuniform fiber distribution in the thickness direction can be investigated. In both models, the properties of the individual regions (cylinders or laminae) are calculated using the method of cells micromechanical model. Classical incremental plasticity theory is used to model the inelastic response of the copper matrix at the microlevel. The models were used to characterize the effects of nonuniform fiber distribution on the thermal expansion of Gr/Cu. These effects were compared to the effects of matrix plasticity, choice of stress-free temperature, and slight fiber misalignment. It was found that the radially nonuniform fiber distribution has little effect on the thermal expansion of Gr/Cu but could become significant for composites with large fiber-matrix transverse CTE and Young's modulus mismatch. The effect of nonuniform fiber distribution in the through-thickness direction of a laminate was more significant, but only approached that of the stress-free temperature for the most extreme cases that include large amounts of bending. Subsequent comparison with experimental thermal expansion data indicated the need for more accurate characterization of the graphite fiber thermomechanical

  10. Influence of an anomalous dimension effect on thermal instability in amorphous-InGaZnO thin-film transistors

    Energy Technology Data Exchange (ETDEWEB)

    Liu, Kuan-Hsien; Chou, Wu-Ching, E-mail: tcchang3708@gmail.com, E-mail: wuchingchou@mail.nctu.edu.tw [Department of Electrophysics, National Chiao Tung University, Hsin-chu 300, Taiwan (China); Chang, Ting-Chang, E-mail: tcchang3708@gmail.com, E-mail: wuchingchou@mail.nctu.edu.tw [Department of Physics, National Sun Yat-Sen University, Kaohsiung 804, Taiwan (China); Advanced Optoelectronics Technology Center, National Cheng Kung University, Taiwan (China); Chen, Hua-Mao; Tai, Ya-Hsiang [Department of Photonics and Institute of Electro-Optical Engineering, National Chiao Tung University, Hsin-chu 300, Taiwan (China); Tsai, Ming-Yen; Hung, Pei-Hua; Chu, Ann-Kuo [Department of Photonics, National Sun Yat-Sen University, Kaohsiung 804, Taiwan (China); Wu, Ming-Siou; Hung, Yi-Syuan [Department of Electronics Engineering, National Chiao Tung University, Hsin-Chu 300, Taiwan (China); Hsieh, Tien-Yu [Department of Physics, National Sun Yat-Sen University, Kaohsiung 804, Taiwan (China); Yeh, Bo-Liang [Advanced Display Technology Research Center, AU Optronics, No.1, Li-Hsin Rd. 2, Hsinchu Science Park, Hsin-Chu 30078, Taiwan (China)

    2014-10-21

    This paper investigates abnormal dimension-dependent thermal instability in amorphous indium-gallium-zinc-oxide (a-IGZO) thin-film transistors. Device dimension should theoretically have no effects on threshold voltage, except for in short channel devices. Unlike short channel drain-induced source barrier lowering effect, threshold voltage increases with increasing drain voltage. Furthermore, for devices with either a relatively large channel width or a short channel length, the output drain current decreases instead of saturating with an increase in drain voltage. Moreover, the wider the channel and the shorter the channel length, the larger the threshold voltage and output on-state current degradation that is observed. Because of the surrounding oxide and other thermal insulating material and the low thermal conductivity of the IGZO layer, the self-heating effect will be pronounced in wider/shorter channel length devices and those with a larger operating drain bias. To further clarify the physical mechanism, fast I{sub D}-V{sub G} and modulated peak/base pulse time I{sub D}-V{sub D} measurements are utilized to demonstrate the self-heating induced anomalous dimension-dependent threshold voltage variation and on-state current degradation.

  11. Gene expression under thermal stress varies across a geographical range expansion front.

    Science.gov (United States)

    Lancaster, Lesley T; Dudaniec, Rachael Y; Chauhan, Pallavi; Wellenreuther, Maren; Svensson, Erik I; Hansson, Bengt

    2016-03-01

    Many ectothermic species are currently expanding their distributions polewards due to anthropogenic global warming. Molecular genetic mechanisms facilitating range expansion under these conditions are largely unknown, but understanding these could help mitigate expanding pests and disease vectors, or help explain why some species fail to track changing climates. Here, using RNA-seq data, we examine genomewide changes in gene expression under heat and cold stress in the range-expanding damselfly Ischnura elegans in northern Europe. We find that both the number of genes involved and levels of gene expression under heat stress have become attenuated during the expansion, consistent with a previously reported release from selection on heat tolerances as species move polewards. Genes upregulated under cold stress differed between core and edge populations, corroborating previously reported rapid adaptation to cooler climates at the expansion front. Expression of sixty-nine genes exhibited a region x treatment effect; these were primarily upregulated in response to heat stress in core populations but in response to cold stress at the range edge, suggesting that some cellular responses originally adapted to heat stress may switch to cold-stress functionality upon encountering novel thermal selection regimes during range expansion. Transcriptional responses to thermal stress involving heat-shock and neural function genes were largely geographically conserved, while retrotransposon, regulatory, muscle function and defence gene expression patterns were more variable. Flexible mechanisms of cold-stress response and the ability of some genes to shift their function between heat and cold stress might be key mechanisms facilitating rapid poleward expansion in insects.

  12. Cold Thermal Anomalous Structure within Lower Mantle and Its Geodynamic Implications

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The lateral temperature anomalous structure of the lower mantle is reconstructed from the seismic tomographical model and high temperature and high pressure laboratory results. A significant correlation between the distribution of the cold anomaly and the location of past subduction belts shows that the shallower anomaly corresponds to the younger subduction sites, while the deeper anomaly to the older ones. This correlation also suggests that the cold anomaly may have come from the subduction slabs and the scale of mantle convection may have been completed. The coldest and largest anomaly is concentrated near the core-mantle boundary (CMB). Few cold anomalies float in the shallower and middle parts of the lower mantle, suggesting that the downward migration of the subduction slabs, discontinuous and step-like, may be divided into the following three stages: subduction, stagnation at the 670 km discontinuity due to the phase transition, and disintegration when the size exceeds the critical point.

  13. CP: AN INVESTIGATION OF COEFFICIENT OF THERMAL EXPANSION, DECOMPOSITION KINETICS, AND REACTION TO VARIOUS STIMULI

    Energy Technology Data Exchange (ETDEWEB)

    Weese, R K; Burnham, A K; Fontes, A T

    2005-03-23

    The properties of pentaamine (5-cyano-2H-tetrazolato-N2) cobalt (III) perchlorate (CP), which was first synthesized in 1968, continues to be of interest for predicting behavior in handling, shipping, aging, and thermal cook-off situations. We report coefficient of thermal expansion (CTE) values over four specific temperature ranges, decomposition kinetics using linear heating rates, and the reaction to three different types of stimuli: impact, spark, and friction. The CTE was measured using a Thermal Mechanical Analyzer (TMA) for samples that were uniaxially compressed at 10,000 psi and analyzed over a dynamic temperature range of -20 C to 70 C. Using differential scanning calorimetry, DSC, CP was decomposed at linear heating rates of 1, 3, and 7 C/min and the kinetic triplet calculated using the LLNL code Kinetics05. Values are also reported for spark, friction, and impact sensitivity.

  14. Microstructure and thermal expansion properties of invar-type Cu-Zn-Al shape memory alloys

    Science.gov (United States)

    Wang, J. J.; Omori, T.; Sutou, Y.; Kainuma, R.; Ishida, K.

    2004-10-01

    The effects of grain size, volume fraction of the α (fcc) phase in the β (bcc) matrix, and thermal stability on low thermal expansion (LTE) properties of Cu-Zn-Al shape memory (SM) alloys induced by cold rolling were investigated by dilatometry, optical microscopy, differential scanning calorimetry, and electrical conductivity measurements. The alloys with the larger grains showed a superior two-way memory (TWM) effect, wider LTE temperature intervals with excellent thermal stability under 80°C. The α+β two-phase alloys also exhibited a good combination of cold workability and LTE properties. These results suggest that the Cu-Zn-Al alloys with high electrical conductivity of about 20% International Annealed Copper Standard (%IACS) have high potential as a new class of Invar alloys that can be applied in various fields.

  15. Computational modeling and relevance of numerical convergence for the investigation of thermal expansion behavior for aluminium hybrid composites

    Science.gov (United States)

    Krishna, S. A. Mohan; Shridhar, T. N.; Krishnamurthy, L.

    2016-06-01

    The thermal characterization and analysis of composite materials has been increasingly important in a wide range of applications. The coefficient of thermal expansion (CTE) is one of the most important properties of metal matrix composites (MMCs). Since nearly all MMCs are used in various temperature ranges, measurement of CTE as a function of temperature is necessary in order to know the behavior of the material. In this research paper, the evaluation of CTE or thermal expansivity has been accomplished for Al 6061, silicon carbide and graphite hybrid MMCs from room temperature to 300∘C. Aluminium-based composites reinforced with silicon carbide and graphite particles have been prepared by stir casting technique. The thermal expansivity behavior of hybrid composites with different percentage compositions of reinforcements has been investigated. The results have indicated that the thermal expansivity of different compositions of hybrid MMCs decrease by the addition of graphite with silicon carbide and Al 6061. Empirical models have been validated for the evaluation of thermal expansivity of composites. Numerical convergence test has been accomplished to investigate the thermal expansion behavior of composites.

  16. Expansion Coefficient on Oxides and Oxide Ceramics.

    Science.gov (United States)

    1986-05-01

    Ferroelectrics )," Ph.D. thesis submitted to the Indian Institute of Science, Bangalore- 12, (1969). 29. B. Alefeld. "The Change of Lattice Parameters of...Kamenetskii. "Anomalous Thermal Expansion of ZrO2 and HfO2 Over the Range 20-1200 0 C," Soy. Phy.-Cryst., 14 (1970) pp. 696-99. 89. A. K. Sreedhar. "Thermal...D. Gac. "Axial and Linear Thermal Expansion of ZrO 2 and HfO2 ," Am. Ceram. Soc. RuZl. 60(4) (1981), pp. 504-506. 167. R. Ruh, G. W. Hollenberg, E

  17. Polyglutamine expansion in Drosophila: thermal stress and Hsp70 as selective agents

    Indian Academy of Sciences (India)

    Brian R Bettencourt; Catherine C Hogan; Mario Nimali

    2007-04-01

    Repetitive DNA sequences that encode polyglutamine tracts are prone to expansion and cause highly deleterious phenotypes of neurodegeneration. Despite this tendency, polyglutamine tracts (``polyQs”) are conserved features of eukaryotic genomes. PolyQs are the most frequent protein-coding homotypic repeat in insect genomes, and are found predominantly in genes encoding transcription factors conserved from Drosophila through human. Although highly conserved across species, polyQ lengths vary widely within species. In D. melanogaster, polyQs in 25 genes have more alleles and higher heterozygosity than all other poly-amino acid tracts. The heat shock protein Hsp70 is a principal suppressor of polyQ expansions and may play a key role in modulating the phenotypes of the alleles that encode them. Hsp70 also promotes tolerance of natural thermal stress in Drosophila and diverse organisms, a role which may deplete the chaperone from buffering against polyQ toxicity. Thus in stressful environments, natural selection against long polyQ alleles more prone to expansion and deleterious phenotypes may be more effective. This hypothesis can be tested by measuring the phenotypic interactions between Hsp70 and polyQ transgenes in D. melanogaster undergoing natural thermal stress, an approach which integrates comparative genomics with experimental and ecological genetics.

  18. Ab initio investigation of the anomalous phonon softening in FeSi

    Science.gov (United States)

    Stern, Robin; Madsen, Georg K. H.

    2016-10-01

    The anomalous softening of the acoustic phonon peak in FeSi has recently received considerable experimental attention. In our work, we investigate the effect of thermal disorder on the lattice dynamics and the filling of the narrow band gap of FeSi using density functional theory. We show, by comparing the phonon density of states from temperature-independent and temperature-dependent force constants, that thermal structural disorder together with thermal expansion explains the anomalously strong renormalization of the acoustic phonons. Furthermore, we find an intricate interplay between thermal disorder and volume in gap closure.

  19. Prototype of low thermal expansion materials: fabrication of mesoporous silica/polymer composites with densely filled polymer inside mesopore space.

    Science.gov (United States)

    Kiba, Shosuke; Suzuki, Norihiro; Okawauchi, Yoshinori; Yamauchi, Yusuke

    2010-09-03

    A prototype of novel low thermal expansion materials using mesoporous silica particles is demonstrated. Mesoporous silica/polymer composites with densely filled polymer inside the mesopore space are fabricated by mechanically mixing both organically modified mesoporous silica and epoxy polymer. The mesopores are easily penetrated by polymers as a result of the capillary force during the mechanical composite processing. Furthermore, we propose a new model of polymer mobility restriction using mesoporous silica with a large pore space. The robust inorganic frameworks covering the polymer effectively restrict the polymer mobility against thermal energy. As a result, the degree of total thermal expansion of the composites is drastically decreased. From the mass-normalized thermal mechanical analysis (TMA) charts of various composites with different amounts of mesoporous silica particles, it is observed that the coefficient of thermal expansion (CTE) values gradually increase with an increase of the polymer amount outside the mesopores. It is proven that the CTE values in the range over the glass-transition temperatures (T(g)) are perfectly proportional to the outside polymer amounts. Importantly, the Y-intercept of the relation equation obtained by a least-square method is the CTE value and is almost zero. This means that thermal expansion does not occur if no polymers are outside the mesopores. Through such a quantative discussion, we clarify that only the outside polymer affects the thermal expansion of the composites, that is, the embedded polymers inside the mesopores do not expand at all during the thermal treatment.

  20. Determination of the Thermal Expansion Coefficient of Concrete at Early Ages by Using Temperature-stress Testing Machine

    Institute of Scientific and Technical Information of China (English)

    HUO Kaicheng; SHUI Zhonghe; LI Yue

    2006-01-01

    By using the uptodate temperatuer-stress testing machine, the thermal expansion coefficient of concrete at early ages was studied and indicative conclusions were achieved: temperature rising due to hydration heat is not directly correlated with cracking, but the temperature and stress evolution process should be taken into consideration in the same time. Proper chemical admixtures and mineral compositions can improve the mechanical properties of concrete such as thermal expansion coefficient, which is very indicative in practice.

  1. Utilizing thermal isostasy to estimate sub-lithospheric heat flow and anomalous crustal radioactivity

    Science.gov (United States)

    Hasterok, D.; Gard, M.

    2016-09-01

    While surface heat flow relates to the heat loss through the lithosphere, it can be difficult to quantify and separate the heat produced internally through radiogenic decay from the heat transferred across the base of the lithosphere by mantle convection. In this study, we apply a thermo-isostatic analysis to Australia and estimate the sub-lithospheric and radiogenic heat flow components by employing a simple 1-D conservation of energy model. We estimate an anomalous radiogenic heat production across much of eastern Australia generally accounting for >50 mW m-2, while western Australia appears to have high crustal compositionally corrected elevation, possibly related to chemical buoyancy of the mantle lithosphere. A moderately high sub-lithospheric heat flow (∼40 mW m-2) along the eastern and southeastern coast, including Tasmania, is coincident with locations of Cenozoic volcanism and supports an edge-driven convection hypothesis. However, the pattern of sub-lithospheric heat flow along the margin does not support the existence of hotspot tracks. Thermo-isostatic models such as these improve our ability to identify and quantify crustal from mantle sources of heat loss and add valuable constraints on tectonic and geodynamic models of the continental lithosphere's physical state and evolution.

  2. Thermal expansion of slag and fly ash from coal gasification in IGCC power plant

    Energy Technology Data Exchange (ETDEWEB)

    M. Aineto; A. Acosta; J.M.A. Rincon; M. Romero [University of Castilla La Mancha, Ciudad Real (Spain). Laboratory of Applied Mineralogy

    2006-11-15

    Integrated gasification in combined cycle (IGCC) is an electrical power generation system which is characterized to be a clean coal technology different than conventional process in combustible treatment. IGCC process gives rise to inorganic solid wastes in the form of vitreous slag and fly ashes with singular thermal properties. The gasification of the fuel takes place at high temperature and pressure in reducing atmosphere. Under that conditions, gases such as H{sub 2}, N{sub 2} or CO, which are the main components of the gas mixture in the gasifier, show a high solubility in the melt and during the cooling remain enclosed in the vitreous slag. When these wastes are afterward thermal treated in oxidizing conditions, two phenomena occur. The development of a crystalline phase by devitrification of the glassy matrix and the releasing of the enclosed gas, which starts at temperatures nearly to the softening point. At higher temperatures the bubbles with increasing kinetic energy tend to ascend with difficulty through the viscous liquid phase and promotes an expansive reaction, giving rise to a foam glass-ceramic product. This paper has been focused on the study of thermal expansion in slag and fly ash samples from the ELCOGAS IGCC power plant located in Puertollano (Spain). 18 refs., 11 figs., 1 tab.

  3. Zirconium tungstate/epoxy nanocomposites: effect of nanoparticle morphology and negative thermal expansivity.

    Science.gov (United States)

    Wu, Hongchao; Rogalski, Mark; Kessler, Michael R

    2013-10-09

    The ability to tailor the coefficient of thermal expansion (CTE) of a polymer is essential for mitigating thermal residual stress and reducing microcracks caused by CTE mismatch of different components in electronic applications. This work studies the effect of morphology and thermal expansivity of zirconium tungstate nanoparticles on the rheological, thermo-mechanical, dynamic-mechanical, and dielectric properties of ZrW2O8/epoxy nanocomposites. Three types of ZrW2O8 nanoparticles were synthesized under different hydrothermal conditions and their distinct properties were characterized, including morphology, particle size, aspect ratio, surface area, and CTE. Nanoparticles with a smaller particle size and larger surface area led to a more significant reduction in gel-time and glass transition temperature of the epoxy nanocomposites, while a higher initial viscosity and significant shear thinning behavior was found in prepolymer suspensions containing ZrW2O8 with larger particle sizes and aspect ratios. The thermo- and dynamic-mechanical properties of epoxy-based nanocomposites improved with increasing loadings of the three types of ZrW2O8 nanoparticles. In addition, the introduced ZrW2O8 nanoparticles did not negatively affect the dielectric constant or the breakdown strength of the epoxy resin, suggesting potential applications of ZrW2O8/epoxy nanocomposites in the microelectronic insulation industry.

  4. Thermal expansion and swelling of cured epoxy resin used in graphite/epoxy composite materials

    Science.gov (United States)

    Adamson, M. J.

    1980-01-01

    The paper presents results of experiments in which the thermal expansion and swelling behavior of an epoxy resin system and two graphite/epoxy composite systems exposed to water were measured. It was found that the cured epoxy resin swells by an amount slightly less than the volume of the absorbed water and that the swelling efficiency of the water varies with the moisture content of the polymer. Additionally, the thermal expansion of cured epoxy resin that is saturated with water is observed to be more than twice that of dry resin. Results also indicate that cured resin that is saturated with 7.1% water at 95 C will rapidly increase in moisture content to 8.5% when placed in 1 C water. The mechanism for this phenomenon, termed reverse thermal effect, is described in terms of a slightly modified free-volume theory in conjunction with the theory of polar molecule interaction. Nearly identical behavior was observed in two graphite/epoxy composite systems, thus establishing that this behavior may be common to all cured epoxy resins.

  5. Fabrication and properties of polyimide composites filled with zirconium tungsten phosphate of negative thermal expansion

    Energy Technology Data Exchange (ETDEWEB)

    Shi, XinWei, E-mail: Shixw@zzu.edu.cn [School of Physical Science & Engineering, Zhengzhou University, 100th Science Road, Zhengzhou 450001 (China); Lian, Hong; Yan, XiaoSheng; Qi, Ruiqiong; Yao, Ning [School of Physical Science & Engineering, Zhengzhou University, 100th Science Road, Zhengzhou 450001 (China); Li, Tao [Department of Technology & Physics, Zhengzhou University of Lightindustry, 5th Dongfeng Road, Zhengzhou 450002 (China)

    2016-08-15

    Negative thermal expansion Zr{sub 2}WP{sub 2}O{sub 12} (ZWP) powder prepared by hydrothermal method was used as fillers to tailor the thermal expansion coefficient (TEC) of the polyimide (PI)-based composites. A series of PI-based composites containing different loading (0–40 wt% or 0–19.6 vol%) of ZWP powder were fabricated by the in-situ polymerization technique. Their structures and properties were characterized by Scanning electron microscope (SEM), Fourier transform infrared spectroscopy (FTIR), Impedance meter, Thermal mechanical analysis (TMA) and Thermogravimetric analysis (TGA). The additions of ZWP steadily reduced the TEC of the PI matrix at all loadings studied. A 40 wt% (19.6 vol%) ZWP loading gives a 32.5% (about 15 × 10{sup −6}/K) reduction of TEC. The thermal stability of the ZWP/PI composites can be enhanced with the increment of ZWP powder. The independence of the dielectric constant on frequency is improved by introduction of ZWP particles to PIs. The dielectric loss displays good stability, which indicates that the ZWP/PI composites show potential applications in microelectronic and aerospace industries. - Graphical abstract: With increasing of ZWP in the composites, the CTEs of the ZWP/PI were reduced. A 40 wt% (19.6 vol%) ZWP loading gives a 32.5% (about 15 × 10{sup −6}/K) reduction of CTE of the composite. - Highlights: • Zr{sub 2}P{sub 2}WO{sub 12} was firstly used as filler to tune the TEC of polyimides. • The TECs of polyimides were reduced by introduction of Zr{sub 2}P{sub 2}WO{sub 12} powders. • Polyimides with reduced TECs have favorable thermal and dielectric properties.

  6. Fabrication of mesoporous silica/polymer composites through solvent evaporation process and investigation of their excellent low thermal expansion property.

    Science.gov (United States)

    Suzuki, Norihiro; Kiba, Shosuke; Yamauchi, Yusuke

    2011-03-21

    We fabricate mesoporous silica/epoxy polymer composites through a solvent evaporation process. The easy penetration of the epoxy polymers into mesopores is achieved by using a diluted polymer solution including a volatile organic solvent. After the complete solvent evaporation, around 90% of the mesopores are estimated to be filled with the epoxy polymer chains. Here we carefully investigate the thermal expansion behavior of the obtained mesoporous silica/polymer composites. Thermal mechanical analysis (TMA) charts revealed that coefficient of linear thermal expansion (CTE) gradually decreases, as the amount of the doped mesoporous silica increases. Compared with spherical silica particle without mesopores, mesoporous silica particles show a greater effect on lowering the CTE values. Interestingly, it is found that the CTE values are proportionally decreased with the decrease of the total amount of the polymers outside the mesopores. These data demonstrate that polymers embedded inside the mesopores become thermally stable, and do not greatly contribute to the thermal expansion behavior of the composites.

  7. Method of Producing Controlled Thermal Expansion Coat for Thermal Barrier Coatings

    Science.gov (United States)

    Brindley, William J. (Inventor); Miller, Robert A. (Inventor); Aikin, Beverly J. M. (Inventor)

    2000-01-01

    An improved thermal barrier coating and method for producing and applying such is disclosed herein. The thermal barrier coatings includes a high temperature substrate, a first bond coat layer applied to the substrate of MCrAlX and a second bond coat layer of MCrAlX with particles of a particulate dispersed throughout the MCrAlX and the preferred particulate is Al2O3. The particles of the particulate dispersed throughout the second bond coat layer preferably have a diameter of less then the height of the peaks of the second bond coat layer or a diameter of less than 5 micron. The method of producing the second bond coat layer may either include the steps of mechanical alloying of particles throughout the second bond coat layer, attrition milling the particles of the particulate throughout the second bond coat layer, or using electrophoresis to disperse the particles throughout the second bond coat layer. In the preferred embodiment of the invention the first bond coat layer is applied to the substrate. and then the second bond coat layer is thermally sprayed onto the first bond coat layer. Further, in a preferred embodiment of the invention a ceramic insulating layer covers the second bond coat layer.

  8. Anisotropic Thermal Expansion of Zirconium Diboride: An Energy-Dispersive X-Ray Diffraction Study

    Directory of Open Access Journals (Sweden)

    William A. Paxton

    2016-01-01

    Full Text Available Zirconium diboride (ZrB2 is an attractive material due to its thermal and electrical properties. In recent years, ZrB2 has been investigated as a superior replacement for sapphire when used as a substrate for gallium nitride devices. Like sapphire, ZrB2 has an anisotropic hexagonal structure which defines its directionally dependent properties. However, the anisotropic behavior of ZrB2 is not well understood. In this paper, we use energy-dispersive synchrotron X-ray diffraction to measure the thermal expansion of polycrystalline ZrB2 powder from 300 to 1150 K. Nine Bragg reflections are fit using Pseudo-Voigt peak profiles and used to compute the a and c lattice parameters using a nonlinear least-squares approximation. The temperature-dependent instantaneous thermal expansion coefficients are determined for each a-axis and c-axis direction and are described by the following equations: αa = (4.1507×10-6 + 5.1086 × 10-9(T-293.15/(1+4.1507 × 10-6(T-293.15 + 2.5543×10-9(T-293.152 and αc = (4.5374×10-6 + 4.3004×10-9(T-293.15/(1+4.5374×10-6(T-293.15 + 2.1502×10-9(T-293.152. Our results are within range of previously reported values but describe the temperature anisotropy in more detail. We show that anisotropic expansion coefficients converge to the same value at about 780 K and diverge at higher temperatures. Results are compared with other reported values.

  9. Characterization and thermal expansion of Sr2Fe Mo2−O6 double perovskites

    Indian Academy of Sciences (India)

    Y Markandeya; Y Suresh Reddy; Shashidhar Bale; C Vishnuvardhan Reddy; G Bhikshamaiah

    2015-10-01

    Double perovskite oxides Sr2FeMo2−O6 ( = 0.8, 1.0, 1.2, 1.3 and 1.4) (SFMO) of different compositions were prepared by sol–gel growth followed by annealing under reducing atmosphere conditions of H2/Ar flow. X-ray powder diffraction studies revealed that the crystal structure of the samples changes from tetragonal to cubic at around = 1.2. Lattice parameters and unit cell volume of these samples found to decrease with the increase in Fe content. The characteristics absorption bands observed in the range 400–1000 cm−1 of Fourier transform infrared spectra indicate the presence of FeO6 and MoO6 octahedra and confirm the formation of double perovskite phase. The value of g ∼ 2.00 obtained from electron spin resonance studies indicates that Fe is in 3+ ionic state in the SFMO samples. Dilatometric studies of these samples reveal that the average value of coefficient of thermal expansion ($\\overline{\\alpha}$) increases with the increase in temperature or Fe content in SFMO samples. The low value of coefficient of thermal expansion 1.31 × 10−6°C−1 obtained for Sr2Fe0.8Mo1.2O6 in the present study in the temperature range of 40–100°C makes it useful as anode material in fuel cells. The coefficient of thermal expansion ($\\overline{\\alpha}$) and the unit cell volume () of SFMO samples vary inversely with composition in agreement with Grüneisen relation.

  10. Models for mean bonding length, melting point and lattice thermal expansion of nanoparticle materials

    Energy Technology Data Exchange (ETDEWEB)

    Omar, M.S., E-mail: dr_m_s_omar@yahoo.com [Department of Physics, College of Science, University of Salahaddin-Erbil, Arbil, Kurdistan (Iraq)

    2012-11-15

    Graphical abstract: Three models are derived to explain the nanoparticles size dependence of mean bonding length, melting temperature and lattice thermal expansion applied on Sn, Si and Au. The following figures are shown as an example for Sn nanoparticles indicates hilly applicable models for nanoparticles radius larger than 3 nm. Highlights: ► A model for a size dependent mean bonding length is derived. ► The size dependent melting point of nanoparticles is modified. ► The bulk model for lattice thermal expansion is successfully used on nanoparticles. -- Abstract: A model, based on the ratio number of surface atoms to that of its internal, is derived to calculate the size dependence of lattice volume of nanoscaled materials. The model is applied to Si, Sn and Au nanoparticles. For Si, that the lattice volume is increases from 20 Å{sup 3} for bulk to 57 Å{sup 3} for a 2 nm size nanocrystals. A model, for calculating melting point of nanoscaled materials, is modified by considering the effect of lattice volume. A good approach of calculating size-dependent melting point begins from the bulk state down to about 2 nm diameter nanoparticle. Both values of lattice volume and melting point obtained for nanosized materials are used to calculate lattice thermal expansion by using a formula applicable for tetrahedral semiconductors. Results for Si, change from 3.7 × 10{sup −6} K{sup −1} for a bulk crystal down to a minimum value of 0.1 × 10{sup −6} K{sup −1} for a 6 nm diameter nanoparticle.

  11. Evaluation of thermal expansion coefficient of Fabry-Perot cavity using an optical frequency comb

    Science.gov (United States)

    Oulehla, Jindřich; Šmíd, Radek; Buchta, Zdeněk; Čížek, Martin; Mikel, Břetislav; Jedlička, Petr; Lazar, Josef; Číp, Ondřej

    2011-05-01

    In construction of highly mechanically stable measuring devices like AFM microscopes or nano-comparators the use of low expansion materials is very necessary. We can find Zerodur ceramics or ULE glasses used as a frame or basement of these devices. The expansion coefficient of such low-expansion materials is lower than 0.01 x 10-6 m•K-1. For example in case of a frame or basement 20 cm long it leads to a dilatation approximately 4 nm per 1 K. For calculation of the total uncertainty of the mentioned measuring devices the knowledge of the thermal expansion coefficient of the frame or basement is necessary. In this work we present a method, where small distance changes are transformed into rf-frequency signal. The frequency of this signal is detected by a counter which measures the value of the frequency with respect to an ultra-stable time-base. This method uses a Fabry-Perot cavity as a distance measuring tool. The spacer of the optical resonator is made from the investigated low-expansion material. It is placed into a vacuum chamber where the inside temperature is controlled. A selected mode of the femtosecond frequency of the femtosecond comb which represent the distance changes of the optical resonator. The frequency is measured by the rf-counter which is synchronized by a time-base signal from an atomic clock. The first results show the resolution of the method in the 0.1 nm order. Therefore the method has a potential in characterisation of materials in the nanoworld.

  12. Materials Selection in Gas Turbine Engine Design and the Role of Low Thermal Expansion Materials

    Science.gov (United States)

    Lagow, Benjamin W.

    2016-11-01

    Materials selection criteria in gas turbine engine design are reviewed, and several design challenges are introduced where selection of low coefficient of thermal expansion (CTE) materials can help improve engine performance and operability. This is followed by a review of the types of low CTE materials that are suitable for gas turbine engine applications, and discussion of their advantages and disadvantages. The primary limitation of low CTE materials is their maximum use temperature; if higher temperature materials could be developed, this could result in novel turbine system designs for gas turbine engines.

  13. Effects of Chemical Treatments on Thermal Expansion Properties of Cordierite Ceramics

    Institute of Scientific and Technical Information of China (English)

    BAI Jiahai; GUO Lucun

    2006-01-01

    Cordierite honeycomb ceramics was treated with 1.5 M HNO3, followed with 1.5 M NaOH at 93 ℃. The combination of acid treatment with alkali treatment significantly diminished the rebounding of coefficient of thermal expansion (CTE)caused by heat treatment, a phenomenon observed in samples treated solely with acid. Inductively coupled plasma (ICP) analysis results reveal that the alkali treatment preferentially dissolved "free" SiO2 left in the acid-treated samples, which is considered to be a key factor responsible for the CTE rebounding.

  14. Correlation dependence of the volumetric thermal expansion coefficient of metallic aluminum on its heat capacity

    Science.gov (United States)

    Bodryakov, V. Yu.; Bykov, A. A.

    2016-05-01

    The correlation between the volumetric thermal expansion coefficient β( T) and the heat capacity C( T) of aluminum is considered in detail. It is shown that a clear correlation is observed in a significantly wider temperature range, up to the melting temperature of the metal, along with the low-temperature range where it is linear. The significant deviation of dependence β( C) from the low-temperature linear behavior is observed up to the point where the heat capacity achieves the classical Dulong-Petit limit of 3 R ( R is the universal gas constant).

  15. Complex oxide with negative thermal expansion for producing ceramic matrix composites with invar effect

    Science.gov (United States)

    Dedova, Elena S.; Pertushina, Mariya U.; Kondratenko, Anton I.; Gorev, Mikhail V.; Kulkov, Sergei N.

