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Sample records for lithium fluoride crystals

  1. Luminescence from edge fracture in shocked lithium fluoride crystals

    DOE PAGES

    Turley, W. D.; Stevens, G. D.; Capelle, G. A.; ...

    2013-04-03

    Light emitted from a [100] lithium fluoride crystal was characterized under shock wave compression to 28 GPa followed by complete stress release at the edges. We examined the light using time-gated optical spectrometry and imaging, time-resolved optical emission measurements, and hydrodynamic modeling. The shock arrival at the circumference of the crystal was delayed relative to the center so that the two regions could be studied at different times. The majority of the light emission originated when the shock waves released at the circumference of the crystal. Unlike previously reported results for shocked lithium fluoride, we found that the light spectrummore » is not strictly broad band, but has spectral lines associated with atomic lithium in addition to a broad band background. Also, the emission spectrum depends strongly on the gas surrounding the sample. Based on our observations, the line emission appears to be related to fracture of the lithium fluoride crystal from the shock wave releasing at the edges. Moreover, experimenters frequently utilize lithium fluoride crystals as transparent windows for observing shock compressed samples. Because of the experimental geometries used, the shock wave in such cases often reaches the circumference of the window at nearly the same moment as when it reaches the center of the sample-window interface. Light generated at the circumference could contaminate the measurement at the interface when this light scatters into the observed region. Finally, this background light may be reduced or avoided using experimental geometries which delay the arrival of the shock wave at the edges of the crystal.« less

  2. Luminescence from Edge Fracture in Shocked Lithium Fluoride Crystals

    SciTech Connect

    Turley, W. D.; Stevens, G. D.; Capelle, G. A.; Grover, M.; Holtkamp, D. B.; LaLone, B. M.; Veeser, L. R.

    2013-01-01

    Light emitted from a [100] lithium fluoride crystal was characterized under shock wave compression to 28GPa followed by complete stress release at the edges. The light was examined using time-gated optical spectrometry and imaging, time-resolved optical emission measurements, and hydrodynamic modeling. The shock arrival at the circumference of the crystal was delayed relative to the center so that the two regions could be studied at different times. The majority of the light emission originated when the shock waves released at the circumference of the crystal. Unlike previously reported results for shocked lithium fluoride, we found that the light spectrum is not strictly broad band, but has spectral lines associated with atomic lithium in addition to a broad band background. Also, the emission spectrum depends strongly on the gas surrounding the sample. Based on our observations, the line emission appears to be related to fracture of the lithium fluoride crystal from the shock wave releasing at the edges. Experimenters frequently utilize lithium fluoride crystals as transparent windows for observing shock compressed samples. Because of the experimental geometries used, the shock wave in such cases often reaches the circumference of the window at nearly the same moment as when it reaches the center of the sample-window interface. Light generated at the circumference could contaminate the measurement at the interface when this light scatters into the observed region. This background light may be reduced or avoided using experimental geometries which delay the arrival of the shock wave at the edges of the crystal.

  3. Reduction of precursor decay anomaly in single crystal lithium fluoride

    NASA Astrophysics Data System (ADS)

    Sano, Yukio

    2000-08-01

    The purpose of this study is to reveal that the precursor decay anomaly in single crystal lithium fluoride is reduced by Sano's decay curve [Y. Sano, J. Appl. Phys. 85, 7616 (1999)], which is much smaller in slope than Asay's decay curve [J. R. Asay, G. R. Fowles, G. E. Duvall, M. H. Miles, and R. F. Tinder, J. Appl. Phys. 43, 2132 (1972)]. To this end, strain, particle, velocity, and stress in a precursor and near the leading edge of the follower changing with time along Sano's decay curve are first analyzed quantitatively. The analysis verified the existence of degenerate contraction waves I and II and a subrarefaction wave R', and the decay process [Y. Sano, J. Appl. Phys. 77, 3746 (1995)] caused in sequence by evolving followers C, I, II, R', Rb. Next, inequalities relating decay rates qualitatively to plastic strain rates at the leading edge of the follower, which are derived using the properties of the followers, are incorporated into the analysis. Calculation results showed that the plastic strain rates were reduced by low decay rates. This indicates that the precursor decay anomaly might be greatly reduced by Sano's decay curve.

  4. Void control in the crystallization of lithium fluoride

    NASA Technical Reports Server (NTRS)

    Jaworske, Donald A.; Perry, William D.