    2016-11-01

    The article investigates the phase composition of (Al2O3-20 wt % ZrO2)-ZrW2O8 ceramic composites obtained by cold-pressing and sintering processes. Using X-ray analysis it has been shown that composites mainly have monoclinic modification of zirconium dioxide and orthorhombic phase of aluminum oxide. After adding zirconium tungstate the phase composition of sintered ceramics changes, followed by the formation of tungsten-aluminates spinel such as Alx(WOy)z. It has been shown that thermal expansion coefficient of material decreases approximatly by 30%, as compared with initial ceramics.

  16. Size- and Temperature-Dependent Thermal Expansion Coefficient of a Nanofilm

    Institute of Scientific and Technical Information of China (English)

    ZHOU Li-Jun; GUO Jian-Gang; ZHAO Ya-Pu

    2009-01-01

    The thermal expansion coefficient (TEC) of an ideal crystal is derived by using a method of Boltzmann statistics.The Morse potential energy function is adopted to show the dependence of the TEC on the temperature.By taking the effects of the surface relaxation and the surface energy into consideration,the dimensionless TEC of a nanofilm is derived.It is shown that with decreasing thickness,the TEC can increase or decrease,depending on the surface relaxation of the nanofilm.

  17. Materials Selection in Gas Turbine Engine Design and the Role of Low Thermal Expansion Materials

    Science.gov (United States)

    Lagow, Benjamin W.

    2016-08-01

    Materials selection criteria in gas turbine engine design are reviewed, and several design challenges are introduced where selection of low coefficient of thermal expansion (CTE) materials can help improve engine performance and operability. This is followed by a review of the types of low CTE materials that are suitable for gas turbine engine applications, and discussion of their advantages and disadvantages. The primary limitation of low CTE materials is their maximum use temperature; if higher temperature materials could be developed, this could result in novel turbine system designs for gas turbine engines.

  18. Thermal Expansion Behavior of La1-xSrxMn1-yCoyO3-δ Perovskites

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    The thermal expansion behavior of La1-xSrxMn1-yCoyO3-δ (x=0.2~0.4, y=0.1~0.3) perovskites in air has been investigated. The average linear thermal expansion coefficients increased with increasing Sr content up to 40 mole fraction or Co content up to 30 mole fraction. The expansion is generally attributed to an increase in the average cation radius as some of the cations in the perovskite are reduced in valence when oxygen ions are removed from the structure.

  19. Modeling non-harmonic behavior of materials from experimental inelastic neutron scattering and thermal expansion measurements

    Science.gov (United States)

    Bansal, Dipanshu; Aref, Amjad; Dargush, Gary; Delaire, Olivier

    2016-09-01

    Based on thermodynamic principles, we derive expressions quantifying the non-harmonic vibrational behavior of materials, which are rigorous yet easily evaluated from experimentally available data for the thermal expansion coefficient and the phonon density of states. These experimentally-derived quantities are valuable to benchmark first-principles theoretical predictions of harmonic and non-harmonic thermal behaviors using perturbation theory, ab initio molecular-dynamics, or Monte-Carlo simulations. We illustrate this analysis by computing the harmonic, dilational, and anharmonic contributions to the entropy, internal energy, and free energy of elemental aluminum and the ordered compound \\text{FeSi} over a wide range of temperature. Results agree well with previous data in the literature and provide an efficient approach to estimate anharmonic effects in materials.

  20. Reentrant Structural and Optical Properties and Large Positive Thermal Expansion in Perovskite Formamidinium Lead Iodide.

    Science.gov (United States)

    Fabini, Douglas H; Stoumpos, Constantinos C; Laurita, Geneva; Kaltzoglou, Andreas; Kontos, Athanassios G; Falaras, Polycarpos; Kanatzidis, Mercouri G; Seshadri, Ram

    2016-12-05

    The structure of the hybrid perovskite HC(NH2 )2 PbI3 (formamidinium lead iodide) reflects competing interactions associated with molecular motion, hydrogen bonding tendencies, thermally activated soft octahedral rotations, and the propensity for the Pb(2+) lone pair to express its stereochemistry. High-resolution synchrotron X-ray powder diffraction reveals a continuous transition from the cubic α-phase (Pm3‾ m, #221) to a tetragonal β-phase (P4/mbm, #127) at around 285 K, followed by a first-order transition to a tetragonal γ-phase (retaining P4/mbm, #127) at 140 K. An unusual reentrant pseudosymmetry in the β-to-γ phase transition is seen that is also reflected in the photoluminescence. Around room temperature, the coefficient of volumetric thermal expansion is among the largest for any extended crystalline solid.

  1. Broad negative thermal expansion operation-temperature window in antiperovskite manganese nitride with small crystallites

    Institute of Scientific and Technical Information of China (English)

    Jie Tan[1,2; Rongjin Huang[1; Wei Wang[1; Wen Li[1,2; YuqiangZhao[1,2; Shaopeng Li[1,2; Yemao Han[1,2; Chuanjun Huang[1; Laifeng Li[1

    2015-01-01

    Using spark plasma sintering (SPS), Mn3Cu0.6Ge0.4N crystallites have been fabricated with different crystallite sizes, and their magnetic properties and thermal behaviors were systemically investigated. With decreasing crystallite size, the magnetic transition becomes increasingly slow, accompanied by broadening of the negative thermal expansion (NTE) operation-temperature window. The NTE operation-temperature window for the 12-nm crystallite sample reaches at 140 K, which is about 75% larger than that of the 74-nm crystallite sample. The magnetic properties and NTE operation-temperature window can be tuned by varying the crystallite size. This discovery will promote an even wider range of practical applications in precision devices.

  2. Anomalous subsurface thermal behavior in tissue mimics upon near infrared irradiation mediated photothermal therapy.

    Science.gov (United States)

    Ghosh, Soham; Sahoo, Nilamani; Sajanlal, P R; Sarangi, Nirod Kumar; Ramesh, Nivarthi; Panda, Tapobrata; Pradeep, T; Das, Sarit Kumar

    2014-03-01

    Photothermal therapy using (Near Infrared) NIR region of EM spectrum is a fast emerging technology for cancer therapy. Different types of nanoparticles may be used for enhancing the treatment. Though the treatment protocols are developed based on experience driven estimated temperature increase in the tissue, it is not really known what spatiotemporal thermal behavior in the tissue is. In this work, this thermal behavior of tissue models is investigated with and without using nanoparticles. An increased temperature inside tissue compared to surface is observed which is counter intuitive from the present state of knowledge. It is shown from fiber level microstructure that this increased temperature leads to enhanced damage at the deeper parts of biomaterials. Nanoparticles can be utilized to control this temperature increase spatially. A multiple scattering based physical model is proposed to explain this counterintuitive temperature rise inside tissue. The results show promising future for better understanding and standardizing the protocols for photothermal therapy.

  3. Anomalous diameter dependence of thermal transport in ultra-narrow Si nanowires

    Energy Technology Data Exchange (ETDEWEB)

    Karamitaheri, Hossein, E-mail: karami@iue.tuwien.ac.at [Institute for Microelectronics, TU Wien, Gußhausstraße 27-29/E360, A-1040 Wien (Austria); Department of Electrical Engineering, University of Kashan, Kashan, 87317-51167 (Iran, Islamic Republic of); Neophytou, Neophytos, E-mail: neophytou@iue.tuwien.ac.at [Institute for Microelectronics, TU Wien, Gußhausstraße 27-29/E360, A-1040 Wien (Austria); School of Engineering, University of Warwick, Coventry CV4 7AL (United Kingdom); Kosina, Hans, E-mail: kosina@iue.tuwien.ac.at [Institute for Microelectronics, TU Wien, Gußhausstraße 27-29/E360, A-1040 Wien (Austria)

    2014-01-14

    We present atomistic valence force field calculations of thermal transport in Si nanowires of diameters from 12 nm down to 1 nm. We show that as the diameter is reduced, the phonon density-of-states and transmission function acquire a finite value at low frequency, in contrast to approaching zero as in the bulk material. It turns out that this effect results in what Ziman described as the “problem of long longitudinal waves” [J. M. Ziman, Electrons and Phonons: The Theory of Transport Phenomena in Solids (Clarendon, Oxford, 1962)], which states that the thermal conductivity of a material increases as its length is increased due to the vanishing scattering for long-wavelength phonons. We show that this thermal transport improvement also appears in nanowires as their diameter is decreased below D = 5 nm (not only as the length increases), originating from the increase in the density of the long wavevector modes. The observation is present under ballistic transport conditions, and further enhanced with the introduction of phonon-phonon scattering. Because of this, in such ultra-narrow nanowires, as the diameter is reduced, phonon transport is dominated more and more by lower energy phonons with longer mean-free paths. We show that ∼80% of the heat is carried by phonons with energies less than 5 meV, most with mean-free paths of several hundreds of nanometers.

  4. Characterization of the negative thermal expansion material Zr1-xHfxW2O8

    Institute of Scientific and Technical Information of China (English)

    2003-01-01

    The oxide ZrW2Osdisplays unusual property of isotropic negative thermal expansion in a large wide temperaturerange, which makes it have a number of important potential applications. The cubic Zrl-xHfxW2O8 (x = 0, 0.3, 0.5, 0.7, and1.0) weresynthesized by standard solid state reaction technique. The high and low temperature X-ray diffraction analysisindicate that the substitution of the Hf4+ for Zr4+ only leads to reducing the lattice constants, and the changes of negativethermal expansion coefficients are not obvious. The linear expansion coefficients of Zrl-xHfxW2O8 (x = 0, 0.3, 0.5, 0.7, and1.0) are about -6 × 10-6 K-1 in the temperature range of 298 to 973 K, while that of Zr0.5Hf0.5W2O8 is -9.6 × 10-6 K-1 from83 to 298 K. The phase transition temperatures from α-ZrW2O8 to β-ZrW2O8 structure were also determined by X-ray dif-fraction method. Thermogravimetric analysis (TGA) exhibits that Zrl-xHfxW2O8 is not hygroscopic in air.

  5. Thermodynamic Predictions of Thermal Expansivity and Elastic Compliances at High Temperatures and Pressures Applied to Perovskite Crystals

    Science.gov (United States)

    Burns, S. J.

    2016-12-01

    The possibility of near zero thermal expansion coefficients at very high pressures is explored for application to the Earth's core materials and mantle dynamics. The pressures in the Earth are large enough to effectively reduce thermal expansion coefficients to values which will decouple heat from mechanical work. It is shown that at pressures below the bulk modulus the thermal expansion coefficient will approach zero in all simple linear-elastic crystalline models. Advanced models of crystalline elastic solids based on interatomic potentials and density functional theory are shown to violate Gibb's potential for a solid, crystalline material described by three elastic matrix compliance entries; it is established that the temperature dependence of S 11 and S 12 are thermodynamically identical; it is also established that the pressure dependence of S 11 and S 12 are thermodynamically identical. The basis for thermal energy in materials is the phonon energy in solids. However, it is noted that heat capacity measurements which are obtained from constant pressure heat capacity conditions converted to constant volume values on isobars are not in the correct state when compared to theoretical models; at atmospheric pressure there may be very little difference between these states but at very high pressures the effect may be major. Very large pressures always reduce thermal expansion coefficients; the importance of very small thermal expansion coefficients is discussed in relation to physical processes deep in the core and mantle of the Earth.

  6. Internal Thermal Control System Hose Heat Transfer Fluid Thermal Expansion Evaluation Test Report

    Science.gov (United States)

    Wieland, P. O.; Hawk, H. D.

    2001-01-01

    During assembly of the International Space Station, the Internal Thermal Control Systems in adjacent modules are connected by jumper hoses referred to as integrated hose assemblies (IHAs). A test of an IHA has been performed at the Marshall Space Flight Center to determine whether the pressure in an IHA filled with heat transfer fluid would exceed the maximum design pressure when subjected to elevated temperatures (up to 60 C (140 F)) that may be experienced during storage or transportation. The results of the test show that the pressure in the IHA remains below 227 kPa (33 psia) (well below the 689 kPa (100 psia) maximum design pressure) even at a temperature of 71 C (160 F), with no indication of leakage or damage to the hose. Therefore, based on the results of this test, the IHA can safely be filled with coolant prior to launch. The test and results are documented in this Technical Memorandum.

  7. First principles calculations of vacancy-vacancy interactions in nickel: thermal expansion effects

    Energy Technology Data Exchange (ETDEWEB)

    Megchiche, E H; Amarouche, M [Laboratoire de Physique et Chimie Quantique (LPCQ), Universite Mouloud Mammeri, Tizi-ouzou (Algeria); Mijoule, C, E-mail: claude.mijoule@ensiacet.f [CIRIMAT UMR CNRS/INP/UPS, Ecole Nationale d' Ingenieurs en Arts Chimiques et Technologiques (ENSIACET), 4 allee Emile Monso, B.P 44362, Toulouse cedex 4 (France)

    2010-12-08

    The energetic properties of the divacancy defect in fcc nickel are studied by ab initio calculations based on density functional theory. The formation and binding enthalpies of the divacancy in the first (1nn), second (2nn) and third (3nn) nearest-neighbor configurations are presented. Results show that the 1nn divacancy configuration is the most stable with a formation enthalpy H{sub 2v}{sup f} of 2.71 eV and a small binding energy H{sub 2v}{sup b} of 0.03 eV. In the 2nn configuration, the monovacancy-monovacancy interaction is repulsive, and it vanishes in the 3nn configuration. The migration process of the divacancy in its stable configuration is studied. We find that the divacancy migrates in the (111) plane by successive rotational steps of 60{sup 0}. The corresponding migration enthalpy H{sub 2v}{sup m} is predicted to be 0.59 eV, about half of that found for the monovacancy. For a better comparison of our results with high temperature experimental data, we have analyzed the effects of thermal expansion. Our results show that the inclusion of thermal expansion allows us to reproduce satisfactorily the experimental predictions.

  8. Phonon spectrum, thermal expansion and heat capacity of UO{sub 2} from first-principles

    Energy Technology Data Exchange (ETDEWEB)

    Yun, Younsuk, E-mail: younsuk.yun@psi.ch [Department of Physics and Astronomy, Uppsala University, Box 516, SE-751 20 Uppsala (Sweden); Laboratory of Reactor Physics and Systems Behaviour, Paul Scherrer Institut, CH-5232 Villigen PSI (Switzerland); Legut, Dominik [Nanotechnology Centre, VSB-Technical University of Ostrava, 17. listopadu 15, CZ-708 33 Ostrava (Czech Republic); Atomistic Modeling and Design of Materials, University of Leoben, Leoben (Austria); Oppeneer, Peter M. [Department of Physics and Astronomy, Uppsala University, Box 516, SE-751 20 Uppsala (Sweden)

    2012-07-15

    We report first-principles calculations of the phonon dispersion spectrum, thermal expansion, and heat capacity of uranium dioxide. The so-called direct method, based on the quasiharmonic approximation, is used to calculate the phonon frequencies within a density functional framework for the electronic structure. The phonon dispersions calculated at the theoretical equilibrium volume agree well with experimental dispersions. The computed phonon density of states (DOSs) compare reasonably well with measured data, as do also the calculated frequencies of the Raman and infrared active modes including the LO/TO splitting. To study the pressure dependence of the phonon frequencies we calculate phonon dispersions for several lattice constants. Our computed phonon spectra demonstrate the opening of a gap between the optical and acoustic modes induced by pressure. Taking into account the phonon contribution to the total free energy of UO{sub 2} its thermal expansion coefficient and heat capacity have been computed from first-principles. Both quantities are in good agreement with available experimental data for temperatures up to about 500 K.

  9. Thermal Expansion Anomaly and Spontaneous Magnetostriction of Y2Fe14Al3Compound

    Institute of Scientific and Technical Information of China (English)

    HAO Yan-Ming; ZHANG Yan-Yan; JIANG Xin-Yuan; GAO Chun-Jing; WU Yan-Zhao

    2009-01-01

    The structure and magnetic properties of Y2Fe14Al3 compound are investigated by means of x-ray diffraction and magnetization measurements. The Y2Fe14.Al3 compound has a hexagonal Th2Ni17-type structure. Nega-tive thermal expansion is found in Y2Fe14Al3 compound in the temperature range from 403 to 491K by x-ray dilatometry. The coefficient of the average thermal expansion is α = -2.54 × 10-5 K-1. The spontaneous mag-netostrictive deformations from 283 to 470 K are calculated by means of the differences between the experimental values of the lattice parameters and the corresponding values extrapolated from the paramagnetic range. The result shows that the spontaneous volume magnetostrictive deformation ωs decreases from 5.74 × 10-3 to nearly zero with temperature increasing from 283 to 470K, the spontaneous linear magnetostrictive deformation λc along the c-axis is larger than the spontaneous linear magnetostrictive deformation λα in basal-plane in the same temperature below 350K.

  10. Thermal expansion and magnetovolume studies of the itinerant helical magnet MnSi

    Science.gov (United States)

    Petrova, A. E.; Stishov, S. M.

    2016-07-01

    Thermal expansion and forced magnetostriction of MnSi were measured as a function of temperature down to 5 K and magnetic field to 3 T. The small length (volume) discontinuity at the magnetic phase transition in MnSi decreases with application of magnetic field to a value Δ L /L ˜10-7 , and then suddenly the discontinuity seemingly jumps to zero. Thermal expansivity peaks strongly deteriorate with magnetic fields. No specific features identifying a tricritical point were observed. We propose that the Frenkel concept of heterophase fluctuations may be relevant in the current case. Therefore, we suggest that the magnetic phase transition in MnSi always remains first order at any temperature and magnetic field, but the transition is progressively smoothed by heterophase fluctuations. These results question the applicability of a model of a fluctuation-induced first-order phase transition for MnSi. Probably a model of coupling of an order parameter with other degrees of freedom is more appropriate.

  11. TEV—A Program for the Determination of the Thermal Expansion Tensor from Diffraction Data

    Directory of Open Access Journals (Sweden)

    Thomas Langreiter

    2015-02-01

    Full Text Available TEV (Thermal Expansion Visualizing is a user-friendly program for the calculation of the thermal expansion tensor αij from diffraction data. Unit cell parameters determined from temperature dependent data collections can be provided as input. An intuitive graphical user interface enables fitting of the evolution of individual lattice parameters to polynomials up to fifth order. Alternatively, polynomial representations obtained from other fitting programs or from the literature can be entered. The polynomials and their derivatives are employed for the calculation of the tensor components of αij in the infinitesimal limit. The tensor components, eigenvalues, eigenvectors and their angles with the crystallographic axes can be evaluated for individual temperatures or for temperature ranges. Values of the tensor in directions parallel to either [uvw]’s of the crystal lattice or vectors (hkl of reciprocal space can be calculated. Finally, the 3-D representation surface for the second rank tensor and pre- or user-defined 2-D sections can be plotted and saved in a bitmap format. TEV is written in JAVA. The distribution contains an EXE-file for Windows users and a system independent JAR-file for running the software under Linux and Mac OS X. The program can be downloaded from the following link: http://www.uibk.ac.at/mineralogie/downloads/TEV.html (Institute of Mineralogy and Petrography, University of Innsbruck, Innsbruck, Austria

  12. Influence of the filler content on the thermal expansion behavior of an epoxy matrix particulate composite

    Energy Technology Data Exchange (ETDEWEB)

    Tognana, S. [IFIMAT - Universidad Nacional del Centro de la Provincia de Buenos Aires, Pinto 399, B7000GHG Tandil (Argentina); Consejo Nacional de Investigaciones Cientificas y Tecnicas (Argentina); Salgueiro, W. [IFIMAT - Universidad Nacional del Centro de la Provincia de Buenos Aires, Pinto 399, B7000GHG Tandil (Argentina); Somoza, A. [IFIMAT - Universidad Nacional del Centro de la Provincia de Buenos Aires, Pinto 399, B7000GHG Tandil (Argentina); Comision de Investigaciones Cientificas de la Provincia de Buenos Aires (Argentina)], E-mail: asomoza@exa.unicen.edu.ar; Pomarico, J.A.; Ranea-Sandoval, H.F. [Consejo Nacional de Investigaciones Cientificas y Tecnicas (Argentina); IFAS - Universidad Nacional del Centro de la Provincia de Buenos Aires, Pinto 399, B7000GHG Tandil (Argentina)

    2009-02-15

    The thermal expansion behavior of epoxy matrix particulate composites prepared with different volumetric filler contents ({phi}) up to 25 vol.% was studied. Using a very simple absolute optical dilatometer developed in our laboratory, the coefficients of thermal expansion (CTE) for pure epoxy resin matrix and the composites in the glassy and rubbery states (293 K {<=} T {<=} 493 K) were obtained. For the matrix, the CTE obtained in the two states are in good agreement with those reported. For composites the results are discussed into the frame of different approaches using well-known mechanical models. In the glassy state, the CTE behavior could be well described by the upper bound of the Hashin-Shtrikman model. In the rubbery state it was necessary to evaluate the contribution of the average volume of nanoholes in the epoxy matrix as a consequence of the addition of particles. To this aim, using positron annihilation lifetime spectroscopy, the dependence of the average volume of nanoholes with {phi} was measured.

  13. Thermal expansion and decomposition of jarosite: a high-temperature neutron diffraction study

    Energy Technology Data Exchange (ETDEWEB)

    Xu, Hongwu [Los Alamos National Laboratory; Zhao, Yusheng [Los Alamos National Laboratory; Vogel, Sven C [Los Alamos National Laboratory; Hickmott, Donald D [Los Alamos National Laboratory; Daemen, Luke L [Los Alamos National Laboratory; Hartl, Monika A [Los Alamos National Laboratory

    2009-01-01

    The structure of deuterated jarosite, KFe{sub 3}(SO{sub 4}){sub 2}(OD){sub 6}, was investigated using time-of-flight neutron diffraction up to its dehydroxylation temperature. Rietveld analysis reveals that with increasing temperature, its c dimension expands at a rate {approx}10 times greater than that for a. This anisotropy of thermal expansion is due to rapid increase in the thickness of the (001) sheet of [Fe(O,OH){sub 6}] octahedra and [SO{sub 4}] tetrahedra with increasing temperature. Fitting of the measured cell volumes yields a coefficient of thermal expansion, a = a{sub 0} + a{sub 1} T, where a{sub 0} = 1.01 x 10{sup -4} K{sup -1} and a{sub 1} = -1.15 x 10{sup -7} K{sup -2}. On heating, the hydrogen bonds, O1{hor_ellipsis}D-O3, through which the (001) octahedral-tetrahedral sheets are held together, become weakened, as reflected by an increase in the D{hor_ellipsis}O1 distance and a concomitant decrease in the O3-D distance with increasing temperature. On further heating to 575 K, jarosite starts to decompose into nanocrystalline yavapaiite and hematite (as well as water vapor), a direct result of the breaking of the hydrogen bonds that hold the jarosite structure together.

  14. Thermal expansion anomaly and spontaneous magnetostriction of Tb2Fe15Cr2 compound

    Institute of Scientific and Technical Information of China (English)

    2006-01-01

    The structural and magnetic properties of Tb2Fe15Cr2 compound were investigated by means of X-ray diffraction and magnetization measurements. Tb2Fe15Cr2 compound has a hexagonal Th2Ni17-type structure. Negative thermal expansion was found in Tb2Fe15Cr2 compound from 372 to 452 K by X-ray dilatometry. The coefficient of the average thermal expansion is α =-3.14×10-5 K-1. The magnetostrictive deformations from 292 to 450 K were calculated. The result showed that the spontaneous volume magnetostrictive deformation ωs remains nearly constant with increasing temperature up to 360 K, but decreases with the further increase of temperature. The spontaneous linear magnetostrictive deformation λc along the c axis decreases with increasing temperature. The spontaneous linear magnetostrictive deformation, λa, in the basal-plane increases with increasing temperature up to 360 K, but decreases with further increasing temperature.

  15. Crystal structure and thermal expansion of Mn(1-x)Fe(x)Ge.

    Science.gov (United States)

    Dyadkin, Vadim; Grigoriev, Sergey; Ovsyannikov, Sergey V; Bykova, Elena; Dubrovinsky, Leonid; Tsvyashchenko, Anatoly; Fomicheva, L N; Chernyshov, Dmitry

    2014-08-01

    A series of temperature-dependent single-crystal and powder diffraction experiments has been carried out using synchrotron radiation in order to characterize the monogermanides of Mn, Fe and their solid solutions. The MnGe single crystal is found to be enantiopure and we report the absolute structure determination. The thermal expansion, parametrized with the Debye model, is discussed from the temperature-dependent powder diffraction measurements for Mn(1-x)Fe(x)Ge (x = 0, 0.1, 0.2, 0.25, 0.3, 0.4, 0.5, 0.6, 0.7, 0.75, 0.8, 0.9). Whereas the unit-cell dimension and the Debye temperature follow a linear trend as a function of composition, the thermal expansion coefficient deviates from linear dependence with increasing Mn content. No structural phase transformations have been observed for any composition in the temperature range 80-500 K for both single-crystal and powder diffraction, indicating that the phase transition previously observed with neutron powder diffraction most probably has a magnetic origin.

  16. Maximizing negative thermal expansion via rigid unit modes: a geometry-based approach.

    Science.gov (United States)

    Grima, J N; Bajada, M; Scerri, S; Attard, D; Dudek, K K; Gatt, R

    2015-07-08

    Existent rigid unit mode (RUM) models based on rotating squares, which may explain the phenomenon of negative thermal expansion (NTE), are generalized so as to assess the NTE potential for novel systems made from rectangular or rhombic rigid units. Analytical models for the area coefficients of thermal expansion (CTE) of these innovative networks are derived in an attempt to determine the optimal geometrical parameters and connectivity for maximum NTE. It was found that all systems exhibit NTE, the extent of which is determined by the shape and connectivity of the elemental rigid units (side lengths ratio or internal angle). It was also found that some of the networks proposed here should exhibit significantly superior NTE properties when compared with the well-known network of squares, and that for optimal NTE characteristics, pencil-like rigid units should be used rather than square-shaped ones, as these permit larger pore sizes that are more conducive to NTE. All this compliments earlier work on the negative Poisson's ratio (auxetic) potential of such systems and may provide a route for the design of new materials exhibiting superior thermo-mechanical characteristics including specifically tailored CTEs or giant NTE characteristics.

  17. Thermal expansion behavior of hydrate paramylon in the low-temperature region.

    Science.gov (United States)

    Kobayashi, Kayoko; Kimura, Satoshi; Togawa, Eiji; Wada, Masahisa

    2013-01-16

    The thermal expansion behavior of hydrate paramylon between 100 and 300K has been investigated using synchrotron X-ray powder diffraction. The X-ray diffraction profile at 300K showed a typical pattern of the hydrate triple helical (1→3)-β-d-glucan with a hexagonal unit cell (a=15.782Å and c=18.580Å). On cooling, the hydrate paramylon had converted to a "low-temperature phase" around 270K. On passing through the phase transition, the a-axis and c-axis values decreased and increased, respectively, and the low-temperature phase at 100K exhibited a hexagonal unit cell (a=15.586Å and c=18.619Å). The phase transition took place reversibly. Below the transition point, both the a-axis and c-axis values decreased linearly. The thermal expansion coefficients are: α(a)=1.50×10(-5)K(-1), α(c)=0.33×10(-5)K(-1), and β=3.08×10(-5)K(-1).

  18. Effect of pressure on the thermal expansion of MgO up to 200 Gpa

    Institute of Scientific and Technical Information of China (English)

    Sun Xiao-Wei; Liu Zi-Jiang; Chen Qi-Feng; Song Ting; Wang Cheng-Wei

    2009-01-01

    Constant temperature and pressure molecular dynamics (MD) simulations are performed to investigate the thermal expansivity of MgO at high pressure, by using effective pair-wise potentials which consist of Coulomb, dispersion, and repulsion interactions that include polarization effects through the shell model (SM). In order to take into account non-central forces in crystals, the breathing shell model (BSM) is also introduced into the MD simulation. We present a comparison between the volume thermal expansion coefficient α dependences of pressure P at 300 and 2000 K that are obtained from the SM and BSM potentials and those derived from other experimental and theoretical methods in the case of MgO. Compared with the results obtained by using the SM potentials, the MD results obtained by using BSM potentials are more compressible. In an extended pressure and temperature range, the α value is also predicted. The properties of MgO in a pressure range of 0-200 GPa at temperatures up to 3500 K axe summarized.

  19. Effects of operation temperature on thermal expansion and main parameters of radial ball bearings

    Directory of Open Access Journals (Sweden)

    Mitrović Radivoje M.

    2015-01-01

    Full Text Available The research of influence of operation temperature on the thermal expansion and main parameters of radial ball bearings is presented in this paper. The main bearing parameters are identified in accordance with the increasing requests concerning stability and load capacity. A series of Finite Element Analyses is performed for quasi-static analysis of all identified bearing parameters during contact period in referent temperature. Then, the dependence of bearing material characteristics on the operation temperature is discussed. Few series of Finite Element Analyses are performed for a particular radial ball bearing type, with characteristics in accordance with manufacturer specifications, for several operation temperatures. These two problems analyses include consideration of relation between the initial radial clearance, thermal expansion strains and contact deformations of the parts of the bearing assembly. The results for radial ball bearing parameters are monitored during a ball contact period for different temperatures and the appropriate discussion and conclusions are given. The conclusions about the contribution of developed procedure in defining the optimum operation temperature range are shown. [Projekat Ministarstva nauke Republike Srbije, br. TR 35029 i br. OI 174001

  20. A Micro-Test Structure for the Thermal Expansion Coefficient of Metal Materials

    Directory of Open Access Journals (Sweden)

    Qingying Ren

    2017-02-01

    Full Text Available An innovative micro-test structure for detecting the thermal expansion coefficient (TEC of metal materials is presented in this work. Throughout this method, a whole temperature sensing moveable structures are supported by four groups of cascaded chevrons beams and packed together. Thermal expansion of the metal material causes the deflection of the cascaded chevrons, which leads to the capacitance variation. By detecting the capacitance value at different temperatures, the TEC value of the metal materials can be calculated. A finite element model has been established to verify the relationship between the TEC of the material and the displacement of the structure on horizontal and vertical directions, thus a function of temperature for different values of TEC can be deduced. In order to verify the analytical model, a suspended-capacitive micro-test structure has been fabricated by MetalMUMPs process and tested in a climate chamber. Test results show that in the temperature range from 30 °C to 80 °C, the TEC of the test material is 13.4 × 10−6 °C−1 with a maximum relative error of 0.8% compared with the given curve of relationship between displacement and temperature.

  1. High Density Polyethylene Composites Reinforced with Hybrid Inorganic Fillers: Morphology, Mechanical and Thermal Expansion Performance

    Directory of Open Access Journals (Sweden)

    Birm-June Kim

    2013-09-01

    Full Text Available The effect of individual and combined talc and glass fibers (GFs on mechanical and thermal expansion performance of the filled high density polyethylene (HDPE composites was studied. Several published models were adapted to fit the measured tensile modulus and strength of various composite systems. It was shown that the use of silane-modified GFs had a much larger effect in improving mechanical properties and in reducing linear coefficient of thermal expansion (LCTE values of filled composites, compared with the use of un-modified talc particles due to enhanced bonding to the matrix, larger aspect ratio, and fiber alignment for GFs. Mechanical properties and LCTE values of composites with combined talc and GF fillers varied with talc and GF ratio at a given total filler loading level. The use of a larger portion of GFs in the mix can lead to better composite performance, while the use of talc can help lower the composite costs and increase its recyclability. The use of 30 wt % combined filler seems necessary to control LCTE values of filled HDPE in the data value range generally reported for commercial wood plastic composites. Tensile modulus for talc-filled composite can be predicted with rule of mixture, while a PPA-based model can be used to predict the modulus and strength of GF-filled composites.