    1991-01-01

    The effect of tungsten-coated graphite fibers on the radiant heat transfer characteristics of salt-fiber composites was studied by measuring the onset of melting as a function of applied furnace power. As the fiber concentration was increased from 0 to 5.40 percent fiber by weight, the furnace temperature required to melt the lithium fluoride also increased. Upon cooling, each of the crystalline salt-fiber composites were cut open with a diamond saw to expose the void. Optical photographs of the voids revealed a trend in void location and size, with the largest void, and the least change in the outer dimension of the boule upon cooling, occurring in the sample with the most fiber.

  5. Fluorescent detection of single tracks of alpha particles using lithium fluoride crystals

    NASA Astrophysics Data System (ADS)

    Bilski, P.; Marczewska, B.

    2017-02-01

    Lithium fluoride single crystals were successfully used for fluorescent imaging of single tracks of alpha particles. This was realized with a standard wide-field fluorescent microscope equipped with a 100× objective. Alpha particles create F2 and F3+ color centers in LiF crystals. The subsequent illumination with the blue light (wavelength around 445 nm), excites these centers and produces fluorescence with a broad band peaked at 670 nm. The observed tracks of alpha particles have diameter of about 500 nm. Focusing of the microscope at different depths in a LiF crystal, enables imaging changes of shape and position of tracks, allowing for visualization of their paths. These encouraging results are the first step towards practical application of LiF as fluorescent nuclear track detectors.

  6. Factors Affecting the Plasticity of Sodium Chloride, Lithium Fluoride, and Magnesium Oxide Single Crystals. 1

    NASA Technical Reports Server (NTRS)

    Stearns, Carl A.; Pack, Ann E.; Lad, Robert A.

    1959-01-01

    A study was made of the relative magnitude of the effects of various factors on the ductility of single crystals of sodium chloride (NaCl), lithium fluoride (LiF), and magnesium oxide (MgO). Specimen treatments included water-polishing, varying cleavage rate, annealing, quenching, X-irradiation, surface coating, aging, and combinations of some of these treatments. The mechanical behavior of the crystals was studied in flexure and in compression, the latter study being performed at both constant strain rate and constant load. Etch-pit studies were carried out to provide some pertinent information on the results of pretreatment on the dislocation concentration and distribution in the vicinity of the surface. The load deformation curves for these ionic single crystals show an initial region of very low slope which proved to be due to anelastic deformation. The extent of initial anelastic deformation is modified by specimen pretreatment in a way that suggests that this deformation is the result of expansion of cleaved-in dislocation loops, which can contract on the removal of the stress. The effects of the various pretreatments on the load and deflection at fracture are in accord with the prediction one might make with regard to their effect on the nucleation of fatal surface cracks. For NaCl, increases in ductility are always accompanied by increases in strength. The creep constants for NaCl are a function of treatments which affect the bulk structure but are not a function of treatments which only affect the surface.

  7. A study of the structure and scattering mechanisms of subterahertz phonons in lithium fluoride single crystals and optical ceramics

    SciTech Connect

    Khazanov, E. N. Taranov, A. V.; Gainutdinov, R. V.; Akchurin, M. Sh.; Basiev, T. T.; Konyushkin, V. A.; Fedorov, P. P.; Kuznetsov, S. V.; Osiko, V. V.

    2010-06-15

    The methods of optical, electron, and atomic force microscopy (AFM) are applied to the study of the real structure of optical lithium fluoride ceramic obtained by hot deformation of single crystals. A comparative analysis is carried out of the scattering mechanisms of weakly nonequilibrium thermal phonons at liquid helium temperatures in LiF single crystals and ceramics. It is demonstrated that the phonon scattering in the original single crystals is determined by the forced vibrations of dislocations in the stress field of an elastic plane wave (a phonon), i.e., by the flutter mechanism. As the degree of deformation of the original material increases, the ceramics exhibit a change in the plastic deformation mechanisms, which leads to a decrease in the average size of grains and to an ordered structure. In this case, the dominant scattering is that by intergrain boundaries. The thickness and the acoustic impedance of these boundaries are evaluated.

  8. Spatial structures based on color centers created by electrons in lithium fluoride crystals: Absorption and luminescence characteristics

    NASA Astrophysics Data System (ADS)

    Voitovich, A. P.; Kalinov, V. S.; Loiko, Yu. V.; Naumenko, N. N.; Runets, L. P.; Stupak, A. P.