  2. Thermal expansion and phase transformations of nitrogen-expanded austenite studied with in situ synchrotron X-ray diffraction

    DEFF Research Database (Denmark)

    Brink, Bastian; Ståhl, Kenny; Christiansen, Thomas Lundin;

    2014-01-01

    Nitrogen-expanded austenite, _N, with high and low nitrogen contents was produced from AISI 316 grade stainless steel powder by gaseous nitriding in ammonia/hydrogen gas mixtures. In situ synchrotron X-ray diffraction was applied to investigate the thermal expansion and thermal stability...... as a fitting parameter. The stacking fault density is constant for temperatures up to 680 K, whereafter it decreases to nil. Surprisingly, a transition phase with composition M4N (M = Fe, Cr, Ni, Mo) appears for temperatures above 770 K. The linear coefficient of thermal expansion depends on the nitrogen...

  3. Zero-Thermal Expansion and Heat Capacity of Zirconium Pyrovanadate Doped with Zirconia and Vanadium (V) Oxide

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The dominant phase ZrV2O7 material, doped with zirconia and vanadium (V) oxide, was synthesized by solid state reaction and sol-gel methods. X-ray power diffraction patterns show that it is cubic structure. Thermal mechanic analysis measurements exhibit a zero-thermal expansion of this material above 150 ℃. Meanwhile, the heat capacity dependent on temperature, determined by differential scanning calorimetry, keeps in constant almost in the same temperature range. The relationship between unusual thermal expansion and abnormal heat capacity is discussed with Gr€黱eisen parameter.

  4. Does greater thermal plasticity facilitate range expansion of an invasive terrestrial anuran into higher latitudes?

    Science.gov (United States)

    Winwood-Smith, Hugh S; Alton, Lesley A; Franklin, Craig E; White, Craig R

    2015-01-01

    Temperature has pervasive effects on physiological processes and is critical in setting species distribution limits. Since invading Australia, cane toads have spread rapidly across low latitudes, but slowly into higher latitudes. Low temperature is the likely factor limiting high-latitude advancement. Several previous attempts have been made to predict future cane toad distributions in Australia, but understanding the potential contribution of phenotypic plasticity and adaptation to future range expansion remains challenging. Previous research demonstrates the considerable thermal metabolic plasticity of the cane toad, but suggests limited thermal plasticity of locomotor performance. Additionally, the oxygen-limited thermal tolerance hypothesis predicts that reduced aerobic scope sets thermal limits for ectotherm performance. Metabolic plasticity, locomotor performance and aerobic scope are therefore predicted targets of natural selection as cane toads invade colder regions. We measured these traits at temperatures of 10, 15, 22.5 and 30°C in low- and high-latitude toads acclimated to 15 and 30°C, to test the hypothesis that cane toads have adapted to cooler temperatures. High-latitude toads show increased metabolic plasticity and higher resting metabolic rates at lower temperatures. Burst locomotor performance was worse for high-latitude toads. Other traits showed no regional differences. We conclude that increased metabolic plasticity may facilitate invasion into higher latitudes by maintaining critical physiological functions at lower temperatures.

  5. Anomalous Thermal Diffusivity in Underdoped YBa$_2$Cu$_3$O$_{6+x}$

    CERN Document Server

    Zhang, J -C; Ramshaw, B J; Bonn, D A; Liang, R; Hardy, W N; Hartnoll, S A; Kapitulnik, A

    2016-01-01

    We present local optical measurements of thermal diffusivity in the $ab$ plane of underdoped YBCO crystals. We find that the diffusivity anisotropy is comparable to reported values of the electrical resistivity anisotropy, suggesting that the anisotropies have the same origin. The anisotropy drops sharply below the charge order transition. We interpret our results through a strong electron-phonon scattering picture and find that both electronic and phononic contributions to the diffusivity saturate a proposed bound. Our results suggest that neither well-defined electron nor phonon quasiparticles are present in this material.

  6. Matrix-filler interfaces and physical properties of metal matrix composites with negative thermal expansion manganese nitride

    Energy Technology Data Exchange (ETDEWEB)

    Takenaka, Koshi, E-mail: takenaka@nuap.nagoya-u.ac.jp [Department of Applied Physics, Nagoya University, Nagoya 464-8603 (Japan); Department of Crystalline Materials Science, Nagoya University, Nagoya 464-8603 (Japan); Kuzuoka, Kota [Department of Applied Physics, Nagoya University, Nagoya 464-8603 (Japan); Sugimoto, Norihiro [Department of Crystalline Materials Science, Nagoya University, Nagoya 464-8603 (Japan)

    2015-08-28

    Copper matrix composites containing antiperovskite manganese nitrides with negative thermal expansion (NTE) were formed using pulsed electric current sintering. Energy dispersive X-ray spectroscopy revealed that the chemically reacted region extends over 10 μm around the matrix–filler interfaces. The small-size filler was chemically deteriorated during formation of composites and it lost the NTE property. Therefore, we produced the composites using only the nitride particles having diameter larger than 50 μm. The large-size filler effectively suppressed the thermal expansion of copper and improved the conductivity of the composites to the level of pure aluminum. The present composites, having high thermal conductivity and low thermal expansion, are suitable for practical applications such as a heat radiation substrate for semiconductor devices.

  7. The role of spontaneous polarization in the negative thermal expansion of tetragonal PbTiO3-based compounds.

    Science.gov (United States)

    Chen, Jun; Nittala, Krishna; Forrester, Jennifer S; Jones, Jacob L; Deng, Jinxia; Yu, Ranbo; Xing, Xianran

    2011-07-27

    PbTiO(3)-based compounds are well-known ferroelectrics that exhibit a negative thermal expansion more or less in the tetragonal phase. The mechanism of negative thermal expansion has been studied by high-temperature neutron powder diffraction performed on two representative compounds, 0.7PbTiO(3)-0.3BiFeO(3) and 0.7PbTiO(3)-0.3Bi(Zn(1/2)Ti(1/2))O(3), whose negative thermal expansion is contrarily enhanced and weakened, respectively. With increasing temperature up to the Curie temperature, the spontaneous polarization displacement of Pb/Bi (δz(Pb/Bi)) is weakened in 0.7PbTiO(3)-0.3BiFeO(3) but well-maintained in 0.7PbTiO(3)-0.3Bi(Zn(1/2)Ti(1/2))O(3). There is an apparent correlation between tetragonality (c/a) and spontaneous polarization. Direct experimental evidence indicates that the spontaneous polarization originating from Pb/Bi-O hybridization is strongly associated with the negative thermal expansion. This mechanism can be used as a guide for the future design of negative thermal expansion of phase-transforming oxides.

  8. The Thermal Expansion of Ring Particles and the Secular Orbital Evolution of Rings Around Planets and Asteroids

    Science.gov (United States)

    Rubincam, David P.

    2013-01-01

    The thermal expansion and contraction of ring particles orbiting a planet or asteroid can cause secular orbit evolution. This effect, called here the thermal expansion effect, depends on ring particles entering and exiting the shadow of the body they orbit. A particle cools off in the shadow and heats up again in the sunshine, suffering thermal contraction and expansion. The changing cross-section it presents to solar radiation pressure plus time lags due to thermal inertia lead to a net along-track force. The effect causes outward drift for rocky particles. For the equatorial orbits considered here, the thermal expansion effect is larger than Poynting-Robertson drag in the inner solar system for particles in the size range approx. 0.001 - 0.02 m. This leads to a net increase in the semimajor axis from the two opposing effects at rates ranging from approx. 0.1 R per million years for Mars to approx. 1 R per million years for Mercury, for distances approx. 2R from the body, where R is the body's radius. Asteroid 243 Ida has approx. 10 R per million years, while a hypothetical Near-Earth Asteroid (NEA) can have faster rates of approx. 0.5 R per thousand years, due chiefly to its small radius compared to the planets. The thermal expansion effect weakens greatly at Jupiter and is overwhelmed by Poynting-Robertson for icy particles orbiting Saturn. Meteoroids in eccentric orbits about the Sun also suffer the thermal expansion effect, but with only approx. 0.0003e2 AU change in semimajor axis over a million years for a 2 m meteoroid orbiting between Mercury and Earth.

  9. PROPERTIES OF CP: COEFFICIENT OF THERMAL EXPANSION, DECOMPOSITION KINETICS, AND REACTION TO SPARK, FRICTION AND IMPACT

    Energy Technology Data Exchange (ETDEWEB)

    Weese, R K; Burnham, A K

    2005-09-28

    The properties of pentaamine (5-cyano-2H-tetrazolato-N2) cobalt (III) perchlorate (CP), which was first synthesized in 1968, continues to be of interest for predicting behavior in handling, shipping, aging, and thermal cook-off situations. We report coefficient of thermal expansion (CTE) values over four specific temperature ranges, decomposition kinetics using linear and isothermal heating, and the reaction to three different types of stimuli: impact, spark, and friction. The CTE was measured using a Thermal Mechanical Analyzer (TMA) for samples that were uniaxially compressed at 10,000 psi and analyzed over a dynamic temperature range of -20 C to 70 C. Differential scanning calorimetry, DSC, was used to monitor CP decomposition at linear heating rates of 1-7 C min{sup -1} in perforated pans and of 0.1-1.0 C min{sup -1} in sealed pans. The kinetic triplet was calculated using the LLNL code Kinetics05, and predictions for 210 and 240 C are compared to isothermal thermogravimetric analysis (TGA) experiments. Values are also reported for spark, friction, and impact sensitivity.

  10. Composite Laminate With Coefficient of Thermal Expansion Matching D263 Glass

    Science.gov (United States)

    Robinson, David; Rodini, Benjamin

    2012-01-01

    The International X-ray Observatory project seeks to make an X-ray telescope assembly with 14,000 flexible glass segments. The glass used is commercially available SCHOTT D263 glass. Thermal expansion causes the mirror to distort out of alignment. A housing material is needed that has a matching coefficient of thermal expansion (CTE) so that when temperatures change in the X-ray mirror assembly, the glass and housing pieces expand equally, thus reducing or eliminating distortion. Desirable characteristics of this material include a high stiffness/weight ratio, and low density. Some metal alloys show promise in matching the CTE of D263 glass, but their density is high compared to aluminum, and their stiffness/weight ratio is not favorable. A laminate made from carbon fiber reinforced plastic (CFRP) should provide more favorable characteristics, but there has not been any made with the CTE matching D263 Glass. It is common to create CFRP laminates of various CTEs by stacking layers of prepreg material at various angles. However, the CTE of D263 glass is 6.3 ppm/ C at 20 C, which is quite high, and actually unachievable solely with carbon fiber and resin. A composite laminate has been developed that has a coefficient of thermal expansion identical to that of SCHOTT D263 glass. The laminate is made of a combination of T300 carbon fiber, Eglass, and RS3C resin. The laminate has 50% uni-T300 plies and 50% uni-E-glass plies, with each fiber-layer type laid up in a quasi-isotropic laminate for a total of 16 plies. The fiber volume (percent of fiber compared to the resin) controls the CTE to a great extent. Tests have confirmed that a fiber volume around 48% gives a CTE of 6.3 ppm/ C. This is a fairly simple composite laminate, following well established industry procedures. The unique feature of this laminate is a somewhat unusual combination of carbon fiber with E-glass (fiberglass). The advantage is that the resulting CTE comes out to 6.3 ppm/ C at 20 C, which matches D

  11. Effects of Thermal Cycling on Thermal Expansion and Mechanical Properties of Sic Fiber-reinforced Reaction-bonded Si3n4 Composites

    Science.gov (United States)

    Bhatt, R. T.; Palczer, A. R.

    1994-01-01

    Thermal expansion curves for SiC fiber-reinforced reaction-bonded Si3N4 matrix composites (SiC/RBSN) and unreinforced RBSN were measured from 25 to 1400 C in nitrogen and in oxygen. The effects of fiber/matrix bonding and cycling on the thermal expansion curves and room-temperature tensile properties of unidirectional composites were determined. The measured thermal expansion curves were compared with those predicted from composite theory. Predicted thermal expansion curves parallel to the fiber direction for both bonding cases were similar to that of the weakly bonded composites, but those normal to the fiber direction for both bonding cases resulted in no net dimensional changes at room temperature, and no loss in tensile properties from the as-fabricated condition. In contrast, thermal cycling in oxygen for both composites caused volume expansion primarily due to internal oxidation of RBSN. Cyclic oxidation affected the mechanical properties of the weakly bonded SiC/RBSN composites the most, resulting in loss of strain capability beyond matrix fracture and catastrophic, brittle fracture. Increased bonding between the SiC fiber and RBSN matrix due to oxidation of the carbon-rich fiber surface coating and an altered residual stress pattern in the composite due to internal oxidation of the matrix are the main reasons for the poor mechanical performance of these composites.

  12. Anomalous ion thermal transport in hot ion plasmas by the ion temperature gradient mode

    Energy Technology Data Exchange (ETDEWEB)

    Kim, J.Y.; Horton, W. (Texas Univ., Austin, TX (United States). Inst. for Fusion Studies); Coppi, B. (Massachusetts Inst. of Tech., Cambridge, MA (United States). Research Lab. of Electronics)

    1992-01-01

    Experiments show that the observed radial profiles of the ion thermal conductivity {chi}{sub i} have the opposite shapes with those obtained from the ion temperature gradient mode ({eta}{sub i} mode) turbulence model by the traditional mixing length estimate. In this work, this radial profile problem is reconsidered with an electromagnetic study of the linear stability of the toroidal {eta}{sub i} mode and a new rule for choosing the mixing length. It is first shown that the electromagnetic effect gives a significant stabilizing effect on the toroidal {eta}{sub i} mode, and that the observed reduction of {chi}{sub i}(r) in the core region can be explained by this electromagnetic effect. Secondly, in view of earlier numerical simulations showing the transfer of fluctuation energy to larger scales that those for the fastest growth rate, as well as fluctuation measurements indicating longer radial correlation lengths, a new mixing length formula is proposed to explain the radial increase of the {chi}{sub i}. It is shown the new formula fits well the observed {chi}{sub i}(r) profiles in two TFTR supershot discharges and also gives the scaling law in the current and the magnetic field which agrees better with experiment than the conventional formula.

  13. Anomalous ion thermal transport in hot ion plasmas by the ion temperature gradient mode

    Energy Technology Data Exchange (ETDEWEB)

    Kim, J.Y.; Horton, W. [Texas Univ., Austin, TX (United States). Inst. for Fusion Studies; Coppi, B. [Massachusetts Inst. of Tech., Cambridge, MA (United States). Research Lab. of Electronics

    1992-08-01

    Experiments show that the observed radial profiles of the ion thermal conductivity {chi}{sub i} have the opposite shapes with those obtained from the ion temperature gradient mode ({eta}{sub i} mode) turbulence model by the traditional mixing length estimate. In this work, this radial profile problem is reconsidered with an electromagnetic study of the linear stability of the toroidal {eta}{sub i} mode and a new rule for choosing the mixing length. It is first shown that the electromagnetic effect gives a significant stabilizing effect on the toroidal {eta}{sub i} mode, and that the observed reduction of {chi}{sub i}(r) in the core region can be explained by this electromagnetic effect. Secondly, in view of earlier numerical simulations showing the transfer of fluctuation energy to larger scales that those for the fastest growth rate, as well as fluctuation measurements indicating longer radial correlation lengths, a new mixing length formula is proposed to explain the radial increase of the {chi}{sub i}. It is shown the new formula fits well the observed {chi}{sub i}(r) profiles in two TFTR supershot discharges and also gives the scaling law in the current and the magnetic field which agrees better with experiment than the conventional formula.

  14. Anomalous dielectric and thermal properties of Ba-doped PbZrO3 ceramics

    Science.gov (United States)

    Pirc, R.; Rožič, B.; Koruza, J.; Cordoyiannis, G.; Malič, B.; Kutnjak, Z.

    2015-11-01

    The dielectric and thermal properties of an antiferroelectric (AFE) material characterised by an intermediate ferroelectric (FE) phase between the AFE and paraelectric phase in zero field are studied by means of a generalised Landau-Kittel model of AFEs. A temperature-dependent coupling of the two sublattices is introduced in accordance with the Rae-Dove (RD) model of re-entrant phase transitions. The sublattice polarisation components are calculated as functions of temperature and the applied electric field by minimising numerically the free energy. The calculated dielectric susceptibility shows anomalies at the boundaries of the intermediate FE phase, characteristic for first-order phase transitions. It is shown that this behaviour is in qualitative agreement with the measured dielectric constant in Ba-doped PbZrO3 ceramics. The model also predicts a negative adiabatic electrocaloric temperature change Δ T in a broad temperature range in the AFE phase, in qualitative agreement with experiments. The dipolar heat capacity is also predicted to be negative in the intermediate phase in zero field, in analogy with the results of the RD model.

  15. Generalized Grüneisen parameters and low temperature limit of lattice thermal expansion of cadmium and zirconium

    Indian Academy of Sciences (India)

    S Sindhu; C S Menon

    2006-09-01

    The generalized Grüneisen parameters ($_{j}^{'}$) and ($_{j}^{''}$) for cadmium and zirconium were calculated from the second- and third-order elastic constants to determine the low temperature limit of the volume thermal expansion of these metals of hexagonal symmetry. The low temperature limit of cadmium and zirconium was calculated to be positive values indicating a positive volume expansion down to 0 K even though many Grüneisen gammas were found to be negative.

  16. Anomalous magnetic moment with heavy virtual leptons

    Energy Technology Data Exchange (ETDEWEB)

    Kurz, Alexander [Karlsruher Institut fuer Technologie (Germany). Inst. fuer Theoretische Teilchenphysik; Deutsches Elektronen-Synchrotron (DESY), Zeuthen (Germany); Liu, Tao; Steinhauser, Matthias [Karlsruher Institut fuer Technologie (Germany). Inst. fuer Theoretische Teilchenphysik; Marquard, Peter [Deutsches Elektronen-Synchrotron (DESY), Zeuthen (Germany)

    2013-11-15

    We compute the contributions to the electron and muon anomalous magnetic moment induced by heavy leptons up to four-loop order. Asymptotic expansion is applied to obtain three analytic expansion terms which show rapid convergence.

  17. Anomalous magnetic moment with heavy virtual leptons

    Energy Technology Data Exchange (ETDEWEB)

    Kurz, Alexander [Institut für Theoretische Teilchenphysik, Karlsruhe Institute of Technology (KIT), 76128 Karlsruhe (Germany); Deutsches Elektronen Synchrotron (DESY), 15738 Zeuthen (Germany); Liu, Tao [Institut für Theoretische Teilchenphysik, Karlsruhe Institute of Technology (KIT), 76128 Karlsruhe (Germany); Marquard, Peter [Deutsches Elektronen Synchrotron (DESY), 15738 Zeuthen (Germany); Steinhauser, Matthias [Institut für Theoretische Teilchenphysik, Karlsruhe Institute of Technology (KIT), 76128 Karlsruhe (Germany)

    2014-02-15

    We compute the contributions to the electron and muon anomalous magnetic moment induced by heavy leptons up to four-loop order. Asymptotic expansion is applied to obtain three analytic expansion terms which show rapid convergence.

  18. Anomalous magnetic moment with heavy virtual leptons

    CERN Document Server

    Kurz, Alexander; Marquard, Peter; Steinhauser, Matthias

    2013-01-01

    We compute the contributions to the electron and muon anomalous magnetic moment induced by heavy leptons up to four-loop order. Asymptotic expansion is applied to obtain three analytic expansion terms which show rapid convergence.

  19. The Coefficients of Thermal Expansion of Boron Arsenide (B12As2) Between 25 C and 850 C

    Energy Technology Data Exchange (ETDEWEB)

    Whiteley, Clinton E. [Kansas State University; Kirkham, Melanie J [ORNL; Edgar, J H [Kansas State University

    2013-01-01

    The semiconductor boron arsenide has a high 10B density, a wide bandgap, and a high melting temperature, all of which make it an interesting candidate for high-temperature electronic devices and radiation detectors. The present investigation was undertaken to determine the coefficients of thermal expansion for boron arsenide. B12As2 powder was synthesized from boron and arsenic heated in a sealed quartz ampoule at 1100 C for 72 hrs with excess boron. Using high temperature X-ray diffraction (HTXRD) between 25 C and 850 C, the average lattice coefficients of thermal expansion were measured perpendicular and parallel to the <111> axis in the rhombohedral setting (equivalent to the a and c axes in the hexagonal setting): 4.9x10-6 K-1 and 5.3x10-6 K-1, respectively. The average unit cell volumetric coefficient of thermal expansion was determined to be 1.5x10-5 K-1.

  20. Synthesis and thermal expansion hysteresis of Ca1–SrZr4P6O24

    Indian Academy of Sciences (India)

    Basavaraj Angadi; V M Jali; M T Lagare; N S Kini; A M Umarji

    2002-06-01

    The low thermal expansion ceramic system, Ca1-SrZr4P6O24, for the compositions with = 0, 0.25, 0.50, 0.75 and 1 was synthesized by solid-state reaction. The sintering characteristics were ascertained by bulk density measurements. The fracture surface microstructure examined by scanning electron microscopy showed the average grain size of 2.47 m for all the compositions. The thermal expansion data for these ceramic systems over the temperature range 25–800°C is reported. The sinterability of various solid solutions and the hysteresis in dilatometric behaviour are shown to be related to the crystallographic thermal expansion anisotropy. A steady increase in the amount of porosity and critical grain size with increase in is suggested to explain the observed decrease in the hysteresis.

  1. The Effect of Compositional Tailoring on the Thermal Expansion and Tribological Properties of PS300: A Solid Lubricant Composite Coating

    Science.gov (United States)

    DellaCorte, C.; Fellenstein, J. A.

    1996-01-01

    This paper describes a research program in which the goal is to alter the thermal expansion coefficient of a composite solid lubricant coating, PS300, by compositional tailoring. PS300 is a plasma sprayed coating consisting of chrome oxide, silver and barium fluoride/calcium fluoride eutectic in NiCr binder. By adjusting the composition, the thermal expansion coefficient can be altered, and hence chosen, to more closely match a selected substrate preventing coating spallation at extreme temperatures. Thermal expansion coefficients (CTE) for a variety of compositions were measured from 25 to 800 C using a commercial dilatometer. The CTE's ranged from 7.0 to 13 x lO(exp -6)/deg C depending on the binder content. Subsequent tribological testing of a modified composition indicated that friction and wear properties were relatively insensitive to compositional tailoring.

  2. Thermal expansion and elastic anisotropy in single crystal Al2O3 and SiC reinforcements

    Science.gov (United States)

    Salem, Jonathan A.; Li, Zhuang; Bradt, Richard C.

    1994-01-01

    In single crystal form, SiC and Al2O3 are attractive reinforcing components for high temperature composites. In this study, the axial coefficients of thermal expansion and single crystal elastic constants of SiC and Al2O3 were used to determine their coefficients of thermal expansion and Young's moduli as a function of crystallographic orientation and temperature. SiC and Al2O3 exhibit a strong variation of Young's modulus with orientation; however, their moduli and anisotropies are weak functions of temperature below 1000 C. The coefficients of thermal expansion exhibit significant temperature dependence, and that of the non-cubic Al2O3 is also a function of crystallographic orientation.

  3. Phonon and thermal expansion properties in Weyl semimetals MX (M = Nb, Ta; X = P, As): ab initio studies.

    Science.gov (United States)

    Chang, Dahu; Liu, Yaming; Rao, Fengfei; Wang, Fei; Sun, Qiang; Jia, Yu

    2016-06-07

    Weyl semimetal (WSM) is a new type of topological quantum material for future spintronic devices. Using the first-principles density functional theory, we systematically investigated the thermal expansion properties, and the temperature dependence of isovolume heat capacity and bulk modulus in WSMs MX (M = Nb, Ta; X = P, As). We also presented the phonon dispersion curves and its variation under stress in MX and the anisotropic thermal expansion properties due to the anisotropic crystal structure in WSMs have been predicted in our calculations. Intriguing, we found that the heat capacities increase more rapidly with increasing temperature in the low temperature region for all MX. Furthermore, our results showed that the thermal expansion properties are determined mainly by the isovolume heat capacity at low temperatures, while the bulk modulus has the major effect at high temperatures. These results are useful for applications of WSMs in electronic and spintronic devices.

  4. Size- and temperature-dependent Young's modulus and size-dependent thermal expansion coefficient of thin films.

    Science.gov (United States)

    Zhou, Xiao-Ye; Huang, Bao-Ling; Zhang, Tong-Yi

    2016-08-21

    Nanomaterials possess a high surface/volume ratio and surfaces play an essential role in size-dependent material properties. In the present study, nanometer-thick thin films were taken as an ideal system to investigate the surface-induced size- and temperature-dependent Young's modulus and size-dependent thermal expansion coefficient. The surface eigenstress model was further developed with the consideration of thermal expansion, leading to analytic formulas of size- and temperature-dependent Young's modulus, and size-dependent thermal expansion coefficient of thin films. Molecular dynamics (MD) simulations on face-centered cubic (fcc) Ag, Cu, and Ni(001) thin films were conducted at temperatures ranging from 300 K to 600 K. The MD simulation results are perfectly consistent with the theoretical predictions, thereby verifying the theoretical approach. The newly developed surface eigenstress model will be able to attack similar problems in other types of nanomaterials.

  5. Thermal expansion behavior of co-extruded wood-plastic composites with glass-fiber reinforced shells

    Directory of Open Access Journals (Sweden)

    Runzhou Huang

    2012-11-01

    Full Text Available Coextruded wood-plastic composites (WPCs with glass-fiber (GF filled shells were manufactured, and their thermal expansion behavior was studied. A three-dimensional finite element model (FEM considering differential properties of both shell and core layers was developed to predict the linear coefficient of thermal expansion (LCTE of the material. It was shown that the LCTE values varied with composite structure and composition (i.e., core-shell thicknesses and materials. The use of GF-filled shells helped lower overall composite LCTE values. The imbalance of shell and core LCTE, and their moduli led to complex stress fields within a given composite system. The FEM predicted a trend of LCTE change with varying composite structures, which was in good agreement with the experimental data. This study provides for the first time a finite element modeling technique to optimize raw material composition and composite structure for optimizing thermal expansion behavior of co-extruded WPCs.

  6. Recent Advances in Understanding of Thermal Expansion Effects in Premixed Turbulent Flames

    Science.gov (United States)

    Sabelnikov, Vladimir A.; Lipatnikov, Andrei N.

    2017-01-01

    When a premixed flame propagates in a turbulent flow, not only does turbulence affect the burning rate (e.g., by wrinkling the flame and increasing its surface area), but also the heat release in the flame perturbs the pressure field, and these pressure perturbations affect the turbulent flow and scalar transport. For instance, the latter effects manifest themselves in the so-called countergradient turbulent scalar flux, which has been documented in various flames and has challenged the combustion community for approximately 35 years. Over the past decade, substantial progress has been made in investigating (a) the influence of thermal expansion in a premixed flame on the turbulent flow and turbulent scalar transport within the flame brush, as well as (b) the feedback influence of countergradient scalar transport on the turbulent burning rate. The present article reviews recent developments in this field and outlines issues to be solved in future research.

  7. Models of coefficient of thermal expansion (CTE) for Gilsocarbon graphites irradiated in inert and oxidising environments

    Energy Technology Data Exchange (ETDEWEB)

    Eason, Ernest D., E-mail: eeason@ix.netcom.com [Modeling and Computing Services, P.O. Box 18583, Boulder, CO 80308 (United States); Hall, Graham N., E-mail: graham.n.hall@manchester.ac.uk [Nuclear Graphite Research Group, School of Mechanical, Aerospace and Civil Engineering, University of Manchester, Manchester M13 9PL (United Kingdom); Marsden, Barry J., E-mail: barry.j.marsden@manchester.ac.uk [Nuclear Graphite Research Group, School of Mechanical, Aerospace and Civil Engineering, University of Manchester, Manchester M13 9PL (United Kingdom); Heys, Graham B., E-mail: Graham.Heys@hse.gsi.gov.uk [Office for Nuclear Regulation, An Agency of the Health and Safety Executive, Building 3, Redgrave Court, Merton Road, Bootle, Merseyside L20 7HS (United Kingdom)

    2013-05-15

    This paper presents the development and validation of an empirical model of radiation effects on coefficient of thermal expansion (CTE) for the Gilsocarbon graphites used in Advanced Gas-cooled Reactors (AGRs). The combined irradiation and oxidation model is based in part on a new model of fast neutron damage in inert environment. The new inert model shows an increase to an “upper shelf” irradiated CTE value at very low dose, then CTE values decrease with increasing dose following a hyperbolic tangent function. The effect of the actual exposure in AGRs is modelled by shifting the inert model in both dose and CTE directions to agree with the CTE measurements on material trepanned from moderator bricks in operating AGRs. The shift in the inert model that is needed to match the trepanned data varies significantly by reactor. The new model predicts randomly-selected validation data that were not used in model fitting as well as it fits the calibration data.

  8. A uniaxial stress capacitive dilatometer for high-resolution thermal expansion and magnetostriction under multiextreme conditions

    Science.gov (United States)

    Küchler, R.; Stingl, C.; Gegenwart, P.

    2016-07-01

    Thermal expansion and magnetostriction are directional dependent thermodynamic quantities. For the characterization of novel quantum phases of matter, it is required to study materials under multi-extreme conditions, in particular, down to very low temperatures, in very high magnetic fields or under high pressure. We developed a miniaturized capacitive dilatometer suitable for temperatures down to 20 mK and usage in high magnetic fields, which exerts a large spring force between 40 to 75 N on the sample. This corresponds to a uniaxial stress up to 3 kbar for a sample with cross section of (0.5 mm)2. We describe design and performance test of the dilatometer which resolves length changes with high resolution of 0.02 Å at low temperatures. The miniaturized device can be utilized in any standard cryostat, including dilution refrigerators or the commercial physical property measurement system.

  9. Young's modulus and thermal expansion of ceramic samples made from kaolin and zeolite

    Science.gov (United States)

    Sunitrová, Ivana; Trník, Anton

    2016-07-01

    In this study we investigate the dependence of Young's modulus, mass change, and thermal expansion of ceramic samples made from a varying amount of kaolin (100 - 50 %) and zeolite (0 - 50 %) on the firing temperature. The samples are fired in a furnace at different temperatures from room temperature up to 1100 °C with a heating rate of 5°C.min-1 and 5 min soaking time at the highest temperature. Afterwards, the samples are freely cooled down and their mass, dimensions and resonant frequency are measured at room temperature. The resonant frequency (from which Young's modulus is calculated) is measured using an apparatus based on the impulse excitation technique (IET). Young's modulus of green samples is the highest for the sample containing 10 mass% of zeolite (3.2 GPa). After sintering the sample with 50 mass% of zeolite has the highest value (11.3 GPa).

  10. Perturbative Non-Equilibrium Thermal Field Theory to all Orders in Gradient Expansion

    CERN Document Server

    Millington, Peter

    2013-01-01

    We present a new perturbative formulation of non-equilibrium thermal field theory, based upon non-homogeneous free propagators and time-dependent vertices. The resulting time-dependent diagrammatic perturbation series are free of pinch singularities without the need for quasi-particle approximation or effective resummation of finite widths. After arriving at a physically meaningful definition of particle number densities, we derive master time evolution equations for statistical distribution functions, which are valid to all orders in perturbation theory and to all orders in a gradient expansion. For a scalar model, we perform a loopwise truncation of these evolution equations, whilst still capturing fast transient behaviour, which is found to be dominated by energy-violating processes, leading to the non-Markovian evolution of memory effects.

  11. Controlled thermal expansion printed wiring boards based on liquid crystal polymer dielectrics

    Science.gov (United States)

    Knoll, Thomas E.; Blizard, Kent; Jayaraj, K.; Rubin, Leslie S.

    1994-01-01

    Dielectric materials based on innovative Liquid Crystal Polymers (LCP's) have been used to fabricate surface mount printed wiring boards (PWB's) with a coefficient of thermal expansion matched to leadless ceramic chip carriers. Proprietary and patented polymer processing technology has resulted in self reinforcing material with balanced in-plane mechanical properties. In addition, LCP's possess excellent electrical properties, including a low dielectric constant (less than 2.9) and very low moisture absorption (less than 0.02%). LCP-based multilayer boards processed with conventional drilling and plating processes show improved performance over other materials because they eliminate the surface flatness problems of glass or aramid reinforcements. Laser drilling of blind vias in the LCP dielectric provides a very high density for use in direct chip attach and area array packages. The material is ideally suited for MCM-L and PCMCIA applications fabricated with very thin dielectric layers of the liquid crystal polymer.

  12. Transverse Coefficient of Thermal Expansion Measurements of Carbon Fibers Using ESEM at High Temperatures

    Science.gov (United States)

    Ochoa, O.; Jiang, J.; Putnam, D.; Lo, Z.; Ellis, A.; Effinger, Michael

    2003-01-01

    The transverse coefficient of thermal expansion (CTE) of single IM7, T1000, and P55 carbon fibers are measured at elevated temperatures. The specimens are prepared by press-fitting fiber tows into 0.7mm-diameter cavity in a graphite disk of 5mm in diameter and 3mm high. The specimens are placed on a crucible in an ESEM, and images of the fiber cross section are taken as the fibers are heated up to 800 C. Holding time, heating and cool down cycles are also introduced. The geometrical changes are measured using a graphics tablet. The change in area/perimeter is calculated to determine the strain and transverse CTE for each fiber. In a complimentary computational effort, displacements and stresses are calculated with finite element models.

  13. Multilayer Article Characterized by Low Coefficient of Thermal Expansion Outer Layer

    Science.gov (United States)

    Lee, Kang N. (Inventor)

    2004-01-01

    A multilayer article comprises a substrate comprising a ceramic or a silicon-containing metal alloy. The ceramic is a Si-containing ceramic or an oxide ceramic with or without silicon. An outer layer overlies the substrate and at least one intermediate layer is located between the outer layer and thc substrate. An optional bond layer is disposed between thc 1 least one intermediate layer and thc substrate. The at least one intermediate layer may comprise an optional chemical barrier layer adjacent the outer layer, a mullite-containing layer and an optional chemical barrier layer adjacent to the bond layer or substrate. The outer layer comprises a compound having a low coefficient of thermal expansion selected from one of the following systems: rare earth (RE) silicates; at least one of hafnia and hafnia-containing composite oxides; zirconia-containing composite oxides and combinations thereof.

  14. Thermal expansion coefficient of graphene using molecular dynamics simulation: A comparative study on potential functions

    Science.gov (United States)

    Ghasemi, Hamid; Rajabpour, Ali

    2017-01-01

    In this paper, we studied the thermal expansion coefficient (TEC) of pristine graphene sheets (GSs) using molecular dynamics (MD) simulation. We validated our model with previous studies employing AIREBO potential function and repeated the same simulation with the optimized Tersoff potential function. We also discussed the differences of the results and the corresponding reasons: evaluating the negative TEC of graphene by measuring the C-C bond length and out-of-plane vibrations of the GS. We finally showed that the ripples and wrinkles are more represented over the GS during the simulation with the AIREBO potential function rather than the optimized Tersoff. Comparing the results of both potential functions; it is seen that the results obtained by AIREBO potential function are in better agreement with those reported by previous scholars.

  15. The influence of ceramic fibre on thermal expansion of moulding materials for investment casting technology

    Directory of Open Access Journals (Sweden)

    Nadolski M.

    2009-04-01

    Full Text Available The results of dilatometric measurements presented in the paper are a supplement to the investigations concerning broadening thecomposition of ceramic slurry intended for investment casting technology with ceramic fibre matrix. An applying of fibre material and a change of rheologic characteristics of ceramic slurry have impelled to develop the method of applying the material to the pattern sets. The technology of multi-layer spraying has been found to be the most favourable method. Partial replacing of the grain silica materials with aluminosilicate materials in the fibrous form has affected the magnitude of dimensional changes taking place during the heating process. In order to determine the magnitude of these changes, there have been prepared slurries of various fibre fraction in the matrix and their thermal expansion has been examined within the temperature range of 273-1273 K

  16. Negative thermal expansion in hybrid improper ferroelectric Ruddlesden-Popper perovskites by symmetry trapping.

    Science.gov (United States)

    Senn, M S; Bombardi, A; Murray, C A; Vecchini, C; Scherillo, A; Luo, X; Cheong, S W

    2015-01-23

    We present new results on the microscopic nature of the ferroelectricity mechanisms in Ca3 Mn2O7 and Ca3Ti2O7. To the first approximation, we confirm the hybrid improper ferroelectric mechanism recently proposed by Benedek and Fennie for these Ruddlesden-Popper compounds. However, in Ca3Mn2O7 we find that there is a complex competition between lattice modes of different symmetry which leads to a phase coexistence over a large temperature range and the "symmetry trapping" of a soft mode. This trapping of the soft mode leads to a large uniaxial negative thermal expansion (NTE) reaching a maximum between 250 and 350 K (3.6×10^(-6)  K^{-1}) representing the only sizable NTE reported for these and related perovskite materials to date. Our results suggest a systematic strategy for designing and searching for ceramics with large NTE coefficients.

  17. Electrical Transport and Thermal Expansion in van der Waals Materials: Graphene and Topological Insulator

    Science.gov (United States)

    Jing, Lei

    Novel two-dimensional materials with weak interlayer Van der Waals interaction are fantastic platforms to study novel physical phenomena. This thesis describes our investigation on two different Van der Waals materials: graphene and bismuth selenide with calcium doping (CaxBi 2-xSe3, x as the doping level) in the topological insulator family. Firstly, we characterize the electrical transport behaviors of high-quality substrate-supported bilayer graphene devices with suspended metal gates. The device exhibits a transport gap induced by external electric field with an on/off ratio of 20,000, which could be explained by variable range hoping between localized states or disordered charge puddles. At large magnetic field, the device presents quantum Hall plateau at fractional values of conductance quantum, which arises from the equilibration of edge states between differentially doped regions. Secondly, we present our study on the electronic transport of CaxBi 2-xSe3 thin films, which are three-dimensional topological insulators and coupled with superconducting leads. In these novel Josephson transistors, we observe different characteristic features by energy dispersion spectrum (EDS) and Raman spectroscopy, and the weak suppression in the critical current Ic. Thirdly, we explore the thermal expansion of suspended graphene. By in-situ scanning electron microscope (SEM), we measure the thickness-dependence of graphene's negative thermal expansion coefficient (TEC). We propose that there is a competitive relation between the intrinsic TEC and the friction from the substrate and the graphene. Lastly, in collaboration with Dr. Nikolai Kalugin from New Mexico Tech., we explore the graphene's application as a quantum Hall effect infrared photodetector. This graphene-based detector can be operated at higher temperature (liquid nitrogen) and wider frequency than the previous implementations of quantum Hall detector.

  18. Universality of anomalous conductivities in theories with higher-derivative holographic duals

    CERN Document Server

    Grozdanov, Sašo

    2016-01-01

    Anomalous chiral conductivities in theories with global anomalies are independent of whether they are computed in a weakly coupled quantum (or thermal) field theory, hydrodynamics, or at infinite coupling from holography. While the presence of dynamical gauge fields and mixed, gauge-global anomalies can destroy this universality, in their absence, the non-renormalisation of anomalous Ward identities is expected to be obeyed at all intermediate coupling strengths. In holography, bulk theories with higher-derivative corrections incorporate coupling constant corrections to the boundary theory observables in an expansion around infinite coupling. In this work, we investigate the coupling constant dependence and universality of anomalous conductivities (and thus of the anomalous Ward identities) in general, four-dimensional systems that possess asymptotically anti-de Sitter holographic duals with a non-extremal black brane in five dimensions, and anomalous transport introduced into the boundary theory via the bulk...

  19. A model for the computation of thermal expansivity at high compression and high temperatures - MGO as an example

    Science.gov (United States)

    Anderson, Orson L.; Oda, Hitoshi; Isaak, Donald

    1992-10-01

    The value of the thermal expansivity, alpha, over a wide range of compression, eta, and temperature is computed. Values of alpha for MgO over V,P,T conditions including those of the earth's lower mantle are suggested using a simple equation relating alpha to eta along isochores. The ab initio database is used to evaluate the parameters in the equation. The thermal expansivity is found to vary from about 1.40 alpha(a) to 0.40 alpha(a) along a geotherm through the upper and lower mantle, where alpha(a) is alpha at ambient conditions.

  20. A model to estimate volume change due to radiolytic gas bubbles and thermal expansion in solution reactors

    Energy Technology Data Exchange (ETDEWEB)

    Souto, F.J. [NIS-6: Advanced Nuclear Technology, Los Alamos National Lab., Los Alamos, NM (United States); Heger, A.S. [ESA-EA: Engineering Sciences and Application, Los Alamos National Lab., Los Alamos, NM (United States)

    2001-07-01

    To investigate the effects of radiolytic gas bubbles and thermal expansion on the steady-state operation of solution reactors at the power level required for the production of medical isotopes, a calculational model has been developed. To validate this model, including its principal hypotheses, specific experiments at the Los Alamos National Laboratory SHEBA uranyl fluoride solution reactor were conducted. The following sections describe radiolytic gas generation in solution reactors, the equations to estimate the fuel solution volume change due to radiolytic gas bubbles and thermal expansion, the experiments conducted at SHEBA, and the comparison of experimental results and model calculations. (author)

  1. Technique for reduction of mechanical losses in AC superconducting coils due to thermal expansion properties of various FRP bobbins

    Science.gov (United States)

    Sekine, N.; Tada, S.; Higuchi, T.; Furumura, Y.; Takao, T.; Yamanaka, A.

    2005-10-01

    We reported about reduction of mechanical losses in AC superconducting coils. The method is the use of FRP bobbins fabricated with special fibers. Since their FRPs have negative thermal expansion coefficient to the fiber direction, the FRP bobbins expand to the circumferential direction during cooling down. In case of the superconducting coils with such FRP bobbins, the winding tensions do not decrease during cooling down. Therefore, the mechanical losses are reduced by the suppression of wire's vibration. Their special FRPs are a Dyneema® fiber reinforced plastic (DFRP), a Dyneema and glass fiber reinforced plastic (DGFRP), and a Zylon® fiber reinforced plastic (ZFRP). These materials have negative thermal expansion coefficient to the fiber direction, however, the amplitudes of thermal expansion are various by the quantity or quality of the fiber. In this paper, the values of thermal expansion were actually measured, and it was discussed about the influence on the mechanical losses. At the experimental results, the mechanical loss was small, so that the thermal strain to the circumferential direction on the coil was large. Moreover, in case of the coils with sufficiently strong winding tensions at coil-operating temperature, the mechanical losses vanished.

  2. Technique for reduction of mechanical losses in AC superconducting coils due to thermal expansion properties of various FRP bobbins

    Energy Technology Data Exchange (ETDEWEB)

    Sekine, N. [Tsukamoto Laboratory, Faculty of Engineering, Yokohama National University, 79-5, Tokiwadai, Hodogaya-ku, Yokohama 240-8501 (Japan)]. E-mail: n-sekine@tsukalab.dnj.ynu.ac.jp; Tada, S. [Sophia University, 7-1, Kioicho, Chiyoda-ku, Tokyo 102-8554 (Japan); Higuchi, T. [Sophia University, 7-1, Kioicho, Chiyoda-ku, Tokyo 102-8554 (Japan); Furumura, Y. [Sophia University, 7-1, Kioicho, Chiyoda-ku, Tokyo 102-8554 (Japan); Takao, T. [Sophia University, 7-1, Kioicho, Chiyoda-ku, Tokyo 102-8554 (Japan); Yamanaka, A. [Research Center, Toyobo, Co., Ltd, 2-1-1, Katata, Otsu, Shiga 520-0292 (Japan)

    2005-10-01

    We reported about reduction of mechanical losses in AC superconducting coils. The method is the use of FRP bobbins fabricated with special fibers. Since their FRPs have negative thermal expansion coefficient to the fiber direction, the FRP bobbins expand to the circumferential direction during cooling down. In case of the superconducting coils with such FRP bobbins, the winding tensions do not decrease during cooling down. Therefore, the mechanical losses are reduced by the suppression of wire's vibration. Their special FRPs are a Dyneema[reg] fiber reinforced plastic (DFRP), a Dyneema and glass fiber reinforced plastic (DGFRP), and a Zylon[reg] fiber reinforced plastic (ZFRP). These materials have negative thermal expansion coefficient to the fiber direction, however, the amplitudes of thermal expansion are various by the quantity or quality of the fiber. In this paper, the values of thermal expansion were actually measured, and it was discussed about the influence on the mechanical losses. At the experimental results, the mechanical loss was small, so that the thermal strain to the circumferential direction on the coil was large. Moreover, in case of the coils with sufficiently strong winding tensions at coil-operating temperature, the mechanical losses vanished.

  3. Atomic Linkage Flexibility Tuned Isotropic Negative, Zero, and Positive Thermal Expansion in MZrF6 (M = Ca, Mn, Fe, Co, Ni, and Zn).

    Science.gov (United States)

    Hu, Lei; Chen, Jun; Xu, Jiale; Wang, Na; Han, Fei; Ren, Yang; Pan, Zhao; Rong, Yangchun; Huang, Rongjin; Deng, Jinxia; Li, Laifeng; Xing, Xianran

    2016-11-09

    The controllable isotropic thermal expansion with a broad coefficient of thermal expansion (CTE) window is intriguing but remains challenge. Herein we report a cubic MZrF6 series (M = Ca, Mn, Fe, Co, Ni and Zn), which exhibit controllable thermal expansion over a wide temperature range and with a broader CTE window (-6.69 to +18.23 × 10(-6)/K). In particular, an isotropic zero thermal expansion (ZTE) is achieved in ZnZrF6, which is one of the rarely documented high-temperature isotropic ZTE compounds. By utilizing temperature-dependent high-energy synchrotron X-ray total scattering diffraction, it is found that the flexibility of metal···F atomic linkages in MZrF6 plays a critical role in distinct thermal expansions. The flexible metal···F atomic linkages induce negative thermal expansion (NTE) for CaZrF6, whereas the stiff ones bring positive thermal expansion (PTE) for NiZrF6. Thermal expansion could be transformed from striking negative, to zero, and finally to considerable positive though tuning the flexibility of metal···F atomic linkages by substitution with a series of cations on M sites of MZrF6. The present study not only extends the scope of NTE families and rare high-temperature isotropic ZTE compounds but also proposes a new method to design systematically controllable isotropic thermal expansion frameworks from the perspective of atomic linkage flexibility.

  4. Cryogenic Refractive Index and Coefficient of Thermal Expansion for the S-TIH1 Glass

    Science.gov (United States)

    Quijada, Manuel A.; Leviton, Douglas; Content, David

    2013-01-01

    Using the CHARMS facility at NASA GSFC, we have measured the cryogenic refractive index of the Ohara S-TIH1 glass from 0.40 to 2.53 micrometers and from 120 to 300 K. We have also examined the spectral dispersion and thermo-optic coefficients (dn/dT). We also derived temperature-dependent Sellmeier models from which refractive index may be calculated for any wavelength and temperature within the stated ranges of each model. The S-TIH1 glass we tested exhibited unusual behavior in the thermo-optic coefficient. We found that for delta index of refraction decrease with a decrease in temperature (positive dn/dT). However, the situation was reversed for delta larger than 0.63 micrometers, where the index will increase with a decrease in temperature (negative dn/dT). We also measured the coefficient of thermal expansion (CTE) for the similar batch of S-TIH1 glass in order to understand its thermal properties. The CTE showed a monotonic change with a decrease in temperature.

  5. Lattice thermal expansion and anisotropic displacements in 𝜶-sulfur from diffraction experiments and first-principles theory

    Science.gov (United States)

    George, Janine; Deringer, Volker L.; Wang, Ai; Müller, Paul; Englert, Ulli; Dronskowski, Richard

    2016-12-01

    Thermal properties of solid-state materials are a fundamental topic of study with important practical implications. For example, anisotropic displacement parameters (ADPs) are routinely used in physics, chemistry, and crystallography to quantify the thermal motion of atoms in crystals. ADPs are commonly derived from diffraction experiments, but recent developments have also enabled their first-principles prediction using periodic density-functional theory (DFT). Here, we combine experiments and dispersion-corrected DFT to quantify lattice thermal expansion and ADPs in crystalline α-sulfur (S8), a prototypical elemental solid that is controlled by the interplay of covalent and van der Waals interactions. We begin by reporting on single-crystal and powder X-ray diffraction measurements that provide new and improved reference data from 10 K up to room temperature. We then use several popular dispersion-corrected DFT methods to predict vibrational and thermal properties of α-sulfur, including the anisotropic lattice thermal expansion. Hereafter, ADPs are derived in the commonly used harmonic approximation (in the computed zero-Kelvin structure) and also in the quasi-harmonic approximation (QHA) which takes the predicted lattice thermal expansion into account. At the PPBE+D3(BJ) level, the QHA leads to excellent agreement with experiments. Finally, more general implications of this study for theory and experiment are discussed.

  6. Negative thermal expansion and spontaneous volume magnetostriction of Tb{sub 2}Fe{sub 16}Cr compound

    Energy Technology Data Exchange (ETDEWEB)

    Hao Yanming [Department of Physics, Tianjin Normal University, Tianjin 300074 (China)]. E-mail: zhao.miao@126.com; Zhao Miao [Department of Physics, Tianjin Normal University, Tianjin 300074 (China); Zhou Yan [Department of Physics, Tianjin Normal University, Tianjin 300074 (China); Hu Jifan [Department of Physics, Shandong University, Jinan, 250100 (China)

    2005-08-15

    The compound Tb{sub 2}Fe{sub 16}Cr has a hexagonal Th{sub 2}Ni{sub 17}-type structure. Negative thermal expansion was found at 292-556 K. Magnetization measurements show that a Cr atom substituting for a Fe atom increases the Curie temperature of the Tb{sub 2}Fe{sub 17} compound.

  7. Crystal Structure and Thermal Expansion Properties of Lu_(2-x)Fe_xMo_3O_(12)

    Institute of Scientific and Technical Information of China (English)

    2011-01-01

    Low or zero thermal expansion materials have a lot of potential applications in space shuttle, microelectronic components, and optical mirrors et al. Polycrystalline samples Lu2-xFexMo3O12 have been prepared successfully by solid state reaction,

  8. Measurements of the densities, isobaric thermal expansion coefficients and isothermal compressibilities of linear alkylbenzene in large liquid scintillator detectors

    CERN Document Server

    Zhou, Xiang; Liu, Qian; Zhang, Zhenyu; Ding, Yayun; Zhou, Li; Cao, Jun

    2014-01-01

    We report the measurements of the densities of linear alkylbenzene at three temperatures over 4 to 23 Celsius degree with pressures up to 10 MPa. The measurements have been analysed to yield the isobaric thermal expansion coefficients and, so far for the first time, isothermal compressibilities of linear alkylbenzene.

  9. Microwave measurements of the length and thermal expansion of a cylindrical resonator for primary acoustic gas thermometry

    Science.gov (United States)

    Zhang, K.; Feng, X. J.; Zhang, J. T.; Lin, H.; Duan, Y. N.; Duan, Y. Y.

    2017-01-01

    In the application of acoustic gas thermometry to determine the Boltzmann constant and thermodynamic temperatures using resonant cavities, the internal dimensions or the thermal expansion of the cavity have to be known accurately. For this purpose, measurement of the microwave resonances has proved to be an accurate and convenient experimental technique for dimensional measurement of acoustic resonators. We report measurements of the length and longitudinal thermal expansion of a prototype cylindrical cavity made of oxygen-free copper. We studied four non-degenerate transverse magnetic modes for three isotherms at 243, 258 and 273 K. Two procedures were investigated for calculating the length and longitudinal thermal expansion of the cavity at the temperatures examined. The results from both methods agree well. The relative standard uncertainties for the measurements of length and longitudinal thermal expansion are less than 0.47  ×  10-6 and 0.04  ×  10-6, respectively, from 243 to 273 K. The low uncertainty achieved here provides confidence to pursue a determination of the Boltzmann constant and thermodynamic temperature with a cylindrical cavity and microwave techniques.

  10. Study on thermal expansion behavior of Dy2O3- Al2O3- SiO2 glass

    Institute of Scientific and Technical Information of China (English)

    LIU Yuzhu; GENG Zhiting; ZHUANG Weidong; HE Huaqiang

    2008-01-01

    Employing Dy2O3, Al2O3, and SiO2 as starting materials, several series of Dy2O3-Al2O3-SiO2 sealing glass were prepared. The relationship between their coefficients of thermal expansion and the contents of Dy2O3, Al2O3, and SiO2 were studied respectively. Experimental results showed that Dy2O3 and Al2O3 had a positive effect on the coefficient of thermal expansion of glass, whereas, SiO2 had a negative effect. The coefficient of thermal expansion of glass showed an apparent linear relation to the contents of these three raw materials, from which an estimation model was built, to calculate the coefficient of thermal expansion of sealing glass. Relative errors of the calculating resalts to testing results were no more than 2%, which suggested that the estimation model was reasonable. This study provides a good theory reference for the practical utilizing of this sealing material, through which a proper glass composition for good sealing could be easily found.

  11. A MODEL TO ESTIMATE VOLUME CHANGE DUE TO RADIOLYTIC GAS BUBBLES AND THERMAL EXPANSION IN SOLUTION REACTORS

    Energy Technology Data Exchange (ETDEWEB)

    F. SOUTO; A HEGER

    2001-02-01

    Aqueous homogeneous solution reactors have been proposed for the production of medical isotopes. However, the reactivity effects of fuel solution volume change, due to formation of radiolytic gas bubbles and thermal expansion, have to be mitigated to allow steady-state operation of solution reactors. The results of the free run experiments analyzed indicate that the proposed model to estimate the void volume due to radiolytic gas bubbles and thermal expansion in solution reactors can accurately describe the observed behavior during the experiments. This void volume due to radiolytic gas bubbles and fuel solution thermal expansion can then be used in the investigation of reactivity effects in fissile solutions. In addition, these experiments confirm that the radiolytic gas bubbles are formed at a higher temperature than the fuel solution temperature. These experiments also indicate that the mole-weighted average for the radiolytic gas bubbles in uranyl fluoride solutions is about 1 {micro}m. Finally, it should be noted that another model, currently under development, would simulate the power behavior during the transient given the initial fuel solution level and density. The model is based on Monte Carlo simulation with the MCNP computer code [Briesmeister, 1997] to obtain the reactor reactivity as a function of the fuel solution density, which, in turn, changes due to thermal expansion and radiolytic gas bubble formation.

  12. The Effect of Fluid Thermal Expansivity on Thermo-mechanical Solitary Shock Waves in the Underground of Volcanic Domains

    Science.gov (United States)

    Natale, G.

    This work is a further development of the modern thermo-poro-elasticity theory which has recently been applied to understand how fluid-rock coupling dynamics related to unrest episodes in volcanic domains can both determine, and occur with, ground deformation and rock fracturing processes. In particular by reformulating the energy equation, one of the two nonlinear heat-like equations upon which the thermo-poroelasticity theory is based, it is shown here how fluid thermal expansivity may influence fluid migration during its movement through subsurface volcanic porous-per meable horizons. With these new considerations it is found that a recent theory in which fluid-rock coupling dynamics is interpreted in terms of thermal and mechanical solitary shock wave propagation remains valid. However, the natural time scale of the propagating wave is reduced and consequently Darcy's velocity is increased as a result of fluid thermal expansivity.

  13. First-principles investigation of negative thermal expansion in II-VI semiconductors

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Lei [International Laboratory for Quantum Functional Materials of Henan, Zhengzhou University, Zhengzhou 450001 (China); Yuan, Peng-Fei; Wang, Fei; Sun, Qiang [International Laboratory for Quantum Functional Materials of Henan, Zhengzhou University, Zhengzhou 450001 (China); Center for Clean Energy and Quantum Structures, and School of Physics and Engineering, Zhengzhou University, Zhengzhou 450052 (China); Guo, Zheng-Xiao [Deparment of Chemistry, University College London, London WCIHOAJ (United Kingdom); Liang, Er-Jun, E-mail: ejliang@zzu.edu.cn [International Laboratory for Quantum Functional Materials of Henan, Zhengzhou University, Zhengzhou 450001 (China); Center for Clean Energy and Quantum Structures, and School of Physics and Engineering, Zhengzhou University, Zhengzhou 450052 (China); Jia, Yu, E-mail: jiayu@zzu.edu.cn [International Laboratory for Quantum Functional Materials of Henan, Zhengzhou University, Zhengzhou 450001 (China); Center for Clean Energy and Quantum Structures, and School of Physics and Engineering, Zhengzhou University, Zhengzhou 450052 (China)

    2014-11-14

    Within the framework of first-principles, all II-VI semiconductors with cubic zinc blende structure have negative thermal expansion (NTE) behavior at low temperatures. Negative mode Grüneisen parameters are found for two transverse acoustic (TA) branches near the Brillouin-zone boundaries. Through the analysis of vibrational modes, it shows that the librational mode which brings about the bond tension effect by atomic motions perpendicular to the bonds can contribute to the NTE. Related thermodynamic properties of II-VI semiconductors have also been studied. It is demonstrated that with increased ionic radius and atomic mass, the variety of electronegativity can cause more covalent character in bonding nature, weaker interatomic force constants and lower frequencies in lattice vibrations. Thus, despite the same vibrational modes, II-VI semiconductors can present different NTE behavior and thermodynamic properties. - Highlights: • The NTE properties of II-VI semiconductors are investigated by first-principles calculation. • Negative mode Grüneisen parameters are found for two TA branches. • The librational mode can contribute to the NTE behavior. • Various ionic radius and electronegativity can cause different NTE behavior and thermodynamic properties.

  14. Magnus Expansion Approach to Parametric Oscillator Systems in a Thermal Bath

    Science.gov (United States)

    Zhu, Beilei; Rexin, Tobias; Mathey, Ludwig

    2016-10-01

    We develop a Magnus formalism for periodically driven systems which provides an expansion both in the driving term and in the inverse driving frequency, applicable to isolated and dissipative systems. We derive explicit formulas for a driving term with a cosine dependence on time, up to fourth order. We apply these to the steady state of a classical parametric oscillator coupled to a thermal bath, which we solve numerically for comparison. Beyond dynamical stabilisation at second order, we find that the higher orders further renormalise the oscillator frequency, and additionally create a weakly renormalised effective temperature. The renormalised oscillator frequency is quantitatively accurate almost up to the parametric instability, as we confirm numerically. Additionally, a cut-off dependent term is generated, which indicates the break down of the hierarchy of time scales of the system, as a precursor to the instability. Finally, we apply this formalism to a parametrically driven chain, as an example for the control of the dispersion of a many-body system.

  15. Crystal electric field effects and thermal expansion of rare-earth hexaborides

    Science.gov (United States)

    Novikov, V. V.; Pilipenko, E. S.; Bud'ko, S. L.

    2017-02-01

    Anomalies in the magnetic contribution to the thermal expansion coefficients ∆β(T)of the CeB6, PrB6, and NdB6 hexaborides in the range of 5-300 K were found by comparison with diamagnetic LaB6. The characteristic of the anomalies was the same in all the studied borides: a distinct peak at low temperatures, followed by a broad maximum at higher temperatures (50-100 K), then a decrease and transition to the region of negative values as the temperature increases further. The features of ∆β(T) are explained by the effects of the magnetic order (sharp low temperature peaks) and the crystal electric field (CEF). The βCEF(T) dependencies were calculated using Raman and neutron scattering data on the splitting of the rare-earth (RE) ions R3+ f-level by the CEF. A satisfactory consistency between the values of βCEF(T) and ∆β(T)was obtained for the studied hexaborides. Additionally, we determined the values of the Grüneisen parameter γi that correspond to the transition between the ground and excited multiplets of R3+ ions f-level splitting.

  16. A compact and miniaturized high resolution capacitance dilatometer for measuring thermal expansion and magnetostriction.

    Science.gov (United States)

    Küchler, R; Bauer, T; Brando, M; Steglich, F

    2012-09-01

    We describe the design, construction, calibration, and two different applications of a miniature capacitance dilatometer. The device is suitable for thermal expansion and magnetostriction measurements from 300 K down to about 25 mK, with a resolution of 0.02 Å at low temperatures. The main body of the dilatometer is fabricated from a single block of a Be-Cu alloy by electrical discharge milling. This creates an extremely compact high-resolution measuring cell. We have successfully tested and operated dilatometers of this new type with the commonly used physical property measurement system by quantum design, as well as with several other cryogenic refrigeration systems down to 25 mK and in magnetic fields up to 20 T. Here, the capacitance is measured with a commercially available capacitance bridge. Using a piezoelectric rotator from Attocube Systems, the cell can be rotated at T = 25 mK inside of an inner vacuum chamber of 40 mm diameter. The miniaturized design for the one-axis rotation setup allows a rotation of 360°.

  17. Microstructure and thermal expansion of Ti coated diamond/Al composites

    Institute of Scientific and Technical Information of China (English)

    YANG Bo; YU Jia-kang; CHEN Chuang

    2009-01-01

    A titanium coating fabricated via vacuum vapor deposition for diamond/Al composites was used to improve the interfacial bonding strength between diamond particles and Al matrix, and the Ti coated diamond particles reinforced Al matrix composites were prepared by gas pressure infiltration for electronic packaging. The surface structure of the Ti coated diamond particles was investigated by XRD and SEM. The interfacial characteristics and fracture surfaces were observed by SEM and EDS. The coefficient of thermal expansion(CTE) of 50% (volume fraction) Ti coated diamond particles reinforced Al matrix composites was measured. The Ti coating on diamond before infiltration consists of inner TiC layer and outer TiO_2 layer, and the inner TiC layer is very stable and cannot be removed during infiltration process. Fractographs of the composites illustrate that aluminum matrix fracture is the dominant fracture mechanism, and the stepped breakage of a diamond particle indicates strong interfacial bonding between the Ti coated diamond particles and the Al matrix. The measured low CTEs (5.07×10~(-6)-9.27×10~(-6_) K~(-1) of the composites also show the strong interfacial bonding between the Ti coated diamond particles and the Al matrix.

  18. Structural investigation of the negative thermal expansion in yttrium and rare earth molybdates

    Energy Technology Data Exchange (ETDEWEB)

    Guzman-Afonso, Candelaria; Torres, Manuel Eulalio; Sabalisck, Nanci; Sanchez-Fajardo, VIctor [Departamento de Fisica Basica, Universidad de La Laguna, Tenerife (Spain); Gonzalez-Silgo, Cristina; Gonzalez-Platas, Javier [Departamento de Fisica Fundamental II, Universidad de La Laguna, Tenerife (Spain); Lozano-GorrIn, Antonio Diego [Servicio Integrado de Difraccion de Rayos X, Universidad de La Laguna, Tenerife (Spain); Campo, Javier [Instituto de Ciencia de Materiales de Aragon, CSIC-Universidad de Zaragoza (Spain); RodrIguez-Carvajal, Juan, E-mail: csilgo@ull.es [Institut Laue-Langevin, Grenoble (France)

    2011-08-17

    The Sc{sub 2}(WO{sub 4}){sub 3}-type phase (Pbcn) of Y{sub 2}(MoO{sub 4}){sub 3}, Er{sub 2}(MoO{sub 4}){sub 3} and Lu{sub 2}(MoO{sub 4}){sub 3} has been prepared by the conventional solid-state synthesis with preheated oxides and the negative thermal expansion (NTE) has been investigated along with an exhaustive structural study, after water loss. Their crystal structures have been refined using the neutron and x-ray powder diffraction data of dehydrated samples from 150 to 400 K. The multi-pattern Rietveld method, using atomic displacements with respect to a known structure as parameters to refine, has been applied to facilitate the interpretation of the NTE behavior. Polyhedral distortions, transverse vibrations of A{center_dot}{center_dot}{center_dot}O-Mo (A = Y and rare earths) binding oxygen atoms, non-bonded distances A{center_dot}{center_dot}{center_dot}Mo and atomic displacements from the high temperature structure, have been evaluated as a function of the temperature and the ionic radii.

  19. Thermal expansion coefficient prediction of fuel-cell seal materials from silica sand

    Science.gov (United States)

    Hidayat, Nurul; Triwikantoro, Baqiya, Malik A.; Pratapa, Suminar

    2013-09-01

    This study is focused on the prediction of coefficient of thermal expansion (CTE) of silica-sand-based fuel-cell seal materials (FcSMs) which in principle require a CTE value in the range of 9.5-12 ppm/°C. A semi-quantitative theoretical method to predict the CTE value is proposed by applying the analyzed phase compositions from XRD data and characterized density-porosity behavior. A typical silica sand was milled at 150 rpm for 1 hour followed by heating at 1000 °C for another hour. The sand and heated samples were characterized by means of XRD to perceive the phase composition correlation between them. Rietveld refinement was executed to investigate the weight fraction of the phase contained in the samples, and then converted to volume fraction for composite CTE calculations. The result was applied to predict their potential physical properties for FcSM. Porosity was taken into account in the calculation after which it was directly measured by the Archimedes method.