    2008-01-01

    We have shown that in spatial structures based on color centers created by electrons in a lithium fluoride crystal, the distances between centers reach 1.6 nm and 3.6 nm for F1 and F2 centers respectively. This suggests considerable potential opportunities for using electron technology to form structures in the crystals with spatial resolution of such an order of magnitude. We measured the decrease in fluorine content on the irradiated surface of the crystal. We found the concentrations of F1, F2, F{3/+}, F3(R2), and F4(N1) centers. We established that the specific characteristics of color center formation by electrons leads to an increase in the efficiency of creation of F3 and F4 centers. We determined the decrease in the average luminescence lifetimes of F2 and F{3/+} centers as a result of concentration quenching. We observed distortion of the luminescence contour for F2 centers as a result of absorption of its short-wavelength portion by other centers and emission of radiation by the latter in its long-wavelength portion.

  9. Optical characterization of femtosecond laser induced active channel waveguides in lithium fluoride crystals

    NASA Astrophysics Data System (ADS)

    Chiamenti, I.; Bonfigli, F.; Gomes, A. S. L.; Michelotti, F.; Montereali, R. M.; Kalinowski, H. J.

    2014-01-01

    We successfully realized broad-band light-emitting color center waveguides buried in LiF crystals by using femtosecond laser pulses. The characterization of the waveguides was performed by optical microscopy, photoluminescence spectra, loss measurements and near-field profiling. The experimental results show that the direct-writing fabrication process induces low-index contrast active channel waveguides: their wavelength-dependent refractive index changes, estimated from 10-3 to 10-4 depending on the writing conditions, allow supporting few modes at visible and near-infrared wavelengths.

  10. Optical characterization of femtosecond laser induced active channel waveguides in lithium fluoride crystals

    SciTech Connect

    Chiamenti, I.; Kalinowski, H. J.; Bonfigli, F.; Montereali, R. M.; Gomes, A. S. L.; Michelotti, F.

    2014-01-14

    We successfully realized broad-band light-emitting color center waveguides buried in LiF crystals by using femtosecond laser pulses. The characterization of the waveguides was performed by optical microscopy, photoluminescence spectra, loss measurements and near-field profiling. The experimental results show that the direct-writing fabrication process induces low-index contrast active channel waveguides: their wavelength-dependent refractive index changes, estimated from 10{sup −3} to 10{sup −4} depending on the writing conditions, allow supporting few modes at visible and near-infrared wavelengths.

  11. Optical spectroscopy and imaging of colour centres in lithium fluoride crystals and thin films irradiated by 3 MeV proton beams

    NASA Astrophysics Data System (ADS)

    Piccinini, M.; Ambrosini, F.; Ampollini, A.; Carpanese, M.; Picardi, L.; Ronsivalle, C.; Bonfigli, F.; Libera, S.; Vincenti, M. A.; Montereali, R. M.

    2014-05-01

    Lithium fluoride is a well-known dosimeter material and it is currently under investigation also for high-resolution radiation imaging detectors based on colour centre photoluminescence. In order to extend their applications, proton beams of 3 MeV energy, produced by a linear accelerator, were used to irradiate LiF crystals and thin films in the fluence range of 1010-1015 protons/cm2. The irradiation induces the formation of colour centres, mainly the primary F centre and the aggregate F2 and F3+ defects, which are stable at room temperature. By optical pumping in the blue spectral region, the F2 and F3+ centres emit broad photoluminescence bands in the visible spectral range. By conventional fluorescence microscopy, the integrated photoluminescence intensity was carefully measured in LiF crystals and thin films as a function of the irradiation fluence: a linear optical response was obtained in a large range of fluence, which is dependent on the used LiF samples. Colour centres concentrations were estimated in LiF crystals by optical absorption spectroscopy. It was possible to record the transversal proton beam intensity profile by acquiring the photoluminescence image of the irradiated spots on LiF films.

  12. Fabrication of nanoscale patterns in lithium fluoride crystal using a 13.5 nm Schwarzschild objective and a laser produced plasma source

    SciTech Connect

    Wang Xin; Mu Baozhong; Jiang Li; Zhu Jingtao; Yi Shengzhen; Wang Zhanshan; He Pengfei

    2011-12-15

    Lithium fluoride (LiF) crystal is a radiation sensitive material widely used as EUV and soft x-ray detector. The LiF-based detector has high resolution, in principle limited by the point defect size, large field of view, and wide dynamic range. Using LiF crystal as an imaging detector, a resolution of 900 nm was achieved by a projection imaging of test meshes with a Schwarzschild objective operating at 13.5 nm. In addition, by imaging of a pinhole illuminated by the plasma, an EUV spot of 1.5 {mu}m diameter in the image plane of the objective was generated, which accomplished direct writing of color centers with resolution of 800 nm. In order to avoid sample damage and contamination due to the influence of huge debris flux produced by the plasma source, a spherical normal-incidence condenser was used to collect EUV radiation. Together with a description of experimental results, the development of the Schwarzschild objective, the influence of condenser on energy density and the alignment of the imaging system are also reported.

  13. Fabrication of nanoscale patterns in lithium fluoride crystal using a 13.5 nm Schwarzschild objective and a laser produced plasma source.

    PubMed

    Wang, Xin; Mu, Baozhong; Jiang, Li; Zhu, Jingtao; Yi, Shengzhen; Wang, Zhanshan; He, Pengfei

    2011-12-01

    Lithium fluoride (LiF) crystal is a radiation sensitive material widely used as EUV and soft x-ray detector. The LiF-based detector has high resolution, in principle limited by the point defect size, large field of view, and wide dynamic range. Using LiF crystal as an imaging detector, a resolution of 900 nm was achieved by a projection imaging of test meshes with a Schwarzschild objective operating at 13.5 nm. In addition, by imaging of a pinhole illuminated by the plasma, an EUV spot of 1.5 μm diameter in the image plane of the objective was generated, which accomplished direct writing of color centers with resolution of 800 nm. In order to avoid sample damage and contamination due to the influence of huge debris flux produced by the plasma source, a spherical normal-incidence condenser was used to collect EUV radiation. Together with a description of experimental results, the development of the Schwarzschild objective, the influence of condenser on energy density and the alignment of the imaging system are also reported.

  14. Fluoride glass: Crystallization, surface tension

    NASA Technical Reports Server (NTRS)

    Doremus, R. H.

    1988-01-01

    Fluoride glass was levitated acoustically in the ACES apparatus on STS-11, and the recovered sample had a different microstructure from samples cooled in a container. Further experiments on levitated samples of fluoride glass are proposed. These include nucleation, crystallization, melting observations, measurement of surface tension of molten glass, and observation of bubbles in the glass. Ground experiments are required on sample preparation, outgassing, and surface reactions. The results should help in the development and evaluation of containerless processing, especially of glass, in the development of a contaminent-free method of measuring surface tensions of melts, in extending knowledge of gas and bubble behavior in fluoride glasses, and in increasing insight into the processing and properties of fluoride glasses.

  15. Fluoride laser crystals: old and new

    NASA Astrophysics Data System (ADS)

    Jenssen, Hans P.; Cassanho, Arlete

    2006-02-01

    The development of oxide and fluoride materials as gain materials of choice for solid state lasers ranges from early materials such as Calcium Fluoride and Calcium Tungstate crystals to the now ubiquitous Nd hosts YLF, YAG and Vanadate. Among Tunable laser materials, MgF II - an early favorite, gave way to superior oxides such as Alexandrite and Ti:Sapphire only to be followed by development of still newer tunable fluoride media, notably, fluoride colquiriites such as Cr-doped LiSAF and LiCaF. Newer fluoride crystals, such as Barium Yttrium Fluoride BaY II F 8 (BYF), KY 3F 10 (KYF) and the tunable Cr doped LiCaGaF 6 are attractive laser materials, but their growth has not been optimized. Key advantages of two of these new crystals are discussed. Crystal growth results for BYF and Cr:LiCaGaF 6 as well as some material characterization are presented.