  20. Thermal Expansion of Three Closed Cell Polymeric Foams at Cryogenic Temperatures

    Science.gov (United States)

    Stokes, Eric

    2006-01-01

    The Space Shuttle External Tank (ET) contains the liquid H2 fuel and liquid oxygen oxidizer and supplies them under pressure to the three space shuttle main engines (SSME) in the orbiter during lift-off and ascent. The ET thermal protection system consists of sprayed-on foam insulation and pre-molded ablator materials. The closed-cell foams are the external coating on the ET and are responsible for minimizing the amount of moisture that condenses out and freezes on the tank from the humid air in Florida while it is on the pad with cryogenic propellant awaiting launch. This effort was part of the overall drive to understand the behavior of these materials under use-conditions. There are four specially-engineered closed-cell foams used on the tank. The thermal expansion (contraction) of three of the polyurethane and polyisocyanurate foams were measured from -423 F (the temperature of liquid hydrogen) to 125 F under atmospheric conditions and under vacuum. One of them, NCFI 24-124, is a mechanically-applied material and covers the main acreage of the tank, accounting for 77 percent of the total foam used. Another, BX-265, is also a mechanically-applied and hand-sprayed material used on the tank's "closeout" areas. PDL 1034 is a hand-poured foam used for filling odd-shaped cavities in the tank, Measurements were made in triplicate in the three primary material directions in the case of the first two materials and the two primary material directions in the case of the last. Task 1 was developing the techniques for getting a uniform heating rate and minimizing axial and radial thermal gradients in the specimens. Temperature measurements were made at four locations in the specimens during this initial development phase of testing. Major challenges that were overcome include developing techniques for transferring the coolant, liquid helium (-452 F), from its storage container to the test facility with a minimal transfer of heat to the coolant and control of the heating

  1. Anisotropic thermal expansion of YBa 2Cu 4O 8 in the temperature range 10-297 K

    Science.gov (United States)

    Alexandrov, O. V.; François, M.; Graf, T.; Yvon, K.

    1990-09-01

    Orthorhombic lattice parameters have been measured to a precision of 1x10 -4 on a low-temperature Guinier X-ray powder diffractometer by using an internal standard. The anisotropic expansion, ( a297 K- a10 K)/ a297 K=17(2) x10 -4, ( b297 K- b10 K)/ b297 K=8(2) x10 -4, ( c297 K- c10 K)/ c297 K=32(2) x10 -4, is attributed to anharmonicity of the CuO 2 planes that vibrate mainly parallel to c, and of the CuO double-chains that vibrate mainly parallel to a. No anomalous changes as a function of temperature occur within experimental resolution.

  2. Molar volume, thermal expansivity and isothermal compressibility of trans-decahydronaphthalene up to 200MPa and 446K

    Institute of Scientific and Technical Information of China (English)

    Zhu Hu-Gang; Liu Zhi-Hua; Tian Yi-Ling; Xue Yuan; Yin Liang

    2005-01-01

    The molar volume isotherms of trans-decahydronaphthalene (C10H18) between 293 and 446 K and at pressures from 10 to 200 MPa have been determined. A modified Tait equation of state is used to fit each experimental molar volume isotherm with a maximum average deviation of 0.029%. The thermal expansivity (cubic expansion coefficient) α and isothermal compressibility κ were determined by fitting the slopes of the isobaric curves and isotherms, respectively.The coefficients in the equation Vm = C1 + C2T + C3T2 - C4p - C5pT have been fitted with an average deviation of 1.03%.

  3. Unusual transformation from strong negative to positive thermal expansion in PbTiO3-BiFeO3 perovskite.

    Science.gov (United States)

    Chen, Jun; Fan, Longlong; Ren, Yang; Pan, Zhao; Deng, Jinxia; Yu, Ranbo; Xing, Xianran

    2013-03-15

    Tetragonal PbTiO(3)-BiFeO(3) exhibits a strong negative thermal expansion in the PbTiO(3)-based ferroelectrics that consist of one branch in the family of negative thermal expansion materials. Its strong negative thermal expansion is much weakened, and then unusually transforms into positive thermal expansion as the particle size is slightly reduced. This transformation is a new phenomenon in the negative termal expansion materials. The detailed structure, temperature dependence of unit cell volume, and lattice dynamics of PbTiO(3)-BiFeO(3) samples were studied by means of high-energy synchrotron powder diffraction and Raman spectroscopy. Such unusual transformation from strong negative to positive thermal expansion is highly associated with ferroelectricity weakening. An interesting zero thermal expansion is achieved in a wide temperature range (30-500 °C) by adjusting particle size due to the negative-to-positive transformation character. The present study provides a useful method to control the negative thermal expansion not only for ferroelectrics but also for those functional materials such as magnetics and superconductors.

  4. Carbon nanotube-copper exhibiting metal-like thermal conductivity and silicon-like thermal expansion for efficient cooling of electronics.

    Science.gov (United States)

    Subramaniam, Chandramouli; Yasuda, Yuzuri; Takeya, Satoshi; Ata, Seisuke; Nishizawa, Ayumi; Futaba, Don; Yamada, Takeo; Hata, Kenji

    2014-03-07

    Increasing functional complexity and dimensional compactness of electronic devices have led to progressively higher power dissipation, mainly in the form of heat. Overheating of semiconductor-based electronics has been the primary reason for their failure. Such failures originate at the interface of the heat sink (commonly Cu and Al) and the substrate (silicon) due to the large mismatch in thermal expansion coefficients (∼300%) of metals and silicon. Therefore, the effective cooling of such electronics demands a material with both high thermal conductivity and a similar coefficient of thermal expansion (CTE) to silicon. Addressing this demand, we have developed a carbon nanotube-copper (CNT-Cu) composite with high metallic thermal conductivity (395 W m(-1) K(-1)) and a low, silicon-like CTE (5.0 ppm K(-1)). The thermal conductivity was identical to that of Cu (400 W m(-1) K(-1)) and higher than those of most metals (Ti, Al, Au). Importantly, the CTE mismatch between CNT-Cu and silicon was only ∼10%, meaning an excellent compatibility. The seamless integration of CNTs and Cu was achieved through a unique two-stage electrodeposition approach to create an extensive and continuous interface between the Cu and CNTs. This allowed for thermal contributions from both Cu and CNTs, resulting in high thermal conductivity. Simultaneously, the high volume fraction of CNTs balanced the thermal expansion of Cu, accounting for the low CTE of the CNT-Cu composite. The experimental observations were in good quantitative concurrence with the theoretically described 'matrix-bubble' model. Further, we demonstrated identical in-situ thermal strain behaviour of the CNT-Cu composite to Si-based dielectrics, thereby generating the least interfacial thermal strain. This unique combination of properties places CNT-Cu as an isolated spot in an Ashby map of thermal conductivity and CTE. Finally, the CNT-Cu composite exhibited the greatest stability to temperature as indicated by its low

  5. First-principles study of thermal expansion and thermomechanics of single-layer black and blue phosphorus

    Science.gov (United States)

    Sun, Hongyi; Liu, Gang; Li, Qingfang; Wan, X. G.

    2016-05-01

    The linear thermal expansion coefficients (LTEC) and thermomechanics of single-layer black and blue phosphorus are systematically studied using first-principles based on quasiharmonic approximation. We find the thermal expansion of black phosphorus is very anisotropic. The LTEC along zigzag direction has a turning from negative to positive at around 138 K, while the LTEC along armchair direction is positive (except below 8 K) and about 2.5 times larger than that along zigzag direction at 300 K. For blue phosphorus, the LTEC is negative in the temperature range from 0 to 350 K. In addition, we find that the Young's modulus and Poisson's ratio of black phosphorus along zigzag direction are 4 to 5 times larger than those along armchair direction within considered temperature range, showing a remarkable anisotropic in-plane thermomechanics property. The mechanisms of these peculiar thermal properties are also explored. This work provides a theoretical understanding of the thermal expansion and thermomechanics of this single layer phosphorus family, which will be useful in nanodevices.

  6. Dehydration of Octacyanido-Bridged Ni(II)-W(IV) Framework toward Negative Thermal Expansion and Magneto-Colorimetric Switching.

    Science.gov (United States)

    Reczyński, Mateusz; Chorazy, Szymon; Nowicka, Beata; Sieklucka, Barbara; Ohkoshi, Shin-Ichi

    2017-01-03

    An inorganic three-dimensional [Ni(II)(H2O)2]2[W(IV)(CN)8]·4H2O (1) framework undergoes a single-crystal-to-single-crystal transformation upon thermal dehydration, producing a fully anhydrous phase Ni(II)2[W(IV)(CN)8] (1d). The dehydration process induces changes in optical, magnetic, and thermal expansion properties. While 1 reveals typical positive thermal expansion of the crystal lattice, greenish-yellow color, and paramagnetic behavior, 1d is the first ever reported octacyanido-based solid revealing negative thermal expansion, also exhibiting a deep red color and diamagnetism. Such drastic shift in the physical properties is explained by the removal of water molecules, leaving the exclusively cyanido-bridged bimetallic network, which is accompanied by the transformation of the octahedral paramagnetic [Ni(II)(H2O)2(NC)4](2-) to the square-planar diamagnetic [Ni(II)(NC)4](2-) moieties.

  7. Structure, phase transition, and controllable thermal expansion behaviors of Sc(2-x)Fe(x)Mo₃O₁₂.

    Science.gov (United States)

    Wu, Meimei; Liu, Xinzhi; Chen, Dongfeng; Huang, Qingzhen; Wu, Hui; Liu, Yuntao

    2014-09-02

    The crystal structures, phase transition, and thermal expansion behaviors of solid solutions of Sc(2-x)Fe(x)Mo3O12 (0 ≤ x ≤ 2) have been examined using X-ray diffraction (XRD), neutron powder diffraction (NPD), and differential scanning calorimetry (DSC). At room temperature, samples crystallize in a single orthorhombic structure for the compositions of x thermal expansion, and the volumetric coefficients of thermal expansion derived from XRD and NPD are 0.28 × 10(-6) °C(-1) (250-800 °C) and 0.65 × 10(-6) °C(-1) (227-427 °C), respectively. NPD results of Sc2Mo3O12 (x = 0) and Sc(1.3)Fe(0.7)Mo3O12 (x = 0.7) indicate that Fe substitution for Sc induces reduction of the mean Sc(Fe)-Mo nonbond distance and the different thermal variations of Sc(Fe)-O5-Mo2 and Sc(Fe)-O3-Mo2 bond angles. The correlation between the displacements of oxygen atoms and the variation of unit cell parameters was investigated in detail for Sc2Mo3O12.

  8. Thermal expansion of kyanite at ambient pressure: An X-ray powder diffraction study up to 1000 ℃

    Institute of Scientific and Technical Information of China (English)

    Xi Liu; Qiang He; Hejing Wang; Michael E. Fleet; Xiaomin Hu

    2010-01-01

    The thermal expansion coefficients of kyanite at ambient pressure have been investigated by an X-ray powder diffraction technique with temperatures up to 1000 ℃. No phase transition was observed in the experimental temperature range. Data for the unit-cell parameters and temperatures were fitted empirically resulting in the following thermal expansion coefficients: aa = 5.8(3) × 10-5, ab = 5.8 (1) × 10-5, ac% = 5.2(1) × 10-5, and av = 7.4(1) × 10-3 ℃-1, in good agreement with a recent neutron powder diffraction study. On the other hand, the variation of the unit-cell angles a, β and γ of kyanite with increase in temperature is very complicated, and the agreement among all studies is poor. The thermal expansion data at ambient pressure reported here and the compression data at ambient temperature from the literature suggest that, for the kyanite lattice, the most and least thermally expandable directions correspond to the most and least compressible directions, respectively.

  9. Phase-Transformation-Induced Extra Thermal Expansion Behavior of (SrxBa1-x)TiO3/Cu Composite.

    Science.gov (United States)

    Sheng, Jie; Wang, Lidong; Li, Shouwei; Yin, Benke; Liu, Xiangli; Fei, Wei-Dong

    2016-06-03

    The properties of metal matrix composites (MMCs) can be optimized effectively through adjusting the type or the volume fraction of reinforcement. Generally, the coefficient of thermal expansion (CTE) of MMCs can be reduced by increasing the volume fraction of the reinforcement with lower CTE than metal matrix. However, it is great challenge to fabricate low CTE MMCs with low reinforcement volume fraction because of the limitation of reinforcement CTEs. SrxBa1-xTiO3 (SBT) powder presents negative thermal expansion behavior during the phase transformation from tetragonal to cubic phase. Here, we demonstrate that the phase transformation of SBT can be utilized to reduce and design the thermal expansion properties of SBT particle-reinforced Cu (SBT/Cu) composite, and ultralow CTE can be obtained in SBT/Cu composite. The X-ray diffraction analysis on heating indicates that the temperature range of phase transformation is extended greatly, therefore, the low CTE can be achieved within wide temperature range. Landau-Devonshire theory study on the phase transformation behaviors of SBT particles in the composite indicates that thermal mismatch stress significantly affects the Curie temperature of SBT particles and the CTE of the composite. The results given in the present study provide a new approach to design the MMCs with low CTE.

  10. Carbon fiber-reinforced cyanate ester/nano-ZrW2O8 composites with tailored thermal expansion.

    Science.gov (United States)

    Badrinarayanan, Prashanth; Rogalski, Mark K; Kessler, Michael R

    2012-02-01

    Fiber-reinforced composites are widely used in the design and fabrication of a variety of high performance aerospace components. The mismatch in coefficient of thermal expansion (CTE) between the high CTE polymer matrix and low CTE fiber reinforcements in such composite systems can lead to dimensional instability and deterioration of material lifetimes due to development of residual thermal stresses. The magnitude of thermally induced residual stresses in fiber-reinforced composite systems can be minimized by replacement of conventional polymer matrices with a low CTE, polymer nanocomposite matrix. Zirconium tungstate (ZrW(2)O(8)) is a unique ceramic material that exhibits isotropic negative thermal expansion and has excellent potential as a filler for development of low CTE polymer nanocomposites. In this paper, we report the fabrication and thermal characterization of novel, multiscale, macro-nano hybrid composite laminates comprising bisphenol E cyanate ester (BECy)/ZrW(2)O(8) nanocomposite matrices reinforced with unidirectional carbon fibers. The results reveal that incorporation of nanoparticles facilitates a reduction in CTE of the composite systems, which in turn results in a reduction in panel warpage and curvature after the cure because of mitigation of thermally induced residual stresses.

  11. A parametric study of assembly pressure, thermal expansion, and membrane swelling in PEM fuel cells

    Directory of Open Access Journals (Sweden)

    Maher A.R. Sadiq Al-Baghdadi

    2016-01-01

    Full Text Available Proton Exchange membrane (PEM fuel cells are still undergoing intense development, and the combination of new and optimized materials, improved product development, novel architectures, more efficient transport processes, and design optimization and integration are expected to lead to major gains in performance, efficiency, durability, reliability, manufacturability and cost-effectiveness. PEM fuel cell assembly pressure is known to cause large strains in the cell components. All components compression occurs during the assembly process of the cell, but also during fuel cell operation due to membrane swelling when absorbs water and cell materials expansion due to heat generating in catalyst layers. Additionally, the repetitive channel-rib pattern of the bipolar plates results in a highly inhomogeneous compressive load, so that while large strains are produced under the rib, the region under the channels remains approximately at its initial uncompressed state. This leads to significant spatial variations in GDL thickness and porosity distributions, as well as in electrical and thermal bulk conductivities and contact resistances (both at the ribe-GDL and membrane-GDL interfaces. These changes affect the rates of mass, charge, and heat transport through the GDL, thus impacting fuel cell performance and lifetime. In this paper, computational fluid dynamics (CFD model of a PEM fuel cell has been developed to simulate the pressure distribution inside the cell, which are occurring during fuel cell assembly (bolt assembling, and membrane swelling and cell materials expansion during fuel cell running due to the changes of temperature and relative humidity. The PEM fuel cell model simulated includes the following components; two bi-polar plates, two GDLs, and, an MEA (membrane plus two CLs. This model is used to study and analyses the effect of assembling and operating parameters on the mechanical behaviour of PEM. The analysis helped identifying critical

  12. Crystal structure and thermal expansion of a CsCe{sub 2}Cl{sub 7} scintillator

    Energy Technology Data Exchange (ETDEWEB)

    Zhuravleva, M., E-mail: mzhuravl@utk.edu [Scintillation Materials Research Center, University of Tennessee, Knoxville, TN (United States); Department of Materials Science and Engineering, University of Tennessee, Knoxville, TN (United States); Lindsey, A. [Scintillation Materials Research Center, University of Tennessee, Knoxville, TN (United States); Department of Materials Science and Engineering, University of Tennessee, Knoxville, TN (United States); Chakoumakos, B.C. [Quantum Condensed Matter Division, Oak Ridge National Laboratory, Oak Ridge, TN 37996 (United States); Custelcean, R. [Chemical Sciences Division, Oak Ridge National Laboratory, Oak Ridge, TN (United States); Meilleur, F. [Biology and Soft Matter Division, Oak Ridge National Laboratory, Oak Ridge, TN (United States); Hughes, R.W.; Kriven, W.M. [Department of Materials Science and Engineering, University of Illinois at Urbana-Champaign, Urbana, IL (United States); Melcher, C.L. [Scintillation Materials Research Center, University of Tennessee, Knoxville, TN (United States); Department of Materials Science and Engineering, University of Tennessee, Knoxville, TN (United States)

    2015-07-15

    We used single-crystal X-ray diffraction data to determine crystal structure of CsCe{sub 2}Cl{sub 7}. It crystallizes in a P112{sub 1}/b space group with a=19.352(1) Å, b=19.352(1) Å, c=14.838(1) Å, γ=119.87(2)°, and V=4818.6(5) Å{sup 3}. Differential scanning calorimetry measurements combined with the structural evolution of CsCe{sub 2}Cl{sub 7} via X-ray diffractometry over a temperature range from room temperature to the melting point indicates no obvious intermediate solid–solid phase transitions. The anisotropy in the average linear coefficient of thermal expansion of the a axis (21.3×10{sup –6}/°C) with respect to the b and c axes (27.0×10{sup –6}/°C) was determined through lattice parameter refinement of the temperature dependent diffraction patterns. These findings suggest that the reported cracking behavior during melt growth of CsCe{sub 2}Cl{sub 7} bulk crystals using conventional Bridgman and Czochralski techniques may be largely attributed to the anisotropy in thermal expansion. - Graphical abstract: Three-dimensional quadric surface of thermal expansion coefficient of CsCe{sub 2}Cl{sub 7} at room temperature (sphere – isotropic) and near melting point (ellipsoid – anisotropic). - Highlights: • Crystal structure of CsCe{sub 2}Cl{sub 7} was solved through X-ray diffraction. • Linear coefficients of thermal expansion were determined from in-situ XRD in 25–650 °C. • Anisotropy of the a axis with respect to b and c axes (21.3 vs 27.0×10{sup –6}/°C) was found. • No solid–solid phase transitions were observed via XRD and thermal analysis.

  13. Effect of dynamic and thermal prehistory on aerodynamic characteristics and heat transfer behind a sudden expansion in a round tube

    Science.gov (United States)

    Terekhov, V. I.; Bogatko, T. V.

    2017-03-01

    The results of a numerical study of the influence of the thicknesses of dynamic and thermal boundary layers on turbulent separation and heat transfer in a tube with sudden expansion are presented. The first part of this work studies the influence of the thickness of the dynamic boundary layer, which was varied by changing the length of the stabilization area within the maximal extent possible: from zero to half of the tube diameter. In the second part of the study, the flow before separation was hydrodynamically stabilized and the thermal layer before the expansion could simultaneously change its thickness from 0 to D1/2. The Reynolds number was varied in the range of {Re}_{{{{D}}1 }} = 6.7 \\cdot 103 {{to}} 1.33 \\cdot 105, and the degree of tube expansion remained constant at ER = ( D 2/ D 1)2 = 1.78. A significant effect of the thickness of the separated boundary layer on both dynamic and thermal characteristics of the flow is shown. In particular, it was found out that with an increase in the thickness of the boundary layer the recirculation zone increases and the maximal Nusselt number decreases. It was determined that the growth of the heat layer thickness does not affect the hydrodynamic characteristics of the flow after separation but does lead to a reduction of heat transfer intensity in the separation area and removal of the coordinates of maximal heat transfer from the point of tube expansion. The generalizing dependence for the maximal Nusselt number at various thermal layer thicknesses is given. Comparison with experimental data confirmed the main trends in the behavior of heat and mass transfer processes in separated flows behind a step with different thermal prehistories.

  14. Systematic and controllable negative, zero, and positive thermal expansion in cubic Zr(1-x)Sn(x)Mo2O8.

    Science.gov (United States)

    Tallentire, Sarah E; Child, Felicity; Fall, Ian; Vella-Zarb, Liana; Evans, Ivana Radosavljević; Tucker, Matthew G; Keen, David A; Wilson, Claire; Evans, John S O

    2013-08-28

    We describe the synthesis and characterization of a family of materials, Zr1-xSnxMo2O8 (0 thermal expansion coefficient can be systematically varied from negative to zero to positive values. These materials allow tunable expansion in a single phase as opposed to using a composite system. Linear thermal expansion coefficients, αl, ranging from -7.9(2) × 10(-6) to +5.9(2) × 10(-6) K(-1) (12-500 K) can be achieved across the series; contraction and expansion limits are of the same order of magnitude as the expansion of typical ceramics. We also report the various structures and thermal expansion of "cubic" SnMo2O8, and we use time- and temperature-dependent diffraction studies to describe a series of phase transitions between different ordered and disordered states of this material.

  15. End plate for e.g. solid oxide fuel cell stack, sets thermal expansion coefficient of material to predetermined value

    DEFF Research Database (Denmark)

    2011-01-01

    .05-0.3 mm. USE - End plate for solid oxide fuel cell stack (claimed). Can also be used in polymer electrolyte fuel cell stack and direct methanol fuel cell stack. ADVANTAGE - The robustness of the end plate is improved. The structure of the end plate is simplified. The risk of delamination of the stack......NOVELTY - The end plate is made of material whose thermal expansion coefficient is corresponding to that of material of a cell (103). The thermal expansion coefficient of material is 9asterisk10-6 K-1 to 14asterisk10-6 K11. The thickness of the end plate is within the range of 0.001-1 mm and 0...

  16. Influence of Chemical Composition on Phase Transformation Temperature and Thermal Expansion Coefficient of Hot Work Die Steel

    Institute of Scientific and Technical Information of China (English)

    XIE Hao-jie; WU Xiao-chun; MIN Yong-an

    2008-01-01

    On the basis of the uniform design method,six kinds of martensitie hot work die steels were designed.The phase transformation temperatures including Ac1,Ac3,and M,were measured by DIL805A quenching dilatometer.The influences of the main elements on phase transformation temperatures were analyzed by quadratic stepwise regression analysis,and three corresponding equations were obtained.These equations,in which the interactions of the elements were considered,showed more effectiveness than the traditional ones.In addition,the thermal expansion coefficients of these steels in annealed state and quenched state were also obtained during the tests.The influences of chemical composition and temperature on the thermal expansion coefficient were analyzed;the equations obtained Were verified by using several kinds of steels.The predicted values were in accordance with the results of the experiments.

  17. An alternative empirical model for the relationship between the bond valence and the thermal expansion rate of chemical bonds.

    Science.gov (United States)

    Sidey, Vasyl

    2015-08-01

    The relationship between the bond valence s and the thermal expansion rate of chemical bonds (dr/dT) has been closely approximated by using the alternative three-parameter empirical model (dr/dT) = (u + vs)(-1/w), where u, v and w are the refinable parameters. Unlike the s-(dr/dT) model developed by Brown et al. [(1997), Acta Cryst. B53, 750-761], this alternative model can be optimized for particular s-(dr/dT) datasets in the least-squares refinement procedure. For routine calculations of the thermal expansion rates of chemical bonds, the alternative model with the parameters u = -63.9, v = 2581.0 and w = 0.647 can be recommended.

  18. Thermo-optic and thermal expansion coefficients of RTP and KTP crystals over 300-350 K

    CERN Document Server

    Smith, Arlee V; Do, Binh T

    2016-01-01

    We report new measurements of the thermal expansion and thermo-optic coefficients of RbTiOPO$_4$ (RTP) and KTiOPO$_4$ (KTP) crystals over the temperature range 300-350 K. For RTP/KTP our coefficients of linear thermal expansion at 305 K are: $\\alpha_x=9.44/7.88\\times 10^{-6}$/K, $\\alpha_y=12.49/9.48\\times 10^{-6}$/K, $\\alpha_z=-4.16/0.02\\times 10^{-6}$/K. Our normalized thermo-optic coefficients $\\beta=(1/n)dn/dT$ at 632.8 nm and 305 K are: $\\beta_x=5.39/3.78\\times 10^{-6}$/K, $\\beta_y=7.11/5.24\\times 10^{-6}$/K, $\\beta_z=12.35/9.34\\times 10^{-6}$/K.

  19. Crystalline electric field and lattice contributions to thermodynamic properties of PrGaO3: specific heat and thermal expansion

    Science.gov (United States)

    Senyshyn, A.; Schnelle, W.; Vasylechko, L.; Ehrenberg, H.; Berkowski, M.

    2007-04-01

    The low-temperature heat capacity of perovskite-type PrGaO3 has been measured in the temperature range from 2 to 320 K. Thermodynamic standard values at 298.15 K are reported. An initial Debye temperature θD(0) = (480 ± 10) K was determined by fitting the calculated lattice heat capacity. The entropy of the derived Debye temperature functions agrees well with values calculated from thermal displacement parameters and from atomistic simulations. The thermal expansion and the Grüneisen parameter, arising from a coupling of crystal field states of Pr3+ ion and phonon modes at low temperature, were analysed.

  20. Multifunctional MOFs through CO2 fixation: a metamagnetic kagome lattice with uniaxial zero thermal expansion and reversible guest sorption.

    Science.gov (United States)

    Keene, Tony D; Murphy, Michael J; Price, Jason R; Sciortino, Natasha F; Southon, Peter D; Kepert, Cameron J

    2014-10-21

    The properties of atmospheric CO2 fixation, metamagnetism, reversible guest adsorption and zero thermal expansion have been combined in a single robust MOF, [Cu3(bpac)3(CO3)2](ClO4)2·H2O (·H2O). This compound is a ditopically-bridged copper carbonate kagome lattice where desolvation of the MOF allows subtle tuning of the metamagnetic and uniaxial ZTE behaviour.

  1. Application of inverse models and XRD analysis to the determination of Ti-17 {beta}-phase coefficients of thermal expansion

    Energy Technology Data Exchange (ETDEWEB)

    Freour, S. [GeM, Institut de Recherche en Genie Civil et Mecanique (UMR CNRS 6183), Universite de Nantes, Ecole Centrale de Nantes, 37 Boulevard de l' Universite, BP 406, 44 602 Saint-Nazaire cedex (France)]. E-mail: freour@crttsn.univ-nantes.fr; Gloaguen, D. [GeM, Institut de Recherche en Genie Civil et Mecanique (UMR CNRS 6183), Universite de Nantes, Ecole Centrale de Nantes, 37 Boulevard de l' Universite, BP 406, 44 602 Saint-Nazaire cedex (France); Francois, M. [Laboratoire des Systemes Mecaniques et d' Ingenierie Simultanee (LASMIS FRE CNRS 2719), Universite de Technologie de Troyes, 12 Rue Marie Curie, BP 2060, 10010 Troyes (France); Guillen, R. [GeM, Institut de Recherche en Genie Civil et Mecanique (UMR CNRS 6183), Universite de Nantes, Ecole Centrale de Nantes, 37 Boulevard de l' Universite, BP 406, 44 602 Saint-Nazaire cedex (France)

    2006-04-15

    scope of this work is the determination of the coefficients of thermal expansion of the Ti-17 {beta}-phase. A rigorous inverse thermo-elastic self-consistent scale transition micro-mechanical model extended to multi-phase materials was used. The experimental data required for the application of the inverse method were obtained from both the available literature and especially dedicated X-ray diffraction lattice strain measurements performed on the studied ({alpha} + {beta}) two-phase titanium alloy.

  2. Dependence of Ionicity and Thermal Expansion Coefficient on Valence Electron Density in AIIBIVC2V Chalcopyrite Semiconductors

    Directory of Open Access Journals (Sweden)

    Amar BAHADUR

    2013-06-01

    Full Text Available A striking correlation has been found to exist between the free electron density parameter, average bond length, homoplar energy gap, heteropolar energy gap, ionicity and thermal expansion coefficient for AIIBIVC2V chalcopyrite semiconductors. The estimated values of these parameters are in good agreement with the available experimental values and theoretical findings. The electron density parameter data is the only one input data to estimate all above properties.

  3. Anomalous law of cooling

    Science.gov (United States)

    Lapas, Luciano C.; Ferreira, Rogelma M. S.; Rubí, J. Miguel; Oliveira, Fernando A.

    2015-03-01

    We analyze the temperature relaxation phenomena of systems in contact with a thermal reservoir that undergoes a non-Markovian diffusion process. From a generalized Langevin equation, we show that the temperature is governed by a law of cooling of the Newton's law type in which the relaxation time depends on the velocity autocorrelation and is then characterized by the memory function. The analysis of the temperature decay reveals the existence of an anomalous cooling in which the temperature may oscillate. Despite this anomalous behavior, we show that the variation of entropy remains always positive in accordance with the second law of thermodynamics.

  4. Anomalous law of cooling.

    Science.gov (United States)

    Lapas, Luciano C; Ferreira, Rogelma M S; Rubí, J Miguel; Oliveira, Fernando A

    2015-03-14

    We analyze the temperature relaxation phenomena of systems in contact with a thermal reservoir that undergoes a non-Markovian diffusion process. From a generalized Langevin equation, we show that the temperature is governed by a law of cooling of the Newton's law type in which the relaxation time depends on the velocity autocorrelation and is then characterized by the memory function. The analysis of the temperature decay reveals the existence of an anomalous cooling in which the temperature may oscillate. Despite this anomalous behavior, we show that the variation of entropy remains always positive in accordance with the second law of thermodynamics.

  5. Thermal Expansion of Sintered Glass Ceramics in the System BaO-SrO-ZnO-SiO2 and Its Dependence on Particle Size.

    Science.gov (United States)

    Thieme, Christian; Schlesier, Martin; Bocker, Christian; Buzatto de Souza, Gabriel; Rüssel, Christian

    2016-08-10

    The thermal expansion behavior of sintered glass-ceramics containing high concentrations of Ba1-xSrxZn2Si2O7, a phase with very low and highly anisotropic thermal expansion behavior, was investigated. The observed phase has the crystal structure of the high-temperature phase of BaZn2Si2O7, which can be stabilized by the introduction of Sr(2+) into this phase. The high anisotropy leads to microcracking within the volume of the samples, which strongly affects the dilatometric thermal expansion. However, these cracks also have an influence on the nominal thermal expansion of the as-mentioned phase, which decreases if the cracks appear. Below a grain size of approximately 80 μm, the sintered glass-ceramics have almost no cracks and show positive thermal expansion. Hence, coefficients of thermal expansion between -5.6 and 6.5 × 10(-6) K(-1) were measured. In addition to dilatometric studies, the effect of the microstructure on the thermal expansion was also measured using in situ X-ray diffraction at temperatures up to 1000 °C.

  6. Crystal structure, electrical conductivity and thermal expansion of Ni and Nb co-doped LaCoO3.

    Science.gov (United States)

    Øygarden, Vegar; Grande, Tor

    2013-02-28

    The effect of co-doping LaCoO(3) with Ni and Nb has been investigated in the two solid solution series (1 - x)LaCoO(3)-xLaNi(2/3)Nb(1/3)O(3) and (1 - y)LaCo(2/3)Ni(1/3)O(3)-yLaNi(2/3)Nb(1/3)O(3). The materials were shown to be stoichiometric with respect to oxygen. The compositional effect on the evolution of the crystal structure, thermal expansion and electrical conductivity is reported. The chemical stability of LaCoO(3) in a reducing atmosphere was improved and the thermal expansion was suppressed at higher levels of Nb-substitution. The materials with mixed oxidation states on the B-site possessed superior electrical transport properties compared to solid solutions with cations in mainly isovalent oxidation states. The evolution of the electronic conductivity, thermal expansion and crystal structural is discussed with emphasis on the oxidation states of Ni and Co, and the spin transitions of Co.

  7. Crystal structure and negative thermal expansion properties of solid solution Er_2W_(3-x)Mo_xO_(12)

    Institute of Scientific and Technical Information of China (English)

    PENG Jie; LIU Xin-zhi; GUO Fu-li; HAN Song-bai; LIU Yun-tao; CHEN Dong-feng; ZHAO Xin-hua; HU Zhong-bo

    2009-01-01

    A series of solid solutions Er_2W_(3-x)Mo_xO_(12) (0.5≤x≤2.5) were successfully synthesized by the solid state method.Their crystal structures and negative thermal expansion properties were studied by high temperature X-ray powder diffraction and the Rietveld method.All samples with rare earth tungstates and molybdates crystallize in the same orthorhombic structure with space group Pnca,and show the negative thermal expansion phenomena related to transverse vibration of bridging oxygen atoms in the structure.Thermal expansion coefficients (TECs) of Er_2W_(3-x)Mo_xO_(12) were determined as -16.2×10~(-6) K~(-1) for x=0.5 and -16.5×10~(-6) K~(-1) for x=2.5 while -20.2×10~(-6) K~(-1) and -18.4×10~(-6) K~(-1) for unsubstituted Er_2W_3O_(12) and Er_2Mo_3O_(12) in the identical temperature range of 200-800 ℃.High temperature XRD data and bond length analysis suggest that the difference between W-O and Mo-O is responsible for the change of TECs after the element substitution in the series of solid solutions.

  8. Effect of micro-cracking on the thermal conductivity and thermal expansion of tialite (Al2TiO5 ceramics

    Directory of Open Access Journals (Sweden)

    Ramanathan Papitha

    2013-09-01

    Full Text Available The pure and magnesium silicate (Mg2+/Si4+ doped tialite ceramics were prepared from the homogenized mixture of alumina and titania by uniaxial pressing and pressure-less sintering at 1550 °C in air. Thermal conductivity and thermal expansion of the doped and undoped tialite ceramics were measured from 30 to 700 °C. The identical trend in the behaviour of these thermal properties most probably is influenced by the population, size and shape of microcracks present throughout the grain and grain boundaries as complemented by the microstructural observations. The observed decrease in thermal properties of the doped in comparison to the pure tialite can be attributed to the substitutional Mg2+ and Si4+ at Al3+ site in Al2TiO5 which promotes the phonon scattering and causes modifications in micro-crack density and the morphology of the cracks.

  9. Negative thermal expansion in 2H CuScO2 originating from the cooperation of transverse thermal vibrations of Cu and O atoms.

    Science.gov (United States)

    Chang, Dahu; Yu, Weiyang; Sun, Qiang; Jia, Yu

    2017-01-18

    Negative thermal expansion (NTE) originating from the transverse thermal vibrations of metal atoms is seldom reported, which is why the transparent conducting oxide 2H CuScO2 is such a unique case. Using the density functional theory (DFT) and the quasi-harmonic approximation (QHA), the thermal properties of 2H CuScO2 were investigated. The coefficient of thermal expansion (CTE) and the Grüneisen parameters of different vibrational modes were calculated, and we found that, up to a temperature of 200 K, 2H CuScO2 displays a strong NTE behavior along the c-axis (i.e. along the O-Cu-O linkage), with an average CTE of approximately -2 × 10(-6) K(-1). Our calculations are consistent with the experimental values. Furthermore, we reveal that low energy modes (0-150 cm(-1)) originating from the cooperation of transverse vibrations of Cu and O atoms, which result in larger negative Grüneisen parameters and vibrational frequency softening phenomenon under pressure, are the main reasons for the NTE of such materials with a 2H structure. Our findings not only provide a better understanding of the NTE mechanism, but also present a report on detailed abnormal thermal properties in 2H CuScO2 that have applications in electronic, electrochemical and optoelectronic devices.

  10. Mechanical and thermal-expansion characteristics of Ca10(PO46(OH2-Ca3(PO42 composites

    Directory of Open Access Journals (Sweden)

    Ruseska G.

    2006-01-01

    Full Text Available Three types of composites consisting of Ca10(PO46(OH2 and Ca3(PO42 with composition: 75% (wt Ca10(PO46(OH2: 25%(wt Ca3(PO42; 50%(wt Ca10(PO46(OH2: 50%(wtCa3(PO42 and 25 %(wt Ca10(PO46(OH2: 75%(wt Ca3(PO42 were the subject of our investigation. Sintered compacts were in thermal equilibrium, which was proved by the absence of hysteresis effect of the dependence ΔL/L=f(T during heating /cooling in the temperature interval 20-1000-200C. Sintered compacts with the previously mentioned composition possess 26-50% higher values of the E-modulus, G-modulus and K-modulus indicating the presence of a synergism effect. Several proposed model equations for predicting the thermal expansion coefficient in dependence of the thermal and elastic properties of the constitutive phases and their volume fractions, given by: Turner, Kerner, Tummala and Friedberg, Thomas and Taya, were used for making correlations between mechanical and thermal-expansion characteristics of the Ca10(PO46(OH2 - Ca3(PO42 composites. Application of the previously mentioned model equations to all kinds of composites leads to the conclusion that the experimentally obtained results for the thermal expansion coefficient are in an excellent agreement with the theoretical calculated values on account of the volume fraction of each constitutive phase and with all applied model equations, with a coefficient of correlation from 98.16-99.86 %.

  11. Unidirectional thermal expansion in edge-sharing BO4 tetrahedra contained KZnB3O6.

    Science.gov (United States)

    Lou, Yanfang; Li, Dandan; Li, Zhilin; Jin, Shifeng; Chen, Xiaolong

    2015-06-05

    Borates are among a class of compounds that exhibit rich structural diversity and find wide applications. The formation of edge-sharing (es-) BO4 tetrahedra is extremely unfavored according to Pauling's third and fourth rules. However, as the first and the only es-borate obtained under ambient pressure, es-KZnB3O6 shows an unexpected high thermal stability up to its melting point. The origin of this extraordinary stability is still unclear. Here, we report a novel property in KZnB3O6: unidirectional thermal expansion, which plays a role in preserving es-BO4 from disassociation at elevated temperatures. It is found that this unusual thermal behavior originates from cooperative rotations of rigid groups B6O12 and Zn2O6, driven by anharmonic thermal vibrations of K atoms. Furthermore, a detailed calculation of phonon dispersion in association with this unidirectional expansion predicts the melting initiates with the breakage of the link between BO3 and es-BO4. These findings will broaden our knowledge of the relationship between structure and property and may find applications in future.

  12. Analysis of rail cooling strategies through numerical simulation with instant calculation of thermal expansion coefficient

    Directory of Open Access Journals (Sweden)

    Pernía-Espinoza, A.

    2010-08-01

    Full Text Available This article describes a new methodology to simulate the cooling process for an asymmetrical Ri60 grooved rail, designed for city tramways, in a more realistic manner than that conducted previously by other authors for long steel sections. The approach considers the phase transformation of the steel and the forced convection cooling. The process is modelled as an uncoupled thermo-mechanical problem. First, the rail’s temperature history is obtained from a computer fluid dynamic model and subsequently introduced in the finite element model, in order to model the stresses and displacements. This second stage involves the calculation of the thermal expansion coefficient, for each element and at each iteration. The calculation is made according to the continuous cooling transformation diagram. These results lead to the extremely reliable determination of residual stresses as proved by the comparison with experimental data obtained in the industrial plant. The methodology allows for an accurate study of two types of cooling strategies for the Ri60 and the selection of the more suitable one.

    En este artículo se describe una nueva metodología para simular el proceso de enfriamiento de un rail asimétrico Ri60, diseñado para tranvías, de una forma mucho más realista que lo realizado hasta ahora para perfiles largos de acero. La propuesta considera los efectos de la transformación de fases del acero y el enfriamiento por convección forzada. El proceso es simulado como un proceso termo-mecánico desacoplado. Primero, las curvas de enfriamiento del rail son obtenidas a partir de un modelo basado en dinámica de fluidos computacional y posteriormente introducidas en el modelo de elementos finitos para calcular las tensiones y desplazamientos. En esta segunda fase se calcula, para cada elemento finito y en cada iteración, el coeficiente de dilatación térmica lineal según el diagrama de curvas de enfriamiento continuo. Estos resultados

  13. Colossal positive and negative thermal expansion and thermosalient effect in a pentamorphic organometallic martensite.

    Science.gov (United States)

    Panda, Manas K; Runčevski, Tomče; Sahoo, Subash Chandra; Belik, Alexei A; Nath, Naba K; Dinnebier, Robert E; Naumov, Panče

    2014-09-04

    The thermosalient effect is an extremely rare propensity of certain crystalline solids for self-actuation by elastic deformation or by a ballistic event. Here we present direct evidence for the driving force behind this impressive crystal motility. Crystals of a prototypical thermosalient material, (phenylazophenyl)palladium hexafluoroacetylacetonate, can switch between five crystal structures (α-ε) that are related by four phase transitions including one thermosalient transition (α↔γ). The mechanical effect is driven by a uniaxial negative expansion that is compensated by unusually large positive axial expansion (260 × 10(-6)  K(-1)) with volumetric expansion coefficients (≈250 × 10(-6)  K(-1)) that are among the highest values reported in molecular solids thus far. The habit plane advances at ~10(4) times the rate observed with non-thermosalient transitions. This rapid expansion of the crystal following the phase switching is the driving force for occurrence of the thermosalient effect.

  14. A STUDY OF THE PROPERTIES OF CP: COEFFICIENT OF THERMAL EXPANSION, DECOMPOSITION KINETICS AND REACTION TO SPARK, FRICTION AND IMPACT

    Energy Technology Data Exchange (ETDEWEB)

    Weese, R K; Burnham, A K; Fontes, A T

    2005-03-30

    The properties of pentaamine (5-cyano-2H-tetrazolato-N2) cobalt (III) perchlorate (CP), which was first synthesized in 1968, continues to be of interest for predicting behavior in handling, shipping, aging, and thermal cook-off situations. We report coefficient of thermal expansion (CTE) values over four specific temperature ranges, decomposition kinetics using linear heating rates, and the reaction to three different types of stimuli: impact, spark, and friction. The CTE was measured using a Thermal Mechanical Analyzer (TMA) for samples that were uniaxially compressed at 10,000 psi and analyzed over a dynamic temperature range of -20 C to 70 C. Using differential scanning calorimetry, DSC, CP was decomposed at linear heating rates of 1, 3, and 7 C/min and the kinetic triplet calculated using the LLNL code Kinetics05. Values are also reported for spark, friction, and impact sensitivity.

  15. Thermal expansion of SiC at high pressure-temperature and implications for thermal convection in the deep interiors of carbide exoplanets

    Science.gov (United States)

    Nisr, C.; Meng, Y.; MacDowell, A. A.; Yan, J.; Prakapenka, V.; Shim, S.-H.

    2017-01-01

    Recent astrophysical observations have shown that some stars have sufficiently high carbon-to-oxygen ratios and may host planets composed mainly of carbides instead of silicates and oxides. From the low thermal expansion of SiC at 1 bar, it can be inferred that the buoyancy force of thermal anomalies is much lower in the carbide planets than in the silicate planets. However, numerous studies have shown that high pressure in planetary interiors can fundamentally change the physical properties of materials. We have measured the pressure-volume-temperature relations of two SiC polymorphs (3C and 6H) at pressures and temperatures up to 80 GPa and 1900 K and 65 GPa and 1920 K, respectively, in the laser-heated diamond anvil cell combined with synchrotron X-ray diffraction. We found no evidence of dissociations of these phases up to our maximum pressure condition, supporting the stability of SiC to 1900 km depth in Earth-size Si-rich carbide planets. Following the Mie-Grüneisen approach, we fit our data to the Birch-Murnaghan or the Vinet equations of state combined with the Debye approach. We found that the pressure-induced change in the thermal expansion parameter of SiC is much smaller than that of Mg silicate perovskite (bridgmanite). Our new measurements suggest that the thermal buoyancy force may be stronger in the deep interiors of Si-rich carbide exoplanets than in the "Earth-like" silicate planets.

  16. Linear Thermal Expansion Measurements of Lead Magnesium Niobate (PMN) Electroceramic Material for the Terrestrial Planet Finder Coronagraph

    Science.gov (United States)

    Karlmann, Paul B.; Halverson, Peter G.; Peters, Robert D.; Levine, Marie B.; VanBuren, David; Dudik, Matthew J.

    2005-01-01

    Linear thermal expansion measurements of nine samples of Lead Magnesium Niobate (PMN) electroceramic material were recently performed in support of NASA's Terrestrial Planet Finder Coronagraph (TPF-C) mission. The TPF-C mission is a visible light coronagraph designed to look at roughly 50 stars pre- selected as good candidates for possessing earth-like planets. Upon detection of an earth-like planet, TPF-C will analyze the visible-light signature of the planet's atmosphere for specific spectroscopic indicators that life may exist there. With this focus, the project's primary interest in PMN material is for use as a solid-state actuator for deformable mirrors or compensating optics. The nine test samples were machined from three distinct boules of PMN ceramic manufactured by Xinetics Inc. Thermal expansion measurements were performed in 2005 at NASA Jet Propulsion Laboratory (JPL) in their Cryogenic Dilatometer Facility. All measurements were performed in vacuum with sample temperature actively controlled over the range of 270K to 3 10K. Expansion and contraction of the test samples with temperature was measured using a JPL developed interferometric system capable of sub-nanometer accuracy. Presented in this paper is a discussion of the sample configuration, test facilities, test method, data analysis, test results, and future plans.

  17. Thermal expansion of gadolinium in the vicinity of the Curie point. [270 to 320/sup 0/K, Curie point exponents

    Energy Technology Data Exchange (ETDEWEB)

    Dolejsi, D.A.

    1977-02-01

    The c- and a-axis linear thermal expansivities of high purity single crystals of gadolinium were measured in the temperature range 270/sup 0/K to 320/sup 0/K. Length changes were translated to capacitance changes with a modified normal geometry 3-terminal capacitance dilatometer. An ac 3-terminal capacitance bridge was employed to measure nominal 10 pF capacitances to a precision of 10/sup -7/ pF, which corresponds to a relative length change sensitivity of 10/sup -10/. A 25 ohm platinum resistance thermometer was used to detect the dilatometer temperature to a precision of 10 ..mu..K with an ac resistance bridge. The c-axis expansivity was negative and had a large (approximately equal to 10/sup -4/ K/sup -1/) peak at 293.435/sup 0/K, while the a-axis expansivity was positive and had a smaller (approximately equal to 10/sup -5/ K/sup -1/) peak at 293.363/sup 0/K. The values of the Curie temperatures (T/sub c/'s) and critical point exponents for the c- and a-axis crystals were obtained from fitting power law equations to the expansivities.

  18. Thermal stability and thermal expansion behaviour of ZrO{sub 2}/Y{sub 2}O{sub 3} multilayers deposited by pulsed laser deposition technique

    Energy Technology Data Exchange (ETDEWEB)

    Mishra, Maneesha, E-mail: pkigcar@gmail.com [Materials Synthesis and Structural Characterisation Division, Physical Metallurgy Group, Metallurgy and Materials Group, Indira Gandhi Centre for Atomic Research, Kalpakkam 603 102 (India); Kuppusami, P. [Centre for Nanoscience and Nanotechnology, Sathyabama University, Chennai, 600119 Tamil Nadu (India); Murugesan, S.; Ghosh, Chanchal; Divakar, R.; Singh, Akash; Mohandas, E. [Materials Synthesis and Structural Characterisation Division, Physical Metallurgy Group, Metallurgy and Materials Group, Indira Gandhi Centre for Atomic Research, Kalpakkam 603 102 (India)

    2015-07-15

    Multilayers of ZrO{sub 2}/Y{sub 2}O{sub 3} were prepared by pulsed laser deposition technique with variation in the ZrO{sub 2} layer thickness from 5 to 30 nm keeping the Y{sub 2}O{sub 3} layer thickness constant (∼10 nm). The stability, phase evolution and thermal expansion behaviour of the multilayers were analyzed by high temperature x-ray diffraction technique, in the temperature range of 300–1373 K. Unlike the single layer of ZrO{sub 2} film, which shows a mixture of tetragonal and monoclinic phase, the ZrO{sub 2} layers in multilayers show tetragonal phase in case of all the multilayers investigated in the present work. The values of coefficient of thermal expansion (CTE) decrease with increase in the ZrO{sub 2} layer thickness. The CTE of both ZrO{sub 2} and Y{sub 2}O{sub 3} are found to be influenced by their mutual solubility as well as due to interdiffusion of these oxides taking place along the interfaces of the multilayers, especially during high temperature heat-treatment. - Highlights: • ZrO{sub 2}/Y{sub 2}O{sub 3} multilayers were deposited by pulsed laser deposition technique. • Formation of tetragonal phase of ZrO{sub 2} and cubic phase of Y{sub 2}O{sub 3} were observed. • The multilayers films show good thermal stability upto temperature 1373 K. • The coefficient of thermal expansion (CTE) of t-ZrO{sub 2} decreases with increase in ZrO{sub 2} layer thickness.

  19. Origin of the colossal positive and negative thermal expansion in Ag{sub 3}[Co(CN){sub 6}]: an ab initio density functional theory study

    Energy Technology Data Exchange (ETDEWEB)

    Calleja, Mark [Cambridge eScience Centre, Centre for Mathematical Sciences, Wilberforce Road, Cambridge CB3 0WA (United Kingdom); Goodwin, Andrew L; Dove, Martin T [Department of Earth Sciences, University of Cambridge, Downing Street, Cambridge CB2 3EQ (United Kingdom)], E-mail: mtd10@cam.ac.uk

    2008-06-25

    DFT calculations have been used to provide insights into the origin of the colossal positive and negative thermal expansion in Ag{sub 3}[Co(CN){sub 6}]. The results confirm that the positive expansion within the trigonal basal plane and the negative expansion in the orthogonal direction are coupled due to the existence of a network defined by nearly rigid bonds within the chains of Co-C-N-Ag-N-C-Co linkages. The origin of the colossal values of the coefficients of thermal expansion arise from an extremely shallow energy surface that allows a flexing of the structure with small energy cost. The thermal expansion can be achieved with a modest value of the overall Grueneisen parameter. The energy surface is so shallow that we need to incorporate a small empirical dispersive interaction to give ground-state lattice parameters that match experimental values at low temperature. We compare the results with DFT calculations on two isostructural systems: H{sub 3}[Co(CN){sub 6}], which is known to have much smaller values of the coefficients of thermal expansion, and Au{sub 3}[Co(CN){sub 6}], which has not yet been synthesized but which is predicted by our calculations to be another candidate material for showing colossal positive and negative thermal expansion.

  20. Thermal expansivities of peptides, polypeptides and proteins as measured by pressure perturbation calorimetry.

    Science.gov (United States)

    Pandharipande, Pranav P; Makhatadze, George I

    2015-04-01

    The main goal of this work was to provide direct experimental evidence that the expansivity of peptides, polypeptides and proteins as measured by pressure perturbation calorimetry (PPC), can serve as a proxy to characterize relative compactness of proteins, especially the denatured state ensemble. This is very important as currently only small angle X-ray scattering (SAXS), intrinsic viscosity and, to a lesser degree, fluorescence resonance transfer (FRET) experiments are capable of reporting on the compactness of denatured state ensembles. We combined the expansivity measurements with other biophysical methods (far-UV circular dichroism spectroscopy, differential scanning calorimetry, and small angle X-ray scattering). Three case studies of the effects of conformational changes on the expansivity of polypeptides in solution are presented. We have shown that expansivity appears to be insensitive to the helix-coil transition, and appears to reflect the changes in hydration of the side-chains. We also observed that the expansivity is sensitive to the global conformation of the polypeptide chain and thus can be potentially used to probe hydration of different collapsed states of denatured or even intrinsically disordered proteins.

  1. Dilatometer setup for low coefficient of thermal expansion materials measurements in the 140 K-250 K temperature range

    Science.gov (United States)

    Spannagel, Ruven; Hamann, Ines; Sanjuan, Josep; Schuldt, Thilo; Gohlke, Martin; Johann, Ulrich; Weise, Dennis; Braxmaier, Claus

    2016-10-01

    Space applications demand light weight materials with excellent dimensional stability for telescopes, optical benches, optical resonators, etc. Glass-ceramics and composite materials can be tuned to reach very low coefficient of thermal expansion (CTE) at different temperatures. In order to determine such CTEs, very accurate setups are needed. Here we present a dilatometer that is able to measure the CTE of a large variety of materials in the temperature range of 140 K to 250 K. The dilatometer is based on a heterodyne interferometer with nanometer noise levels to measure the expansion of a sample when applying small amplitude controlled temperature signals. In this article, the CTE of a carbon fiber reinforced polymer sample has been determined with an accuracy in the 10-8 K-1 range.

  2. (Pb,Cd)-O covalency in PbTiO3-CdTiO3 with enhanced negative thermal expansion.

    Science.gov (United States)

    Wang, Fangfang; Xie, Ying; Chen, Jun; Fu, Honggang; Xing, Xianran

    2014-03-21

    Recently experiments have found that negative thermal expansion is a common phenomenon in PbTiO3-based materials, and their negative thermal expansion is affected by various substitutions. Interestingly, Cd substitution in PbTiO3 has a unique effect in enhancing negative thermal expansion compared with any other A-site substitutions. Therefore, studying Cd substitution in PbTiO3, the role of which still remains unclear, would bring us deeper understanding on the nature of the negative thermal expansion of PbTiO3-based materials. Structure calculations, density of states, Bader analysis and the minimum electron density of Pb1-xCdxTiO3 supercells have been reported on the chemical bond through first-principles calculations here. We found that the hybridization between (Pb,Cd)-O orbitals exists in tetragonal phase. Furthermore, the hybridization between Cd-O orbitals is stronger than that between Pb-O orbitals, and Cd-O covalency promotes the average A-site hybridization. Simultaneously, the average bulk coefficient of thermal expansion is negative and inversely proportional to the Cd substitution amount. So, (Pb,Cd)-O covalency in the tetragonal Pb1-xCdxTiO3 is responsible for the nature of enhanced negative thermal expansion in accordance with our previous experimental investigations.

  3. The role of hydrogen bonding in the thermal expansion and dehydration of brushite, di-calcium phosphate dihydrate

    Science.gov (United States)

    Schofield, P. F.; Knight, K. S.; Houwen, J. A. M. Van Der; Valsami-Jones, E.

    2004-12-01

    The unit-cell and atomic parameters of perdeuterated brushite have been extracted from Rietveld analysis of neutron powder diffraction data within the temperature range 4.2 to 470 K. The thermal expansion of brushite is anisotropic, with the largest expansion along the b axis due principally to the effect of the O(1)···D(4) and O(3)···D(2) hydrogen bonds. Expansion along the c axis, influenced by the Ow1···D(5) interwater hydrogen bond, is also large. The high temperature limits for the expansion coefficients for the unit-cell edges a, b and c are 9.7(5) × 10-6, 3.82(9) × 10-5 and 5.54(5) × 10-5 K-1, respectively, and for the cell volume it is 9.7(1) × 10-5 K-1. The β angle displays oscillatory variation, and empirical data analysis results in αβ = 1.28(3) × 10-6sin(0.0105 T) K-1, within this temperature range. The evolution of the thermal expansion tensor of brushite has been calculated between 50 ≤T≤ 400 K. At 300 K the magnitudes of the principal axes are α11 = 50(6) × 10-6 K-1, α22 = 26.7(7) × 10-6 K-1 and α33 = 7.0(5) × 10-6 K-1. The intermediate axis, α22, is parallel to b, and using IRE convention for the tensor orthonormal basis, the axes α11 and α33 have directions equal to (-0.228, 0, -0.974) and (-0.974, 0, 0.228) respectively. Under the conditions of these experiments, the onset of dehydration occurred at temperatures above 400 K. Bond valence analysis combined with assessments of the thermal evolution of the bonding within brushite suggests that dehydration is precipitated through instabilities in the chemical environment of the second water molecule.

  4. Thermal expansion and structural distortion of perovskite — data for NaMgF 3 perovskite. Part I

    Science.gov (United States)

    Zhao, Yusheng; Weidner, Donald J.; Parise, John B.; Cox, David E.

    1993-02-01

    The crystal structure of NaMgF 3 perovskite (Neighborite) has been studied at high temperature by X-ray powder diffraction. Data were collected using a position sensitive detector with a monochromatic synchroton radiation source. Changes in unit cell and atomic positions of the perovskite structure were defined using the Rietveld refinement technique. The linear and volumetric thermal expansion coefficients are observed to be αa = 4.04 × 10 -5 K -1, αb = 1.53 × 10 -5 K -1, αc = 3.06 × 10 -5 K -1, αv = 8.80 × 10 -5 K -1 for the orthorhombic Pbnm phase, and αa0 = 3.16 × 10 -5 K -1, αv0 = 9.49 × 10 -5 K -1 for the cubic Pm3m phase of NaMgF 3 perovskite, respectively. The temperature-induced linear and volumetric changes of the centrosymmetrically distorted ABX 3 perovskite structure can be empirically expressed as a combination of the change of the (BX) bond length and the change of tilting of the BX 6 octahedral framework. The considerable anisotropy of linear thermal expansion, αa > αc > αb, for the orthorhombic Pbnm phase reflects the progressive decrease of structural distortion and the development of the phase transition of the NaMgF 3 perovskite. The tilting angle of the MgF 6 octahedral framework is observed to decrease rapidly toward zero as the temperature approaches Tc = 765°C in the manner expected for a ferroelastic phase transition. More interestingly, the apparent (MgF) bond lengths of the MgF 6 octahedra shrink dramatically throughout a temperature interval of about 100°C before the phase transition. The volumetric thermal expansion increases drastically in a critical manner as the temperature approaches Tc.

  5. Assessment and Accommodation of Thermal Expansion of the Internal Active Thermal Control System Coolant During Launch to On-Orbit Activation of International Space Station Elements

    Science.gov (United States)

    Edwards, Darryl; Ungar, Eugene K.; Holt, James M.

    2002-01-01

    The International Space Station (ISS) employs an Internal Active Thermal Control System (IATCS) comprised of several single-phase water coolant loops. These coolant loops are distributed throughout the ISS pressurized elements. The primary element coolant loops (i.e. U.S. Laboratory module) contain a fluid accumulator to accomodate thermal expansion of the system. Other element coolant loops are parasitic (i.e. Airlock), have no accumulator, and require an alternative approach to insure that the system maximum design pressure (MDP) is not exceeded during the Launch to Activation (LTA) phase. During this time the element loops is a stand alone closed system. The solution approach for accomodating thermal expansion was affected by interactions of system components and their particular limitations. The mathematical solution approach was challenged by the presence of certain unknown or not readily obtainable physical and thermodynamic characteristics of some system components and processes. The purpose of this paper is to provide a brief description of a few of the solutions that evolved over time, a novel mathematical solution to eliminate some of the unknowns or derive the unknowns experimentally, and the testing and methods undertaken.

  6. Anomalous law of cooling

    OpenAIRE

    Lapas, Luciano C.; Ferreira, Rogelma M. S.; Oliveira, Fernando A.; Rubí, J. Miguel

    2014-01-01

    We analyze the temperature relaxation phenomena of systems in contact with a thermal reservoir that undergo a non-Markovian diffusion process. From a generalized Langevin equation, we show that the temperature is governed by a law of cooling of the Newton's law type in which the relaxation time depends on the velocity autocorrelation and is then characterized by the memory function. The analysis of the temperature decay reveals the existence of an anomalous cooling in which the temperature ma...

  7. Anomalous magnetic moment of anyons

    CERN Document Server

    Gat, G; Gat, Gil; Ray, Rashmi

    1994-01-01

    The anomalous magnetic moment of anyons is calculated to leading order in a 1/N expansion. It is shown that the gyromagnetic ratio g remains 2 to the leading order in 1/N. This result strongly supports that obtained in \\cite{poly}, namely that g=2 is in fact exact.

  8. The pseudogap and anisotropic thermal expansion in RMn(4)Al(8) (R = La,Y,Lu and Sc).

    Science.gov (United States)

    Muro, Y; Nakamura, H; Kohara, T

    2006-04-26

    The temperature dependence of the magnetic susceptibility shows a broad maximum at ∼550 and 630 K for LuMn(4)Al(8) and ScMn(4)Al(8), respectively, which can be interpreted as due to the presence of a pseudogap in the effective bands as in LaMn(4)Al(8) and YMn(4)Al(8). The anisotropic thermal expansion observed for RMn(4)Al(8) (R = La, Y, Lu and Sc) and the sensitive volume dependence of the gap width throughout the RMn(4)Al(8) system suggest dominant magnetic coupling in Mn spin chains along the c axis.

  9. Elastic anisotropy and low-temperature thermal expansion in the shape memory alloy Cu-Al-Zn.

    Science.gov (United States)

    Kuruvilla, Santhosh Potharay; Menon, C S

    2008-04-01

    Cu-based shape memory alloys are known for their technologically important pseudo-elastic and shapememory properties, which are intimately associated with the martensitic transformation. A combination of deformation theory and finite-strain elasticity theory has been employed to arrive at the expressions for higher order elastic constants of Cu-Al-Zn based on Keating's approach. The second- and third-order elastic constants are in good agreement with the measurements. The aggregate elastic properties like bulk modulus, pressure derivatives, mode Grüneisen parameters of the elastic waves, low temperature limit of thermal expansion, and the Anderson-Grüneisen parameter are also presented.

  10. Application of Mythen Detector In-situ XRD Study on The Thermal Expansion Behavior of Metal Indium

    OpenAIRE

    DU, RONG; Chen, Zhongjun; Cai, Quan; Fu, Jianlong; Gong, Yu; Wu, Zhonghua

    2015-01-01

    A Mythen detector has been equipped at the beamline 4B9A of Beijing Synchrotron Radiation Facility, which can be used for in-situ real-time measurement of X-ray diffraction (XRD) full profiles. In this paper, the thermal expansion behavior of metal indium has been studied by using the in-situ XRD technique with the Mythen detector. The indium film was heated from 30 to 160 {\\deg}C with a heating rate of 2 {\\deg}C/min. The in-situ XRD full-profiles were collected with a rate of one profile per...

  11. The effect of bromination of carbon fibers on the coefficient of thermal expansion of graphite fiber-epoxy composites

    Science.gov (United States)

    Jaworske, D. A.; Maciag, C.

    1987-01-01

    To examine the effect of bromination of carbon fibers on the coefficient of thermal expansion (CTE) of carbon fiber epoxy composites, several pristine and brominated carbon fiber-epoxy composite samples were subjected to thermomechanical analysis. The CTE's of these samples were measured in the uniaxial and transverse directions. The CTE was dominated by the fibers in the uniaxial direction, while it was dominated by the matrix in the transverse directions. Bromination had no effect on the CTE of any of the composites. In addition, the CTE of fiber tow was measured in the absence of a polymer matrix, using an extension probe. The results from this technique were inconclusive.

  12. Thermal conductivity and thermal linear expansion measurements on molten salts for assessing their behaviour as heat transport fluid in thermodynamics solar systems

    Science.gov (United States)

    Coppa, P.; Bovesecchi, G.; Fabrizi, F.