  16. Toxic fluoride gas emissions from lithium-ion battery fires.

    PubMed

    Larsson, Fredrik; Andersson, Petra; Blomqvist, Per; Mellander, Bengt-Erik

    2017-08-30

    Lithium-ion battery fires generate intense heat and considerable amounts of gas and smoke. Although the emission of toxic gases can be a larger threat than the heat, the knowledge of such emissions is limited. This paper presents quantitative measurements of heat release and fluoride gas emissions during battery fires for seven different types of commercial lithium-ion batteries. The results have been validated using two independent measurement techniques and show that large amounts of hydrogen fluoride (HF) may be generated, ranging between 20 and 200 mg/Wh of nominal battery energy capacity. In addition, 15-22 mg/Wh of another potentially toxic gas, phosphoryl fluoride (POF3), was measured in some of the fire tests. Gas emissions when using water mist as extinguishing agent were also investigated. Fluoride gas emission can pose a serious toxic threat and the results are crucial findings for risk assessment and management, especially for large Li-ion battery packs.

  17. Surface crystallization of a fluoride glass

    NASA Technical Reports Server (NTRS)

    Bansal, Narottam P.; Doremus, Robert H.

    1983-01-01

    Growth of crystals on the surface of a Zr-Ba-La fluoride glass was observed by optical and scanning electron microscopy. Small, dark crystal nucleated rapidly and grew to a size of about 10 microns; then they stopped growing, and wrinkled regions emerged, covering the entire crystal surface.

  18. Neutron Fading Characteristics of Copper Doped Lithium Fluoride (LiF: MCP) Thermoluminescent Dosimeters (TLDs)

    DTIC Science & Technology

    2008-05-21

    Fading Characteristics of Copper-Doped Lithium Fluoride (LiF: MCP) Thermoluminescent Dosimeters (TLDs)" Name of Candidate: L T Jeffrey A. Delzer Master...Lithium Fluoride Thermoluminescent Dosimeters beyond brief excerpts is with the permission of the copyright owner, and will save and hold harmless...Thesis: Author: Thesis directed by: ABSTRACT "Neutron Fading Characteristics of Copper-Doped Lithium Fluoride (LiF: MCP) Thermoluminescent

  19. Optical Properties of Lithium Terbium Fluoride and Implications for Performance in High Power Lasers (Postprint)

    DTIC Science & Technology

    2016-02-01

    AFRL-RX-WP-JA-2016-0323 OPTICAL PROPERTIES OF LITHIUM TERBIUM FLUORIDE AND IMPLICATIONS FOR PERFORMANCE IN HIGH POWER LASERS...OPTICAL PROPERTIES OF LITHIUM TERBIUM FLUORIDE AND IMPLICATIONS FOR PERFORMANCE IN HIGH POWER LASERS (POSTPRINT) 5a. CONTRACT NUMBER IN-HOUSE 5b...Form 298 (Rev. 8-98) Prescribed by ANSI Std. Z39-18 Optical properties of lithium terbium fluoride and implications for performance in

  20. Crystallization of lithium borate glasses

    NASA Technical Reports Server (NTRS)

    Goktas, A. A.; Neilson, G. F.; Weinberg, M. C.

    1992-01-01

    The glass-forming ability and crystallization behavior of lithium borate compositions, in the diborate-to-metaborate-range, were studied. In particular, the nature and sequence of formation of crystalline phases and the tendency toward devitrification were investigated as functions of temperature, thermal history and batch composition. It was found that the sequence of crystalline phase formation was sensitive to all of the three latter factors, and it was observed that under certain conditions metastable defect structures of the metaborate can appear.

  1. Formation of lithium fluoride/metal nanocomposites for energy storage through solid state reduction of metal fluorides

    SciTech Connect

    Amatucci, GG; Pereira, N; Badway, F; Sina, M; Cosandey, F; Ruotolo, M; Cao, C

    2011-12-01

    In order to utilize high energy metal fluoride electrode materials as direct replacement electrode materials for lithium ion batteries in the future, a methodology to prelithiate the cathode or anode must be developed. Herein, we introduce the use of a solid state Li(3)N route to achieve the lithiation and mechanoreduction of metal fluoride based nanocomposites. The resulting prelithiation was found to be effective with the formation of xLiF:Me structures of very fine nanodimensions analogous to what is found by electrochemical lithiation. Physical and electrochemical properties of these nanocomposites for the bismuth and iron lithium fluoride systems are reported. (C) 2011 Elsevier B.V. All rights reserved.