    2010-08-01

    Molten salts (sodium and potassium nitrides) are going to be used in many different plants as heat transferring fluids, e.g. concentration solar plants, nuclear power plants, etc. In fact they present may important advantages: their absolute safety and non toxicity, availability and low cost. But their use, e.g. in the energy receiving pipe in the focus of the parabolic mirror concentrator of the solar thermodynamic plant, requires the accurate knowledge of the thermophysical properties, above all thermal conductivity, viscosity, specific heat and thermal linear expansion, in the temperature range 200°C÷600°C. In the new laboratory by ENEA Casaccia, SolTerm Department all these properties are going to be measured. Thermal conductivity is measured with the standard probe method (linear heat source inserted into the material) manufacturing a special probe suited to the foreseen temperature range (190-550°C). The probe is made of a ceramic quadrifilar pipe containing in different holes the heater (Ni wire) and the thermometer (type J thermocouple). The thermal linear expansion will be measured by a special system designed and built to this end, measuring the sample dilatation by the reflection of a laser beam by the bottom of the meniscus in the liquid solid interface. The viscosity will be evaluated detecting the start of the natural convection in the same experiment as to measure thermal conductivity. In the paper the construction of the devices, the results of preliminary tests and an evaluation of the obtainable accuracy are reported.

  13. Thermally induced changes in the focal distance of composite mirrors - Composites with a zero coefficient of thermal expansion of the radius of curvature

    Science.gov (United States)

    Dolgin, Benjamin P.

    1992-01-01

    Calculations are presented of the coefficient of thermal expansion (CTE) of the radius of curvature of the reflector face sheets made of a quasi-isotropic composite. It is shown that, upon cooling, the change of the CTE of the focal distance of the mirror is equal to that of the radius of the curvature of the reflector face sheet. The CTE of the radius of the curvature of a quasi-isotropic composite face sheet depends on both the in-plane and the out-of-plane CTEs. The zero in-plane CTE of a face sheet does not guarantee mirrors with no focal length changes.

  14. Thermoacoustic Effects at a Solid-Fluid Boundary: The Role of a Second-Order Thermal Expansion Coefficient

    Science.gov (United States)

    Gopinath, Ashok

    1996-01-01

    Analytical and numerical studies are to be carried out to examine time-averaged thermal effects which are induced by the interaction of strong acoustic fields with a rigid boundary (thermoacoustic streaming). Also of interest is the significance of a second-order thermal expansion coefficient that emerges from this analysis. The model problem to be considered is that of a sphere that is acoustically levitated such that it is effectively isolated in a high-intensity standing acoustic field. The solution technique involves matched asymptotic analysis along with numerical solution of the boundary layer equations. The objective of this study is to predict the thermoacoustic streaming behavior and fully understand the role of the associated second-order thermodynamic modulus.

  15. Thermal expansion behavior of A- and B-type amylose crystals in the low-temperature region.

    Science.gov (United States)

    Kobayashi, Kayoko; Kimura, Satoshi; Naito, Philip-Kunio; Togawa, Eiji; Wada, Masahisa

    2015-10-20

    The thermal expansion behaviors of A-type and B-type amylose crystals, which were prepared by recrystallization of short amylose chains synthesized by phosphorylase, were investigated using synchrotron X-ray powder diffraction between 100 and 300K. For both types of crystals, the room-temperature phase (RT phase), which is the usually observed phase, transitioned to a low-temperature phase (LT phase), on cooling. The phase transitions took place reversibly with rapid changes in the unit-cell parameters around 200-270K. The differences between the RT and LT phase were investigated using solid-state (13)C NMR spectroscopy, which revealed there were changes in molecular chain conformations. These results suggest that the phase transition of water molecules on the crystalline surfaces affects the thermal behavior and structure of polysaccharide crystals.

  16. Crystal structures and thermal expansion properties of Y2-xErxMo4O15 (x = 0.0-2.0) solid solutions

    Institute of Scientific and Technical Information of China (English)

    2007-01-01

    A new series of rare earth compounds, Y2-xErxMo4O15 (x = 0.0-2.0), were synthesized and their structures were determined by powder X-ray diffraction (XRD). Rietveld analysis of XRD patterns reveals that the compounds of this series crystallize in monoclinic system with space group P21/c. The lattice parameters a, b, c, β and the unit cell volume V decrease linearly with increasing Er content. The thermal expansion properties of these compounds were studied under high-temperature XRD. Positive thermal expansions of compounds Y2-xErxMo4O15 are found to be anisotropic along the three crystallographic directions where a and c axes expand while b axis contracts in the whole temperature range. By analysis of data, the expansion of weak band Mo2-O14 with rising temperature should be responsible for positive thermal expansion.

  17. Thermal expansion and contraction of an elastomer stamp causes position-dependent polymer patterns in capillary force lithography.

    Science.gov (United States)

    Kim, Bongsoo; Park, Minwoo; Kim, Youn Sang; Jeong, Unyong

    2011-12-01

    It is often observed that polymer patterns fabricated by capillary force lithography (CFL) are not identical, position-dependent even in one sample. The drawback has not been successfully explained so far. This paper reveals that the position-dependent pattern is mainly caused by the volume expansion and contraction of the elastomer stamp during heating and cooling in the CFL process. The stamp expands on a polymer liquid on heating, accumulating the polymer at one side-wall of each pattern of the stamp. And the stamp shrinks back to the initial position, accumulating the polymer at the opposite wall of the stamp pattern. For crystalline polymers, the morphology was mainly determined by the annealing temperature, that is, the degree of expansion. The position-dependence of the morphology was enhanced as the annealing temperature was increased. For amorphous polymers, the morphology was sensitive to cooling rate. Fast cooling led to a frozen morphology generated at the hot annealing temperature, while slow cooling produced an opposite morphology from the one at the annealing. The experimental results were theoretically explained by analyzing thermal expansion of the stamp and the shear stress exerted in the polymer layer. In the conclusion, we added our suggestions to avoid the nonuniformity in the polymer pattern by CFL process.

  18. The Dependence of the Change in the Coefficient of Thermal Expansion of Graphite Fiber Reinforced Polyimide IM7-K3B on Microcracking due to Thermal Cycling

    Science.gov (United States)

    Stewart, Melissa C.

    1995-01-01

    Composite IM7-K3B was subjected to a simulated high speed aircraft thermal environment to determine the effects of microcracking on the change in CTE. IM7-K3B is a graphite fiber reinforced polyimide laminate, manufactured by Dupont. The lay-up for the material was (0.90((Sub 3)(Sub s))). The specimens were placed in a laser-interferometric dilatometer to obtain thermal expansion measurements and were then repeatedly cycled between -65 F and 350 F up to 1000 cycles. After cycling they were scanned for microcracks at a magnification of 400x. The material was expected not to crack and to have a near zero CTE. Some microcracking did occur in all specimens and extensive microcracking occurred in one specimen. Further testing is required to determine how closely the CTE and microcracking are related.

  19. Thermal expansion behaviour of a versatile monazite phase with simulated HLW: A high temperature x-ray diffraction study

    Energy Technology Data Exchange (ETDEWEB)

    Asuvathraman, R.; Kutty, K.V. Govindan, E-mail: kvg@igcar.gov.in

    2014-04-01

    Highlights: • The XPS characterization of the versatile monazite phase, Ce{sub 0.8}Ca{sub 0.2}PO{sub 4} (Ce{sub 0.6}{sup 3+}Ce{sub 0.2}{sup 4+}Ca{sub 0.2}{sup 2+}PO{sub 4}) confirms the mixed valence state of Ce. • The monoclinic lattice parameters all increase to nearly the same extent with temperature displaying the isotropic behaviour for the monazite phase. • The thermal expansion along the three crystallographic axes vary in the order b < a < c. - Abstract: Synthetic analogues of monazite are considered as an alternate ceramic host for the immobilization of high level waste (HLW) generated in the nuclear fuel cycle. The Ca doped CePO{sub 4} (Ce{sub 0.8}Ca{sub 0.2}PO{sub 4}) is expected to be a versatile monazite phase for this purpose due to the mixed valence state of cerium in this compound which assists in accommodating cations of any valence by initiating the internal redox reaction, viz., Ce{sup 3+} ⇌ Ce{sup 4+} + e{sup −}, as required by the incoming cation for charge neutrality of the lattice. The thermal expansion of this versatile monazite phase with 20 wt.% simulated HLW was measured using high temperature x-ray diffractometer (HTXRD) in the temperature range of 298–973 K and are reported here. The thermal expansion behaviour is found to be similar for CePO{sub 4}, Ce{sub 0.8}Ca{sub 0.2}PO{sub 4} and Ce{sub 0.8}Ca{sub 0.2}PO{sub 4} with 20 wt.% simulated HLW with the average volume expansion coefficient of 27.4, 26.5 and 24.1 × 10{sup −6} K{sup −1} respectively in the temperature range of 298–973 K.

  20. Flow and linear coefficient of thermal expansion of four types of Base Plate waxes compared with ADA standard

    Directory of Open Access Journals (Sweden)

    Monzavi A

    2002-07-01

    Full Text Available Waxes have a lot of applications in dentistry. Such materials are of thermoplastic type that undergoes deformation in different temperatures. Two important properties of base plate waxes are flow and their coefficient of linear thermal expansion. Recently, different institutions, inside the country, produce dentistry waxes, while they have not been standardized. Consequently, consumers' dissatisfaction are observed. In this research, the two above- mentioned factors were compared between three kinds of Iranian waxes with Cavex that is foreign production, based on test number 24 of ADA. To measure the flow rate in the temperatures of 23, 37 and 45°c, Wilcoxon statistical analysis was used. The results showed that in 23°c, the flow rate of Cavex and Azardent waxes met ADA standards; however, it was not true for two others types. In 37°c, the flow of none of the waxes was standardized and in 45°c their flow was acceptable, moreover, thermal expansion coefficient, for Cavex and Azardent types, was based on ADA standard.

  1. Thermal Expansion Behavior of Precursor-Derived Amorphous Si-C-N and Si-B-C-N Ceramics

    Institute of Scientific and Technical Information of China (English)

    2002-01-01

    Thermal expansion behaviors of some precursor-derived amorphous Si-C-N and Si-B-C-N ceramics, which were shaped by plastic forming after crosslink, were studied. To complete the shrinkage and densification, after thermolysis specimens were heat treated at a temperature of 1400℃ for 10 h in nitrogen atmosphere. The thermal expansion coefficient of VT50-derived amorphous Si-C-N ceramic increases from 1.98×10-6/K at 400℃ to 3.09×10-6/K at 1000℃, of NCP200-derived amorphous Si-C-N ceramic increases from 2.35× 10-6/K at 400℃ to 3.45×10-6/K at1000℃, and of T2-1-derived amorphous Si-B-C-N ceramic increases from 2.08×10-6/K at 400℃ to 3.18×10-6/K at 1000℃. No glass transition for these amorphous ceramic materials was detected, indicating that as-thermolyzed precursor-derived Si-(B-)C-N ceramic materials are amorphous solids, but not glasses.

  2. Mechanical, electrical, and thermal expansion properties of carbon nanotube-based silver and silver-palladium alloy composites

    Institute of Scientific and Technical Information of China (English)

    Hemant Pal; Vimal Sharma

    2014-01-01

    The mechanical, electrical, and thermal expansion properties of carbon nanotube (CNT)-based silver and silver–palladium (10:1, w/w) alloy nanocomposites are reported. To tailor the properties of silver, CNTs were incorporated into a silver matrix by a modified mo-lecular level-mixing process. CNTs interact weakly with silver because of their non-reactive nature and lack of mutual solubility. Therefore, palladium was utilized as an alloying element to improve interfacial adhesion. Comparative microstructural characterizations and property evaluations of the nanocomposites were performed. The structural characterizations revealed that decorated type-CNTs were dispersed, em-bedded, and anchored into the silver matrix. The experimental results indicated that the modification of the silver and silver–palladium nanocomposite with CNT resulted in increases in the hardness and Young’s modulus along with concomitant decreases in the electrical con-ductivity and the coefficient of thermal expansion (CTE). The hardness and Young’s modulus of the nanocomposites were increased by 30%-40% whereas the CTE was decreased to 50%-60% of the CTE of silver. The significantly improved CTE and the mechanical proper-ties of the CNT-reinforced silver and silver–palladium nanocomposites are correlated with the intriguing properties of CNTs and with good interfacial adhesion between the CNTs and silver as a result of the fabrication process and the contact action of palladium as an alloying ele-ment.

  3. Application of Mythen detector: In-situ XRD study on the thermal expansion behavior of metal indium

    Science.gov (United States)

    Du, Rong; Chen, ZhongJun; Cai, Quan; Fu, JianLong; Gong, Yu; Wu, ZhongHua

    2016-07-01

    A Mythen detector has been equipped at the beamline 4B9A of Beijing Synchrotron Radiation Facility (BSRF), which is expected to enable BSRF to perform time-resolved measurement of X-ray diffraction (XRD) full-profiles. In this paper, the thermal expansion behavior of metal indium has been studied by using the in-situ XRD technique with the Mythen detector. The indium was heated from 303 to 433 K with a heating rate of 2 K/min. The in-situ XRD full-profiles were collected with a rate of one profile per 10 seconds. Rietveld refinement was used to extract the structural parameters. The results demonstrate that these collected quasi-real-time XRD profiles can be well used for structural analysis. The metal indium was found to have a nonlinear thermal expansion behavior from room temperature to the melting point (429.65 K). The a-axis of the tetragonal unit cell expands with a biquadratic dependency on temperature, while the c-axis contracts with a cubic dependency on temperature. By the time-resolved XRD measurements, it was observed that the [200] preferred orientation can maintain to about 403.15 K. While (110) is the last and detectable crystal plane just before melting of the polycrystalline indium foil. This study is not only beneficial to the application of metal indium, but also exhibits the capacity of in-situ time-resolved XRD measurements at the X-ray diffraction station of BSRF.

  4. Temperature dependence of density, thermal expansion coefficient and shear viscosity of supercooled glycerol as a reflection of its structure.

    Science.gov (United States)

    Blazhnov, Ivan V; Malomuzh, Nikolay P; Lishchuk, Sergey V

    2004-10-01

    The relationship of the microstructure of supercooled, highly viscous glycerol to the temperature dependence of its density, thermal expansion coefficient, and shear viscosity are discussed. The character of this temperature dependence at the transition from low viscosity state to the solid amorphous state (solidified state without nuclei) is described with help of function psi, which can be interpreted as the effective number of degrees of freedom responsible for the change of viscosity of glycerol over a broad range; these degrees of freedom are those related to the alpha-relaxation process. It is shown that the change in effective activation energy of the viscosity is completely determined by the parameter psi. The change in the shear viscosity of glycerol due to the influence of the solid-phase nuclei is considered. It is shown that the introduction of the parameter phi, equal to the specific volume occupied by the nuclei of the solid phase, together with psi provides a natural explanation of the temperature dependence of density and thermal expansion coefficients of glycerol in its liquid, solid amorphous, glassy, and crystal states. The peculiarities of the temperature dependence of phi(T) and psi(T) for glycerol and o-terphenyl are compared.

  5. Compressibility, thermal expansion coefficient and heat capacity of CH4 and CO2 hydrate mixtures using molecular dynamics simulations.

    Science.gov (United States)

    Ning, F L; Glavatskiy, K; Ji, Z; Kjelstrup, S; H Vlugt, T J

    2015-01-28

    Understanding the thermal and mechanical properties of CH4 and CO2 hydrates is essential for the replacement of CH4 with CO2 in natural hydrate deposits as well as for CO2 sequestration and storage. In this work, we present isothermal compressibility, isobaric thermal expansion coefficient and specific heat capacity of fully occupied single-crystal sI-CH4 hydrates, CO2 hydrates and hydrates of their mixture using molecular dynamics simulations. Eight rigid/nonpolarisable water interaction models and three CH4 and CO2 interaction potentials were selected to examine the atomic interactions in the sI hydrate structure. The TIP4P/2005 water model combined with the DACNIS united-atom CH4 potential and TraPPE CO2 rigid potential were found to be suitable molecular interaction models. Using these molecular models, the results indicate that both the lattice parameters and the compressibility of the sI hydrates agree with those from experimental measurements. The calculated bulk modulus for any mixture ratio of CH4 and CO2 hydrates varies between 8.5 GPa and 10.4 GPa at 271.15 K between 10 and 100 MPa. The calculated thermal expansion and specific heat capacities of CH4 hydrates are also comparable with experimental values above approximately 260 K. The compressibility and expansion coefficient of guest gas mixture hydrates increase with an increasing ratio of CO2-to-CH4, while the bulk modulus and specific heat capacity exhibit the opposite trend. The presented results for the specific heat capacities of 2220-2699.0 J kg(-1) K(-1) for any mixture ratio of CH4 and CO2 hydrates are the first reported so far. These computational results provide a useful database for practical natural gas recovery from CH4 hydrates in deep oceans where CO2 is considered to replace CH4, as well as for phase equilibrium and mechanical stability of gas hydrate-bearing sediments. The computational schemes also provide an appropriate balance between computational accuracy and cost for predicting

  6. Giant Phonon Anharmonicity and Anomalous Pressure Dependence of Lattice Thermal Conductivity in Y2Si2O7 silicate

    Science.gov (United States)

    Luo, Yixiu; Wang, Jiemin; Li, Yiran; Wang, Jingyang

    2016-07-01

    Modification of lattice thermal conductivity (κL) of a solid by means of hydrostatic pressure (P) has been a crucially interesting approach that targets a broad range of advanced materials from thermoelectrics and thermal insulators to minerals in mantle. Although it is well documented knowledge that thermal conductivity of bulk materials normally increase upon hydrostatic pressure, such positive relationship is seriously challenged when it comes to ceramics with complex crystal structure and heterogeneous chemical bonds. In this paper, we predict an abnormally negative trend dκL/dP functional theoretical calculations. The mechanism is disclosed as combined effects of slightly decreased group velocity and significantly augmented scattering of heat-carrying acoustic phonons in pressured lattice, which is originated from pressure-induced downward shift of low-lying optic and acoustic phonons. The structural origin of low-lying optic phonons as well as the induced phonon anharmonicity is also qualitatively elucidated with respect to intrinsic bonding heterogeneity of Y2Si2O7. The present results are expected to bring deeper insights for phonon engineering and modulation of thermal conductivity in complex solids with diverging structural flexibility, enormous bonding heterogeneity, and giant phonon anharmonicity.

  7. Thermal expansion behaviour and phase stability of AFe$_2$As$_2$ (A=Ca, Sr and Eu) using powder diffraction technique

    Indian Academy of Sciences (India)

    MISHRA S K; MITTAL R; KRISHNA P S R; SASTRY P U; CHAPLOT S L; BABU P D; MATSUISHI S; HOSONO H

    2016-06-01

    The thermal expansibilities and phase stabilities of AFe$_2$As$_2$ (A = Ca, Sr and Eu) have been investigated by powder diffraction techniques in the temperature range 5–600 K.We found the anisotropic thermal expansivities with temperature for all the compounds. The lattice parameter in the tetragonal phase (AT) of CaFe$_2$As$_2$ contracts with increasing temperature, whereas CT expands. The rate of contraction in AT is lower than the rate of expansion in CT. Other compounds show normal thermal expansion behaviour along both a- and c-axes. In-plane expansion (i.e., along the a-axis) is found to be the smallest for EuFe$_2$As$_2$ and the highest for BaFe$_2$As$_2$. However, therate of change of thermal expansivities along out-of-plane (i.e., along the c-axis) is higher as we go from Ba, Sr, Eu and Ca, respectively. Above 600 K, we notice the appearance/disappearance of certain reflections which suggest that tetragonal phase is not stable above this temperature for these compounds.

  8. Probing the Mott physics in κ-(BEDT-TTF)₂X salts via thermal expansion.

    Science.gov (United States)

    de Souza, Mariano; Bartosch, Lorenz

    2015-02-11

    In the field of interacting electron systems the Mott metal-to-insulator (MI) transition represents one of the pivotal issues. The role played by lattice degrees of freedom for the Mott MI transition and the Mott criticality in a variety of materials are current topics under debate. In this context, molecular conductors of the κ-(BEDT-TTF)2X type constitute a class of materials for unraveling several aspects of the Mott physics. In this review, we present a synopsis of literature results with focus on recent expansivity measurements probing the Mott MI transition in this class of materials. Progress in the description of the Mott critical behavior is also addressed.

  9. The relationship between bond ionicity, lattice energy, coefficient of thermal expansion and microwave dielectric properties of Nd(Nb(1-x)Sb(x))O4 ceramics.

    Science.gov (United States)

    Zhang, Ping; Zhao, Yonggui; Wang, Xiuyu

    2015-06-28

    The crystalline structure refinement, chemical bond ionicity, lattice energy and coefficient of thermal expansion were carried out for Nd(Nb(1-x)Sb(x))O4 ceramics with a monoclinic fergusonite structure to investigate the correlations between the crystalline structure, phase stability, bond ionicity, lattice energy, coefficient of thermal expansion, and microwave dielectric properties. The bond ionicity, lattice energy, and coefficient of thermal expansion of Nd(Nb(1-x)Sb(x))O4 ceramics were calculated using a semiempirical method based on the complex bond theory. The phase structure stability varied with the lattice energy which was resulted by the substitution constant of Sb(5+). With the increasing of the Sb(5+) contents, the decrease of Nb/Sb-O bond ionicity was observed, which could be contributed to the electric polarization. The ε(r) had a close relationship with the Nb/Sb-O bond ionicity. The increase of the Q×f and |τ(f)| values could be attributed to the lattice energy and the coefficient of thermal expansion. The microwave dielectric properties of Nd(Nb(1-x)Sb(x))O4 ceramics with the monoclinic fergusonite structure were strongly dependent on the chemical bond ionicity, lattice energy and coefficient of thermal expansion.

  10. Ba(1-x)Sr(x)Zn2Si2O7--A new family of materials with negative and very high thermal expansion.

    Science.gov (United States)

    Thieme, Christian; Görls, Helmar; Rüssel, Christian

    2015-12-15

    The compound BaZn2Si2O7 shows a high coefficient of thermal expansion up to a temperature of 280 °C, then a transition to a high temperature phase is observed. This high temperature phase exhibits negative thermal expansion. If Ba(2+) is successively replaced by Sr(2+), a new phase with a structure, similar to that of the high temperature phase of BaZn2Si2O7, forms. At the composition Ba0.8Sr0.2Zn2Si2O7, this new phase is completely stabilized. The crystal structure was determined with single crystal X-ray diffraction using the composition Ba0.6Sr0.4Zn2Si2O7, which crystallizes in the orthorhombic space group Cmcm. The negative thermal expansion is a result of motions and distortions inside the crystal lattice, especially inside the chains of ZnO4 tetrahedra. Dilatometry and high temperature X-ray powder diffraction were used to verify the negative thermal expansion. Coefficients of thermal expansion partially smaller than -10·10(-6) K(-1) were measured.

  11. Oxidation resistant and low coefficient of thermal expansion Nia1-CoCrAly alloy

    Science.gov (United States)

    Hebsur, Mohan G. (Inventor)

    2004-01-01

    A bond coat composition for use in thermal barrier coatings comprises a NiAl--CoCrAlY matrix containing particles of AlN dispersed therein. The bond coat composition is prepared by croymilling NiAl and CoCrAlY in liquid nitrogen.

  12. Thermal expansion of Y 2Ba 4Cu 7O 15 in the temperature range 10-290 K, and comparison with YBa 2Cu 3O 7 and YBa 2Cu 4O 8

    Science.gov (United States)

    Alexandrov, O. V.; François, M.; Graf, T.; Yvon, K.

    1991-01-01

    The orthorhombic lattice parameters of superconducting Y 2Ba 4Cu 7O 15.28 ( Tc = 85.5 K) are measured as a function of temperature (10-290 K) to a precision of 1 × 10 -4 on a low-temperature Guinier X-ray powder diffractometer by using an internal standard. The thermal expansion is anisotropic (( a297 K- a10 K)/ a297 K = 17(2) × 10 -4, ( b297 K- b10 K)/ b297 K = 11(2) × 10 -4, ( c297 K- c10 K)/ c297 K = 34(2) × 10 -4) and intermediate between that of structurally related YBa 2Cu 3O 7 and YBa 2Cu 4O 8. It is attributed to anharmonic thermal vibrations of the CuO 2-planes and CuO single- and double-chains in the directions of vacant oxygen sites. No anomalous changes as a function of temperature are found within experimental resolution.

  13. Spatial variability in the coefficient of thermal expansion induces pre-service stresses in computer models of virgin Gilsocarbon bricks

    Science.gov (United States)

    Arregui-Mena, José David; Margetts, Lee; Griffiths, D. V.; Lever, Louise; Hall, Graham; Mummery, Paul M.

    2015-10-01

    In this paper, the authors test the hypothesis that tiny spatial variations in material properties may lead to significant pre-service stresses in virgin graphite bricks. To do this, they have customised ParaFEM, an open source parallel finite element package, adding support for stochastic thermo-mechanical analysis using the Monte Carlo Simulation method. For an Advanced Gas-cooled Reactor brick, three heating cases have been examined: a uniform temperature change; a uniform temperature gradient applied through the thickness of the brick and a simulated temperature profile from an operating reactor. Results are compared for mean and stochastic properties. These show that, for the proof-of-concept analyses carried out, the pre-service von Mises stress is around twenty times higher when spatial variability of material properties is introduced. The paper demonstrates that thermal gradients coupled with material incompatibilities may be important in the generation of stress in nuclear graphite reactor bricks. Tiny spatial variations in coefficient of thermal expansion (CTE) and Young's modulus can lead to the presence of thermal stresses in bricks that are free to expand.

  14. Electrical conductivity and thermal expansion behavior of MMoO{sub 4} (M = Ca, Sr and Ba)

    Energy Technology Data Exchange (ETDEWEB)

    Maji, Binoy Kumar; Jena, Hrudananda, E-mail: hruda66@yahoo.co.in; Asuvathraman, R.; Kutty, K.V. Govindan

    2015-08-15

    Highlights: • CaMoO{sub 4}, SrMoO{sub 4} and BaMoO{sub 4} are scheelite type oxides exhibit electrical conduction. • These are the interaction products of radio-nuclides in the nuclear fuel cycle. • Decrease in thermal expansion shows decrease in bond strength from CaMoO{sub 4} to BaMoO{sub 4}. • Decrease in σ from CaMoO{sub 4} to BaMoO{sub 4} is due to decrease in electropositive character. • Diffusion coefficient (D) of oxide ion conduction decreases from CaMoO{sub 4} to BaMoO{sub 4}. - Abstract: Alkaline earth (Ca, Sr, Ba) molybdates were synthesized by solid state reaction route. The compounds were characterized by powder-XRD, TG–DTA techniques. The electrical conductivities of these compounds were measured by AC-impedance technique at 673–1073 K. The activation energies of electrical conduction of CaMoO{sub 4}, SrMoO{sub 4} and BaMoO{sub 4} were found to be 1.29 ± 0.01 eV, 1.33 ± 0.01 eV and 1.31 ± 0.01 eV respectively. The linear thermal expansion of these molybdates was measured by dilatometry. The mean coefficients (α{sub m}) of thermal expansion for these compounds were found to be in the range of 9.38 ± 0.18 × 10{sup −6}–12.96 ± 0.25 × 10{sup −6} K{sup −1} at 305–1005 K temperature range. The diffusion coefficient (D) values of oxide ion conduction for these molybdates were determined and found to be in the range of 9.48 ± 0.02 × 10{sup −14}–3.32 ± 0.01 × 10{sup −10} for CaMoO{sub 4}, 5.86 ± 0.02 × 10{sup −14}–2.50 ± 0.01 × 10{sup −10} for SrMoO{sub 4} and 3.46 ± 0.02 × 10{sup −14}–1.22 ± 0.01 × 10{sup −10} cm{sup 2} s{sup −1} for BaMoO{sub 4} at 673–1073 K range of temperature.

  15. A model for thermal oxidation of Si and SiC including material expansion

    Energy Technology Data Exchange (ETDEWEB)

    Christen, T., E-mail: thomas.christen@ch.abb.com; Ioannidis, A. [ABB Corporate Research, Segelhofstrasse 1K, CH-5405 Baden (Switzerland); Winkelmann, C. [ETH Zürich, Seminar for Applied Mathematics, Rämistrasse 101, CH-8092 Zürich (Switzerland)

    2015-02-28

    A model based on drift-diffusion-reaction kinetics for Si and SiC oxidation is discussed, which takes the material expansion into account with an additional convection term. The associated velocity field is determined self-consistently from the local reaction rate. The approach allows a calculation of the densities of volatile species in an nm-resolution at the oxidation front. The model is illustrated with simulation results for the growth and impurity redistribution during Si oxidation and for carbon and silicon emission during SiC oxidation. The approach can be useful for the prediction of Si and/or C interstitial distribution, which is particularly relevant for the quality of metal-oxide-semiconductor electronic devices.

  16. The enhanced range of temperature for coefficient of low thermal expansion, electrical and thermal conductivities of Cu substituted Fe-Ni invar alloys

    Science.gov (United States)

    Khan, S. A.; Ziya, A. B.; Ibrahim, A.; Atiq, S.; Ahmad, N.; Bashir, F.

    2016-03-01

    Six alloys of Fe65Ni35-x Cu x (x = 0, 0.2, 0.6, 1, 1.4, 1.8 at.%) have been prepared by conventional arc-melting technique and characterized by utilizing high temperature x-ray diffraction (HTXRD) technique at a range from room temperature to 773 K for determination of phase, lattice parameter (a), coefficient of thermal expansion (α(T)), mean square amplitude of vibration (\\bar{{u}2}), characteristic Debye temperature (ΘD), electrical resistivity (ρ) and thermal conductivity (κ). The studies showed that these alloys form face centered cubic structure (fcc) throughout the investigated temperature range. The values of α(T) were found to be comparable to those for conventional Fe-Ni invar alloys but have increased temperature span to a significant extent. The mean square amplitude of vibration (\\bar{{u}2}) and Debye temperature were found to remain almost unchanged in the invar temperature range, whereas the electrical and thermal conductivity were found to improve.

  17. CFD Analysis of Thermally Induced Thermodynamic Loses in the Reciprocating Compression and Expansion of Real Gases

    OpenAIRE

    Taleb, AI; Sapin, PMC; Barfu?, C; Fabris, D.; Markides, CN

    2016-01-01

    The efficiency of expanders is of prime importance in determining the overall performance of a variety of thermodynamic power systems, with reciprocating-piston expanders favoured at intermediate-scales of application (typically 10???100 kW). Once the mechanical losses in reciprocating machines are minimized (e.g. through careful valve design and operation), losses due to the unsteady thermal-energy exchange between the working fluid and the solid walls of the containing device can become the...

  18. An Ag based brazing system with a tunable thermal expansion for the use as sealant for solid oxide cells

    DEFF Research Database (Denmark)

    Kiebach, Wolff-Ragnar; Engelbrecht, Kurt; Grahl-Madsen, Laila;

    2016-01-01

    An Ag-Al2TiO5 composite braze was developed and successfully tested as seal for solid oxide cells. The thermo-mechanical properties of the Ag-Al2TiO5 system and the chemical compatibility between this composite braze and relevant materials used in stacks were characterized and the leak rates...... as a function of the operation temperature were measured. The thermal expansion coefficient in the Ag-Al2TiO5 system can be tailored by varying the amount of the ceramic filler. The brazing process can be carried out in air, the joining partners showed a good chemical stability and sufficient low leak rates...

  19. Thermal expansion and magnetostriction of pure and doped RAgSb(2) (R = Y, Sm, La) single crystals.

    Science.gov (United States)

    Bud'ko, S L; Law, S A; Canfield, P C; Samolyuk, G D; Torikachvili, M S; Schmiedeshoff, G M

    2008-03-19

    Data on temperature-dependent, anisotropic thermal expansion in pure and doped RAgSb(2) (R = Y, Sm, La) single crystals are presented. Using the Ehrenfest relation and heat capacity measurements, uniaxial pressure derivatives for long range magnetic ordering and charge density wave transition temperatures are evaluated and compared with the results of the direct measurements under hydrostatic pressure. In-plane and c-axis pressure have opposite effects on the phase transitions in these materials, with in-plane effects being significantly weaker. Quantum oscillations in magnetostriction were observed for the three pure compounds, with the possible detection of new frequencies in SmAgSb(2) and LaAgSb(2). The uniaxial (along the c-axis) pressure derivatives of the dominant extreme orbits (β) were evaluated for YAgSb(2) and LaAgSb(2).

  20. Magnetic field-induced changes of lattice parameters and thermal expansion behavior of the CoMnSi compound

    Energy Technology Data Exchange (ETDEWEB)

    Kou, R. H.; Gao, J.; Wang, G.; Liu, Y. D.; Wang, Y. D.; Ren, Y.; Brown, D. E.