  2. Spatial diagnostics of the laser induced lithium fluoride plasma

    SciTech Connect

    Baig, M. A.; Qamar, Aisha; Fareed, M. A.; Anwar-ul-Haq, M.; Ali, Raheel

    2012-06-15

    We present spatial characteristics of the lithium fluoride plasma generated by the fundamental and second harmonic of a Nd:YAG laser. The plume emission has been recorded spatially using five spectrometers covering the spectral region from 200 nm to 720 nm. The electron density is measured from the Stark broadened line profile of the line at 610.37 nm, whereas the plasma temperature has been determined using the Boltzmann plot method including all the observed spectral lines of lithium. Both the plasma parameters; electron density and plasma temperature decrease with the increase of the distance from the target surface. The thermal conduction towards the target, the radiative cooling of the plasma, and the conversion of thermal energy into kinetic energy are the main mechanisms responsible for the spatially decrease of the plasma parameters.

  3. Optical Restoration of Lead Fluoride Crystals

    NASA Astrophysics Data System (ADS)

    Spilker, A.; Cole, P. L.; Bertin, P.; Forest, T. A.; Mestari, M.; Naeem, S.; Roche, J.; Camacho, C. Muñoz; LeBaron, N.

    2009-03-01

    Due to its relatively high resistance to high radiation, lead fluoride (PbF2) crystals are becoming an increasingly popular material of choice for electromagnetic calorimetry, such as for experiments requiring the measurement of high-energy photons in Hall A of Jefferson Lab. For our studies we irradiated the PbF2 crystals using an electron linear accelerator (LINAC) followed by exposing the crystals to blue light so as to restore the nominal optical properties. This technique of optical bleaching with blue light affords an efficient and low-cost means for reversing the deleterious effects of optical transmission loss in radiation-damaged lead fluoride crystals. Whereas earlier experiments irradiated the PbF2 samples with 1.1 and 1.3 MeV gammas from 60Co, we used pulsed beams of energetic electrons from the tunable 25-MeV LINAC at Idaho Accelerator Center of Idaho State University in Pocatello, Idaho. A 20-MeV beam of electrons was targeted onto four separate 19 cm length samples of lead fluoride over periods of 1, 2, and 4 hours yielding doses between 7 kGy and 35 kGy. Samples were then bleached with blue light of wavelength 410-450 nm for periods between 19.5 and 24 hours. We performed this process twice—radiation, bleaching, radiation, and then followed by bleaching again—for each of these four PbF2 samples. We shall discuss the efficacy of blue light curing on samples that have undergone two cycles of electron irradiation and optical bleaching.

  4. Optical Restoration of Lead Fluoride Crystals

    SciTech Connect

    Spilker, A.; Cole, P. L.; Forest, T. A.; Mestari, M.; Naeem, S.; LeBaron, N.; Bertin, P.; Camacho, C. Munoz; Roche, J.

    2009-03-10

    Due to its relatively high resistance to high radiation, lead fluoride (PbF{sub 2}) crystals are becoming an increasingly popular material of choice for electromagnetic calorimetry, such as for experiments requiring the measurement of high-energy photons in Hall A of Jefferson Lab. For our studies we irradiated the PbF{sub 2} crystals using an electron linear accelerator (LINAC) followed by exposing the crystals to blue light so as to restore the nominal optical properties. This technique of optical bleaching with blue light affords an efficient and low-cost means for reversing the deleterious effects of optical transmission loss in radiation-damaged lead fluoride crystals. Whereas earlier experiments irradiated the PbF{sub 2} samples with 1.1 and 1.3 MeV gammas from {sup 60}Co, we used pulsed beams of energetic electrons from the tunable 25-MeV LINAC at Idaho Accelerator Center of Idaho State University in Pocatello, Idaho. A 20-MeV beam of electrons was targeted onto four separate 19 cm length samples of lead fluoride over periods of 1, 2, and 4 hours yielding doses between 7 kGy and 35 kGy. Samples were then bleached with blue light of wavelength 410-450 nm for periods between 19.5 and 24 hours. We performed this process twice - radiation, bleaching, radiation, and then followed by bleaching again - for each of these four PbF{sub 2} samples. We shall discuss the efficacy of blue light curing on samples that have undergone two cycles of electron irradiation and optical bleaching.

  5. Effects of Systemic Fluoride and in vitro Fluoride Treatment on Enamel Crystals

    PubMed Central

    Chen, H.; Czajka-Jakubowska, A.; Spencer, N.J.; Mansfield, J.F.; Robinson, C.; Clarkson, B.H.

    2008-01-01

    Systemically administered fluoride at a concentration of 75 ppm increases the surface roughness of developing enamel crystals in rats, which may be significant in advancing our understanding of the biological mechanism of fluorosis. Thus, the aim of this study was to investigate whether the increased surface roughness may be a result of surface restructuring by the direct action of fluoride at the crystal surface. We examined the fluoride dose-dependent roughening of enamel crystal surfaces in vivo, in the rat, and whether this roughening could be mimicked by the in vitro treatment of rat enamel crystals with neutral pH fluoride solutions. Our results showed that enamel crystal surface roughness increased after treatment with increasing fluoride ion concentrations, whether applied in vitro or administered systemically. This suggests a mechanism, alongside others, for the increased surface roughness of crystals in fluorotic enamel. PMID:17062747

  6. Crystallization of heavy metal fluoride glasses

    NASA Technical Reports Server (NTRS)

    Bansal, Narottam P.; Bruce, Allan J.; Doremus, R. H.; Moynihan, C. T.

    1984-01-01

    The kinetics of crystallization of a number of fluorozirconate glasses were studied using isothermal and dynamic differential scanning calorimetry and X-ray diffraction. The addition of the fluorides LiF, NaF, AlF3, LaF3 to a base glass composition of ZrF4-BaF2 reduced the tendency to crystallize, probably by modifying the viscosity-temperature relation. ZrF4-BaF2-LaF3-AlF3-NaF glass was the most stable against devitrification and perhaps is the best composition for optical fibers with low scattering loss. Some glasses first crystallize out into metastable beta-BaZr2F10 and beta-BaZrF6 phases, which transform into the most stable alpha-phases when heated to higher temperatures. The size of the crystallites was estimated to be about 600 A from X-ray diffraction.

  7. Crystallization of heavy metal fluoride glasses

    NASA Technical Reports Server (NTRS)

    Bansal, Narottam P.; Bruce, Allan J.; Doremus, R. H.; Moynihan, C. T.

    1984-01-01

    The kinetics of crystallization of a number of fluorozirconate glasses were studied using isothermal and dynamic differential scanning calorimetry and X-ray diffraction. The addition of the fluorides LiF, NaF, AlF3, LaF3 to a base glass composition of ZrF4-BaF2 reduced the tendency to crystallize, probably by modifying the viscosity-temperature relation. ZrF4-BaF2-LaF3-AlF3-NaF glass was the most stable against devitrification and perhaps is the best composition for optical fibers with low scattering loss. Some glasses first crystallize out into metastable beta-BaZr2F10 and beta-BaZrF6 phases, which transform into the most stable alpha-phases when heated to higher temperatures. The size of the crystallites was estimated to be about 600 A from X-ray diffraction.

  8. Zirconium fluoride glass - Surface crystals formed by reaction with water

    NASA Technical Reports Server (NTRS)

    Doremus, R. H.; Bansal, N. P.; Bradner, T.; Murphy, D.

    1984-01-01

    The hydrated surfaces of a zirconium barium fluoride glass, which has potential for application in optical fibers and other optical elements, were observed by scanning electron microscopy. Crystalline zirconium fluoride was identified by analysis of X-ray diffraction patterns of the surface crystals and found to be the main constituent of the surface material. It was also found that hydrated zirconium fluorides form only in highly acidic fluoride solutions. It is possible that the zirconium fluoride crystals form directly on the glass surface as a result of its depletion of other ions. The solubility of zirconium fluoride is suggested to be probably much lower than that of barium fluoride (0.16 g/100 cu cm at 18 C). Dissolution was determined to be the predominant process in the initial stages of the reaction of the glass with water. Penetration of water into the glass has little effect.

  9. Zirconium fluoride glass - Surface crystals formed by reaction with water

    NASA Technical Reports Server (NTRS)

    Doremus, R. H.; Bansal, N. P.; Bradner, T.; Murphy, D.

    1984-01-01

    The hydrated surfaces of a zirconium barium fluoride glass, which has potential for application in optical fibers and other optical elements, were observed by scanning electron microscopy. Crystalline zirconium fluoride was identified by analysis of X-ray diffraction patterns of the surface crystals and found to be the main constituent of the surface material. It was also found that hydrated zirconium fluorides form only in highly acidic fluoride solutions. It is possible that the zirconium fluoride crystals form directly on the glass surface as a result of its depletion of other ions. The solubility of zirconium fluoride is suggested to be probably much lower than that of barium fluoride (0.16 g/100 cu cm at 18 C). Dissolution was determined to be the predominant process in the initial stages of the reaction of the glass with water. Penetration of water into the glass has little effect.