    2016-02-01

    The crystal structure of the CoMnSi compound during zero-field cooling and field cooling from room temperature down to 200 K was studied using the synchrotron radiation X-ray diffraction technique. The results show that the lattice parameters and thermal expansion behavior of the sample are changed by the applied magnetic fields. The lattice contracts along the a axis, but expands along the b and c axes. Due to enlarged and anisotropic changes under a magnetic field of 6 T, the lattice shows an invar-like behavior along all three axes. Critical interatomic distances and bond angles also show large changes under the influence of such a high magnetic field. These magnetic field-induced changes of the lattice are discussed with respect to their contributions to the large magnetocaloric effect of the CoMnSi compound.

  1. An Adaptive Neuro-Fuzzy Inference System for Sea Level Prediction Considering Tide-Generating Forces and Oceanic Thermal Expansion

    Directory of Open Access Journals (Sweden)

    Li-Ching Lin Hsien-Kuo Chang

    2008-01-01

    Full Text Available The paper presents an adaptive neuro fuzzy inference system for predicting sea level considering tide-generating forces and oceanic thermal expansion assuming a model of sea level dependence on sea surface temperature. The proposed model named TGFT-FN (Tide-Generating Forces considering sea surface Temperature and Fuzzy Neuro-network system is applied to predict tides at five tide gauge sites located in Taiwan and has the root mean square of error of about 7.3 - 15.0 cm. The capability of TGFT-FN model is superior in sea level prediction than the previous TGF-NN model developed by Chang and Lin (2006 that considers the tide-generating forces only. The TGFT-FN model is employed to train and predict the sea level of Hua-Lien station, and is also appropriate for the same prediction at the tide gauge sites next to Hua-Lien station.

  2. On the sensitivity of projected oceanic thermal expansion to the parameterisation of sub-grid scale ocean mixing

    Science.gov (United States)

    Weaver, Andrew J.; Wiebe, Edward C.

    A coupled model of intermediate complexity is used to examine the importance of the parameterisation of sub-grid scale ocean mixing on the global mean steric sea level rise in global warming simulations. It is shown that when mixing associated with mesoscale eddies is treated in a more physically realistic way than the commonly used horizontal/vertical scheme, quasi-equilibrium projected steric sea level rise is more than two times lower in both 2 × CO2 and 4 × CO2 climates. This occurs despite the invariance of the coupled model climate sensitivity to the particular sub-grid scale mixing scheme employed. During the early phase of the transient integrations thermal expansion differences are smaller, although experiments using the Gent and McWilliams parameterisation for mixing associated with mesoscale eddies approach equilibrium more rapidly once the radiative forcing is held fixed. This reduced expansion commitment reflects a greater decoupling of the surface ocean from the deep ocean, due to a reduction in spurious high latitude convection that occurs when a horizontal/vertical mixing scheme is used.

  3. Anisotropic thermal expansion behavior of thin films of polymethylsilsesquioxane, a spin-on-glass dielectric for high-performance integrated circuits.

    Science.gov (United States)

    Oh, Weontae; Ree, Moonhor

    2004-08-03

    Thin films of poly(methylsilsesquioxane) (PMSSQ) are candidates for use as interdielectric layers in advanced semiconductor devices with multilayer structures. We prepared thin films of PMSSQ with thicknesses in the range 25.0-1151.0 nm by spin-casting its soluble precursor onto Si and GaAs substrates with native oxide layers and then drying and curing the films under a nitrogen atmosphere at temperatures in the range 250-400 degrees C. The out-of-plane thermal expansion coefficient alpha(perpendicular) of each film was measured over the temperature range 25-200 degrees C using spectroscopic ellipsometry and synchrotron X-ray reflectivity, while the in-plane thermal expansion coefficient alpha(parallel) of each film was determined over the temperature range 25-400 degrees C by residual stress analysis. PMSSQ films cured at higher temperatures exhibited reduced thermal expansion, which is attributed to the denser molecular packing and higher degree of cross-linking that arises at higher temperatures. Surprisingly however, all the PMSSQ films were found to exhibit very strong anisotropic thermal expansion; alpha(perpendicular) and alpha(parallel) of the films were in the ranges 140-329 ppm/ degrees C and 12-29 ppm/ degrees C respectively, depending on the curing temperature. This is the first time that cured PMSSQ thin films have been shown to exhibit anisotropic thermal expansion behavior. This anisotropic thermal expansion of the PMSSQ thin films might be due to the anisotropy of cross-link density in the films, which arises because of a combination of factors: the preferential orientation of methyl groups toward the upper film surface and the preferential network formation in the film plane that occurs during curing of the confined film. In addition, the film electron densities were determined using synchrotron X-ray reflectivity measurements and the film biaxial moduli were obtained using residual stress analysis.

  4. Molar volume, thermal expansion, and bulk modulus in liquid Fe-Ni alloys at 1 bar: Evidence for magnetic anomalies?

    Science.gov (United States)

    Nasch, P. M.; Manghnani, M. H.

    New experimental data on the molar volume Ω, thermal expansion coefficient α, and ultrasonic sound velocity vp in liquid Fe-Ni systems at temperatures between melting and 1975 K are reported. The molar volume and thermal expansion data were acquired using a penetrating γ radiation method; the sound velocity data were obtained by ultrasonic interferometry. In the temperature range of this study, the molar volume Ω increases and the sound velocity vp decreases, both linearly with temperature. The adiabatic bulk modulus KS ∝ v2p/Ωp of liquid Fe-Ni alloys is nearly independent of composition at Fe content greater than 65 wt%. The temperature derivative ∂K/∂T of both adiabatic and isothermal bulk modulus of pure liquid Fe decreases by approximately 50% upon being alloyed with 15 wt% Ni. The mixing behavior of thermodynamic and cohesive properties of liquid Fe-Ni is interpreted as resulting from the existence of disordered and localized magnetic states and correlations in the liquid state, i.e., well above the Curie temperature and extending from pure Fe into the Fe-Ni stability field. These magnetic contributions have strong mechanical effects on the structure in modifying the volume and elastic modulus by as much as 13% and 31%, respectively, in the case of pure liquid Fe. It is believed that the magnetic contribution, which is likely to be absent at core temperatures, should be removed from the measured 1-bar values of density and elastic moduli if these latter were to be used as precise anchoring points in high pressure-temperature EOS.

  5. Thermal Expansion and Second Harmonic Generation Response of the Tungsten Bronze Pb2AgNb5O15.

    Science.gov (United States)

    Lin, Kun; Gong, Pifu; Sun, Jing; Ma, Hongqiang; Wang, You; You, Li; Deng, Jinxia; Chen, Jun; Lin, Zheshuai; Kato, Kenichi; Wu, Hui; Huang, Qingzhen; Xing, Xianran

    2016-03-21

    The incorporation of transition metal element Ag was performed to explore negative thermal expansion (NTE) materials with tetragonal tungsten bronze (TTB) structures. In this study, the structure and thermal expansion behaviors of a polar TTB oxide, Pb2AgNb5O15 (PAN), were systematically investigated by high-resolution synchrotron powder diffraction, high-resolution neutron powder diffraction, transmission electron microscope (TEM), and high-temperature X-ray diffractions. The TEM and Rietveld refinements revealed that the compound PAN displays (√2a(TTB), √2b(TTB), 2c(TTB))-type superstructure. This superstructure within the a-b plane is caused by the ordering of A-site cations, while the doubling of the c axis is mainly induced by a slight tilt distortion of the NbO6 octahedra. The transition metal Ag has larger spontaneous polarization displacements than Pb, but the Pb-O covalence seems to be weakened compared to the potassium counterpart Pb2KNb5O15 (PKN), which may account for the similar Curie temperature and uniaxial NTE behavior for PAN and PKN. Powder second harmonic generation (SHG) measurement indicates that PAN displays a moderate SHG response of ∼0.2 × LiNbO3 (or ∼100 × α-SiO2) under 1064 nm laser radiation. The magnitudes of the local dipole moments in NbO6 and PbOx polyhedra were quantified using bond-valence approach. We show that the SHG response stems from the superposition of dipole moments of both the PbO(x) and NbO6 polyhedra.

  6. Synthesis, Structures, and Thermal Expansion of the La 2W 2- xMo xO 9 Series

    Science.gov (United States)

    Collado, J. A.; Aranda, M. A. G.; Cabeza, A.; Olivera-Pastor, P.; Bruque, S.

    2002-08-01

    The La 2W 2- xMo xO 9 series has been synthesized by the ceramic method. An alternative synthesis using microwave radiation is also reported. La 2W 2O 9 has two polymorphs and the low-temperature phase ( α) transforms to the high-temperature form ( β) at 1077°C. The influence of the W/Mo substitution in this phase transition has been investigated by DTA. The β structure for x≥0.7 compositions can be prepared as single phase at any cooling rate. The β phase for 0.3≤ x≤0.7 compounds can be prepared as single phase by quenching, whereas a mixture of α and β phases is obtained by slow cooling. The W/Mo ratio in both coexisting phases is different with the β-phase having a higher Mo content. The x=0.1 and 0.2 compounds have been prepared as mixtures of phases. The room temperature structure of β-La 2W 1.7Mo 0.3O 9 has been analyzed by the Rietveld method in P2 13 space group. The final R-factors were RWP=9.0% and RF=5.6% with a structure similar to that of β-La 2Mo 2O 9. Finally, the thermal expansion of both types of structures has been determined from a thermodiffractometric study. The thermal expansion coefficients were 2.9×10 -6 and 9.7×10 -6°C -1 for α-La 2W 2O 9 and β-La 2W 1.2Mo 0.8O 9, respectively.

  7. Thermal expansion, thermal conductivity, and heat capacity measurements for boreholes UE25 NRG-4, UE25 NRG-5, USW NRG-6, and USW NRG-7/7A

    Energy Technology Data Exchange (ETDEWEB)

    Brodsky, N.S.; Riggins, M. [Sandia National Labs., Albuquerque, NM (United States); Connolly, J. [Univ. of New Mexico, Albuquerque, NM (United States). Dept. of Geology and Inst. of Meteoritics; Ricci, P. [Holometrix, Inc., Bedford, MA (United States)

    1997-09-01

    Specimens were tested from four thermal-mechanical units, namely Tiva Canyon (TCw), Paintbrush Tuff (PTn), and two Topopah Spring units (TSw1 and TSw2), and from two lithologies, i.e., welded devitrified (TCw, TSw1, TSw2) and nonwelded vitric tuff (PTn). Thermal conductivities in W(mk){sup {minus}1} averaged over all boreholes, ranged (depending upon temperature and saturation state) from 1.2 to 1.9 for TCw, from 0.4 to 0.9 for PTn, from 1.0 to 1.7 for TSw1, and from 1.5 to 2.3 for TSw2. Mean coefficients of thermal expansion were highly temperature dependent and values, averaged over all boreholes, ranged (depending upon temperature and saturation state) from 6.6 {times} 10{sup {minus}6} to 49 {times} 10{sup {minus}6} C{sup {minus}1} for TCw, from the negative range to 16 {times} 10{sup {minus}6} {center_dot} {degree}C{sup {minus}1} for PTn, from 6.3 {times} 10{sup {minus}6} to 44 {times} 10{sup {minus}6} C{sup {minus}1} for TSw1, and from 6.7 {times} 10{sup {minus}6} to 37 {times} 10{sup {minus}6} {center_dot} {degree}C{sup {minus}1} for TSw2. Mean values of thermal capacitance in J/cm{sup 3}K (averaged overall specimens) ranged from 1.6 J to 2.1 for TSw1 and from 1.8 to 2.5 for TSw2. In general, the lithostratigraphic classifications of rock assigned by the USGS are consistent with the mineralogical data presented in this report.

  8. Compressibility and thermal expansion of hydrous ringwoodite with 2.5(3) wt% H[subscript 2]O

    Energy Technology Data Exchange (ETDEWEB)

    Ye, Yu; Brown, David A.; Smyth, Joseph R.; Panero, Wendy R.; Jacobsen, Steven D.; Chang, Yun-Yuan; Townsend, Joshua P.; Thomas, Sylvia-Monique; Hauri, Erik H.; Dera, Przemyslaw; Frost, Daniel J. (Bayreuth); (Colorado); (CIW); (UC); (NWU); (OSU)

    2016-07-29

    Ringwoodite ({gamma}-Mg{sub 2}SiO{sub 4}) is the stable polymorph of olivine in the transition zone between 525-660 km depth, and can incorporate weight percent amounts of H{sub 2}O as hydroxyl, with charge compensated mainly by Mg vacancies (Mg{sup 2+} = 2H{sup +}), but also possibly as (Si{sup 4+} = 4H{sup +} and Mg{sup 2+} + 2H{sup +} = Si{sup 4+}). We synthesized pure Mg ringwoodite containing 2.5(3) wt% H{sub 2}O, measured by secondary ion mass spectrometry (SIMS), and determined its compressibility at 300 K by single-crystal and powder X-ray diffraction (XRD), as well as its thermal expansion behavior between 140 and 740 K at room pressure. A third-order Birch-Murnaghan equation of state (BM3 EOS) fits values of the isothermal bulk modulus K{sub T0} = 159(7) GPa and (dK{sub T}/dP){sub P = 0} = K' = 6.7(7) for single-crystal XRD; K{sub T0} = 161(4) GPa and K' = 5.4(6) for powder XRD, with K{sub T0} = 160(2) GPa and K' = 6.2(3) for the combined data sets. At room pressure, hydrous ringwoodite breaks down by an irreversible unit-cell expansion above 586 K, which may be related to dehydration and changes in the disorder mechanisms. Single-crystal intensity data were collected at various temperatures up to 736 K, and show that the cell volume V(cell) has a mean thermal expansion coefficient {alpha}{sub V0} of 40(4) x 10{sup -6}/K (143-736 K), and 29(2) x 10{sup -6}/K (143-586 K before irreversible expansion). V(Mg) have {alpha}{sub 0} values of 41(3) x 10{sup -6}/K (143-736 K), and V(Si) has {alpha}{sub 0} values of 20(3) x 10{sup -6}/K (143-586 K) and 132(4) x 10{sup -6}K (586-736 K). Based on the experimental data and previous work from {sup 29}Si NMR, we propose that during the irreversible expansion, a small amount of H{sup +} cations in Mg sites transfer to Si sites without changing the cubic spinel structure of ringwoodite, and the substituted Si{sup 4+} cations move to the normally vacant octahedral site at (1/2, 1/2, 0). Including new SIMS

  9. Anomalous transport

    Science.gov (United States)

    Cheverry, Christophe

    2017-02-01

    This article is concerned with the relativistic Vlasov equation, for collisionless axisymmetric plasmas immersed in a strong magnetic field, like in tokamaks. It provides a consistent kinetic treatment of the microscopic particle phase-space dynamics. It shows that the turbulent transport can be completely described through WKB expansions.

  10. X-ray study of the anomalous thermal hystereses of the modulation wavevectors in Cs2HgCl4

    Science.gov (United States)

    Bagautdinov, Bagautdin; Shaw, Zachery; Orlov, Andrii; Aliev, Marat A.

    2016-05-01

    A rich sequence of structural modulations in Cs2HgCl4 as a function of temperature was studied by means of X-ray diffraction. Accurate satellite-position measurements on the cooling and heating paths of the crystal revealed abnormal thermal hystereses for incommensurate phases and coexistences of neighboring commensurate phases. A well-defined X-ray picture of the a-axis modulated phases in the range of 221-184 K were observed on the heating path, while the c-axis modulated phases existing below 184 K were definitely detected on the cooling path. The proper conditions for a precise phase diagram of Cs2HgCl4 can be correlated with relatively defect-free transformations of a-axis modulations at heating and of c-axis modulations at cooling. The peculiarity of Cs2HgCl4 to switch modulation direction among the a- and c-axes at 184 K allows us deliberately accumulate and thus control a majority of mobile defects on the mutually perpendicular (100) or (001) planes by possessing crystal within temperature domain of a- or c-axes modulations, respectively.

  11. New Family of Materials with Negative Coefficients of Thermal Expansion: The Effect of MgO, CoO, MnO, NiO, or CuO on the Phase Stability and Thermal Expansion of Solid Solution Phases Derived from BaZn2Si2O7.

    Science.gov (United States)

    Thieme, Christian; Waurischk, Tina; Heitmann, Stephan; Rüssel, Christian

    2016-05-02

    Recently, a silicate with the composition SrxBa1-xZn2Si2O7 was reported, which exhibits a negative coefficient of thermal expansion. The compound BaZn2Si2O7 shows a highly positive coefficient of thermal expansion up to a temperature of 280 °C and then transfers to a high temperature phase, which exhibits a coefficient of thermal expansion near zero or negative over a limited temperature range up to around 500 °C. This high temperature modification can be stabilized to room temperature if Ba(2+) is replaced by Sr(2+). In the solid solution SrxBa1-xZn2Si2O7, also Zn(2+) can be replaced in a wide concentration range by other cations with the respective valency. In the present study, Zn was partially or completely replaced by Mg, Co, Mn, Ni, or Cu. If the high temperature phase is stable at room temperature, the thermal expansion is negative, and if the partial substitution exceeds a certain concentration threshold, the low temperature phase with the crystal structure of BaZn2Si2O7 and highly positive thermal expansion is formed. The lowest mean coefficients of thermal expansion were measured for the composition Ba0.5Sr0.5Zn1.4Co0.6Si2O7 with a value of -2.9 × 10(-6) K(-1). In general, a lower Zn-concentration leads to a higher anisotropy and a lower mean coefficient of thermal expansion.

  12. Predictions of thermal expansion coefficients of rare-earth zirconate pyrochlores: A quasi-harmonic approximation based on stable phonon modes

    Science.gov (United States)

    Lan, Guoqiang; Ouyang, Bin; Xu, Yushuai; Song, Jun; Jiang, Yong

    2016-06-01

    Rare-earth (RE) pyrochlores are considered as promising candidate materials for the thermal barrier coating. In this study, we performed first-principles calculations, augmented by quasi-harmonic phonon calculations, to investigate the thermal expansion behaviors of several RE2Zr2O7 (RE = La, Nd, Sm, Gd) pyrochlores. Our findings show that RE2Zr2O7 pyrochlores exhibit low-lying optical phonon frequencies that correspond to RE-cation rattling vibrational modes. These frequencies become imaginary upon volume expansion, preventing correct determination of the free energy versus volume relation and thereby quantification of thermal expansion using QH phonon calculations. To address this challenge, we proposed a QH approximation approach based on stable phonon modes where the RE-cation rattling modes were systematically eliminated. This approach is shown to provide accurate predictions of the coefficients of thermal expansion (CTEs) of RE2Zr2O7 pyrochlores, in good agreement with experimental measurements and data from first-principles molecular dynamics simulations. In addition, we showed that the QH Debye model considerably overestimates the magnitudes and wrongly predicts the trend for the CTEs of RE2Zr2O7 pyrochlores.

  13. Determination of isobaric thermal expansivity of organic compounds from 0.1 to 30 MPa at 30 degrees C with an isothermal pressure scanning microcalorimeter

    DEFF Research Database (Denmark)

    Verdier, Sylvain Charles Roland; Andersen, Simon Ivar

    2003-01-01

    This paper describes a simple high-pressure mercury-free microcalorimetric technique that enables the compression of a fluid from 0.1 to 30 MPa. Thermal expansivities of several compounds were calculated (n-hexane, cyclohexane, heptane, and toluene) with the pressure. scanning transitiometry meth...

  14. Near-zero thermal expansion of In2(1-x)(HfMg) x Mo3O12 with tailored phase transition

    Science.gov (United States)

    Cheng, Yong-Guang; Mao, Yan-Chao; Liu, Xain-Sheng; Yuan, Bao-He; Chao, Ming-Ju; Liang, Er-Jun

    2016-08-01

    Solid solutions of In2(1-x)(HfMg) x Mo3O12 are synthesized by solid state reaction with the aim to reduce the phase transition temperature of In2Mo3O12 and improve its thermal expansion property. The effects of (HfMg)6+ incorporation on the phase transition and thermal expansion are investigated. It is shown that the monoclinic-to-orthorhombic phase transition temperature obviously decreases and the coefficient of thermal expansion (CTE) of the orthorhombic becomes less negative and approaches to zero with increasing the content of (HfMg)6+. A near zero thermal expansion covering the case at room temperature (RT) is achieved for the solid solutions with x ≥ 0.85, implying potential applications of this material in many fields. Project supported by the National Natural Science Foundation of China (Grant Nos. 11574276, 51302249, and 51503185) and the Doctoral Fund of the Ministry of Education of China (Grant No. 20114101110003).

  15. Sodium Borohydride Reduction of Aqueous Silver-Iron-Nickel Solutions: a Chemical Route to Synthesis of Low Thermal Expansion-High Conductivity Ag-Invar Alloys

    Science.gov (United States)

    Sterling, E. A.; Stolk, J.; Hafford, L.; Gross, M.

    2009-07-01

    Thermal management is a critical concern in the design and performance of electronics systems. If heat extraction and thermal expansion are not properly addressed, the thermal mismatch among dissimilar materials may give rise to high thermal stresses or interfacial shear strains, and ultimately to premature system failure. In this article, we present a chemical synthesis process that yields Ag-Invar (64Fe-36Ni) alloys with a range of attractive properties for thermal management applications. Sodium borohydride reduction of an aqueous Ag-Fe-Ni metal salt solution produces nanocrystalline powders, and conventional powder processing converts this powder to fine-grained alloys. The samples are characterized by X-ray diffraction (XRD), scanning electron microscopy, thermomechanical analysis, and electrical conductivity measurements; thermal conductivity is estimated using the Wiedemann-Franz law. Sintering of Ag-Fe-Ni powders leads to the formation of two-phase silver-Invar alloys with low coefficients of thermal expansion (CTEs) and relatively high electrical conductivities. A sample of 50Ag-50Invar exhibits a CTE of 8.76 μm/(m· °C) and an estimated thermal conductivity of 236 W/(m·K). The Ag-Invar alloys offer thermodynamic stability and tailorable properties, and they may help address the need for improved packaging materials.

  16. What was old is new again: thermal adaptation within clonal lineages during range expansion in a fungal pathogen.

    Science.gov (United States)

    Robin, Cécile; Andanson, Audrey; Saint-Jean, Gilles; Fabreguettes, Olivier; Dutech, Cyril

    2017-01-31

    Range-expanding species are expected to gain an increasing importance in the context of global change. They provide a great opportunity to study contemporary evolutionary changes and to unravel the mechanisms of evolution. Cryphonectria parasitica, the causal agent of chestnut blight, originating from Asia, has been spread since the beginning of the 20th century into different continents. We took advantage of the C. parasitica recent emergence in northern France to study the changes in population genetic structure and in phenotypic traits along this colonization and climatic gradient. Four hundred twenty-seven C. parasitica isolates were sampled in 47 chestnut sites in northern France. The C. parasitica outbreak in the north was found to be due to the expansion of five dominant clonal groups from southern France and to the emergence of a few rare recombined genotypes. The evolutionary changes during C. parasitica range expansion were studied by analyzing phenotypic changes in isolates from the same clonal lineage, with or without a geographic shift. Growth rates were assessed in vitro, at four temperatures. The northern isolates grew faster at 12 and 15°C and more slowly at 28 and 32°C than the southern isolates. These results strongly suggest local adaptation to low temperatures in C. parasitica, with a trade-off of slower growth at high temperatures. They also reflect the high evolutionary potential of C. parasitica along a colonization gradient and show that clonal evolution is not a limitation for the rapid thermal adaptation of this invasive fungal species. This article is protected by copyright. All rights reserved.

  17. Effects of exchangeable cation composition on the thermal expansion/contraction of clinoptilolite

    Energy Technology Data Exchange (ETDEWEB)

    Bish, D.L.

    1984-12-31

    To understand and predict the effects of a thermal pulse induced by a radioactive waste repository on clinoptilolite-bearing rocks, the lattice parameters of 6 natural and 3 cation-exchanged (Ca, K, Na) clinoptilolites were studied as a function of temperature. The samples were examined at room temperature, under vacuum, and at 50{sup 0}C increments to 300{sup 0}C using a high-temperature x-ray powder diffractometer. The unit cell of all samples decreased in volume between 20 and 300{sup 0}C; Na-saturated clinoptilolite underwent the greatest volume decrease (8.4%) and K-saturated clinoptilolite the smallest (1.6%), of the clinoptilolites studied. The volume decrease for the Ca-saturated clinoptilolite was 3.6%. The highest percentage decrease for each sample was along the b axis, generally 80 to 90% of the total volume decrease. The change in the a axis was the smallest and was usually <5%, although 26.5% of the contraction of the Na-exchanged clinoptilolite was along a. The bulk of the volume contraction of many samples occurred on evacuation at room temperature, demonstrating that the observed changes were due to water loss and not to temperature-induced structural changes. Low-angle scattering was significantly reduced upon evacuation for every sample, and the 110 reflection of clinoptilolite at 7.35{sup 0}2 {theta} became obvious, whereas it was not in the untreated samples. These data show that the effects of heating on the unit-cell volume of clinoptilolite depend strongly on the exchangeable cation content. Significant reductions in the unit-cell volumes of natural, mixed Na-K-Ca clinoptilolites could take place in rocks in a repository environment, particularly if the clinoptilolites occurred in unsaturated, dehydrated rock. The unit-cell volumes of clinoptilolites in partially saturated rocks at temperatures below 100{sup 0}C, however, should not decrease significantly.

  18. Uranium hexafluoride liquid thermal expansion, elusive eutectic with hydrogen fluoride, and very first production using chlorine trifluoride

    Energy Technology Data Exchange (ETDEWEB)

    Rutledge, G.P. [Central Environmental, Inc., Anchorage, AK (United States)

    1991-12-31

    Three unusual incidents and case histories involving uranium hexafluoride in the enrichment facilities of the USA in the late 1940`s and early 1950`s are presented. The history of the measurements of the thermal expansion of liquids containing fluorine atoms within the molecule is reviewed with special emphasis upon uranium hexafluoride. A comparison is made between fluorinated esters, fluorocarbons, and uranium hexafluoride. The quantitative relationship between the thermal expansion coefficient, a, of liquids and the critical temperature, T{sub c} is presented. Uranium hexafluoride has an a that is very high in a temperature range that is used by laboratory and production workers - much higher than any other liquid measured. This physical property of UF{sub 6} has resulted in accidents involving filling the UF{sub 6} containers too full and then heating with a resulting rupture of the container. Such an incident at a uranium gaseous diffusion plant is presented. Production workers seldom {open_quotes}see{close_quotes} uranium hexafluoride. The movement of UF{sub 6} from one container to another is usually trailed by weight, not sight. Even laboratory scientists seldom {open_quotes}see{close_quotes} solid or liquid UF{sub 6} and this can be a problem at times. This inability to {open_quotes}see{close_quotes} the UF{sub 6}-HF mixtures in the 61.2{degrees}C to 101{degrees}C temperature range caused a delay in the understanding of the phase diagram of UF{sub 6}-HF which has a liquid - liquid immiscible region that made the eutectic composition somewhat elusive. Transparent fluorothene tubes solved the problem both for the UF{sub 6}-HF phase diagram as well as the UF{sub 6}-HF-CIF{sub 3} phase diagram with a miscibility gap starting at 53{degrees}C. The historical background leading to the first use of CIF{sub 3} to produce UF{sub 6} in both the laboratory and plant at K-25 is presented.

  19. Anisotropic lattice thermal expansion of PbFeBO{sub 4}: A study by X-ray and neutron diffraction, Raman spectroscopy and DFT calculations

    Energy Technology Data Exchange (ETDEWEB)

    Murshed, M. Mangir, E-mail: murshed@uni-bremen.de [Chemische Kristallographie fester Stoffe, Institut für Anorganische Chemie, Universität Bremen, Leobener Straße, D-28359 Bremen (Germany); Mendive, Cecilia B.; Curti, Mariano [Departamento de Química, Facultad de Ciencias Exactas y Naturales, Universidad Nacional de Mar del Plata, Dean Funes 3350, B7600AYL, Mar del Plata (Argentina); Nénert, Gwilherm [Institut Laue-Langevin, 6 rue Jules Horowitz, 38042 Grenoble (France); Kalita, Patricia E. [Department of Physics and Astronomy and High-Pressure Science and Engineering Center, University of Nevada Las Vegas, Box 4002, Las Vegas, NV 89154-4002 (United States); Lipinska, Kris [Department of Mechanical Engineering, University of Nevada Las Vegas, 4505 Maryland Parkway, Box 454009, Las Vegas, NV 89154-4009 (United States); Cornelius, Andrew L. [Department of Physics and Astronomy and High-Pressure Science and Engineering Center, University of Nevada Las Vegas, Box 4002, Las Vegas, NV 89154-4002 (United States); Huq, Ashfia [Chemical and Engineering Materials Division, Oak Ridge National Laboratory, Oak Ridge, TN 37831-6475 (United States); Gesing, Thorsten M. [Chemische Kristallographie fester Stoffe, Institut für Anorganische Chemie, Universität Bremen, Leobener Straße, D-28359 Bremen (Germany)

    2014-11-15

    Highlights: • Mullite-type PbFeBO{sub 4} shows uni-axial negative coefficient of thermal expansion. • Anisotropic thermal expansion of the metric parameters was modeled using modified Grüneisen approximation. • The model includes harmonic, quasi-harmonic and intrinsic anharmonic contributions to the internal energy. • DFT calculation, temperature- and pressure-dependent Raman spectra help understand the phonon decay and associated anharmonicity. - Abstract: The lattice thermal expansion of mullite-type PbFeBO{sub 4} is presented in this study. The thermal expansion coefficients of the metric parameters were obtained from composite data collected from temperature-dependent neutron and X-ray powder diffraction between 10 K and 700 K. The volume thermal expansion was modeled using extended Grüneisen first-order approximation to the zero-pressure equation of state. The additive frame of the model includes harmonic, quasi-harmonic and intrinsic anharmonic potentials to describe the change of the internal energy as a function of temperature. The unit-cell volume at zero-pressure and 0 K was optimized during the DFT simulations. Harmonic frequencies of the optical Raman modes at the Γ-point of the Brillouin zone at 0 K were also calculated by DFT, which help to assign and crosscheck the experimental frequencies. The low-temperature Raman spectra showed significant anomaly in the antiferromagnetic regions, leading to softening or hardening of some phonons. Selected modes were analyzed using a modified Klemens model. The shift of the frequencies and the broadening of the line-widths helped to understand the anharmonic vibrational behaviors of the PbO{sub 4}, FeO{sub 6} and BO{sub 3} polyhedra as a function of temperature.

  20. Magnetocaloric effect and negative thermal expansion in hexagonal Fe doped MnNiGe compounds with a magnetoelastic AFM-FM-like transition.

    Science.gov (United States)

    Xu, Kun; Li, Zhe; Liu, Enke; Zhou, Haichun; Zhang, Yuanlei; Jing, Chao

    2017-01-30

    We report a detailed study of two successive first-order transitions, including a martensitic transition (MT) and an antiferromagnetic (AFM)-ferromagnetic (FM)-like transition, in Mn1-xFexNiGe (x = 0, 0.06, 0.11) alloys by X-ray diffraction, differential scanning calorimetry, magnetization and linear thermal expansion measurements. Such an AFM-FM-like transition occurring in the martensitic state has seldom been observed in the M(T) curves. The results of Arrott plot and linear relationship of the critical temperature with M(2) provide explicit evidence of its first-order magnetoelastic nature. On the other hand, their performances as magnetocaloric and negative thermal expansion materials were characterized. The isothermal entropy change for a field change of 30 kOe reaches an impressive value of -25.8 J/kg K at 203 K for x = 0.11 compared to the other two samples. It demonstrates that the magneto-responsive ability has been significantly promoted since an appropriate amount of Fe doping can break the local Ni-6Mn AFM configuration. Moreover, the Fe-doped samples reveal both the giant negative thermal expansion and near-zero thermal expansion for different temperature ranges. For instance, the average thermal expansion coefficient ā of x = 0.06 reaches -60.7 × 10(-6)/K over T = 231-338 K and 0.6 × 10(-6)/K over T = 175-231 K during cooling.