  10. Silver copper fluoride: A novel perovskite cathode for lithium batteries

    NASA Astrophysics Data System (ADS)

    Tong, Wei; Amatucci, Glenn G.

    2017-09-01

    An electrochemically active nanostructured silver copper fluoride (SCF) perovskite, AgCuF3, was synthesized via a mechanochemical reaction between AgF and CuF2 precursors. Phase composition and electrochemical properties of the SCF perovskites produced under various synthetic parameters were studied. The optimum SCF perovskite sample exhibited an appreciable electrochemical performance through the use of conductive carbon matrix in a primary lithium half cell. A high specific capacity of 270 mAh g-1 was achieved at a cutoff voltage of 2 V with 190 mAh g-1 above 3 V, leading to a total volumetric energy density of 3666 Wh L-1 at >3 V and 4848 Wh L-1 at >2 V.

  11. Materials corrosion in molten lithium fluoride-sodium fluoride-potassium fluoride eutectic salt

    NASA Astrophysics Data System (ADS)

    Olson, Luke Christopher

    Static corrosion studies were undertaken to determine the compatibility of several candidate high temperature materials for a heat transfer loop in a molten alkali fluoride eutectic salt, LiF-NaF-KF: 46.5-11.5-42 mol % (commonly referred to as FLiNaK), as well as a molten chloride near eutectic salt, KCl-MgCl2: 68-32 mol %. Several high temperature alloys: Hastelloy-N, Hastelloy-X, Haynes-230, Inconel-617, and Incoloy-800H, Nb-1Zr, a nearly pure Ni alloy Ni-201, and a C/SiSiC ceramic were exposed to molten FLiNaK at 850°C for 500 h in sealed graphite crucibles under an argon cover gas. Corrosion occurred predominantly from dealloying of Cr from the Cr bearing alloys, an effect that was particularly pronounced at the grain boundaries. Corrosion was noted to occur from selective attack of the Si phase in the C/SiSiC ceramic. Alloy weight-loss/area due to molten fluoride salt exposure correlated with the initial Cr-content of the alloys, and was consistent with the Cr-content measured in the salts after corrosion tests. The alloys' weight-loss/area was also found to correlate to the concentration of carbon present in the nominally 20% Cr containing alloys, due to the formation of chromium carbide phases at the grain boundaries. The corrosion mechanisms for the chloride based salt were found to be similar to those observed in FLiNaK, but the chemical attack was found to be less aggressive. Sulfamate Ni electroplating and Mo plasma spraying of Fe-Ni-Cr alloy coupons was investigated to mitigate Cr dissolution. A chemical vapor deposited pyrolytic carbon and SiC coating was also investigated to protect the C/SiSiC composites. Results indicate that Ni-plating has the potential to provide protection against alloy corrosion in molten fluoride salts. Furthermore, the presence of a chromium-oxide interlayer at the interface of the Ni-plating and alloy substrate can further improve the efficacy of the Ni-plating. The pyrolytic carbon and SiC coating on the C/SiSiC composites

  12. Radiation and phase change of lithium fluoride in an annulus

    NASA Technical Reports Server (NTRS)

    Lund, Kurt O.

    1993-01-01

    A one-dimensional thermal model is developed to evaluate the effect of radiation on the phase change of lithium-fluoride (LiF) in an annular canister under gravitational and microgravitational conditions. Specified heat flux at the outer wall of the canister models focused solar flux; adiabatic and convective conditions are considered for the inner wall. A two-band radiation model is used for the combined-mode heat transfer within the canister, and LiF optical properties relate metal surface properties in vacuum to those in LiF. For axial gravitational conditions, the liquid LiF remains in contact with the two bounding walls, whereas a void gap is used at the outer wall to model possible microgravitational conditions. For the adiabatic cases, exact integrals are obtained for the time required for complete melting of the LiF. Melting was found to occur primarily from the outer wall in the 1-g model, whereas it occurred primarily from the inner wall in the mu-g model. For the convective cases, partially melted steady-state conditions and fully melted conditions are determined to depend on the source flux level, with radiation extending the melting times.

  13. Radiation and phase change of lithium fluoride in an annulus

    NASA Technical Reports Server (NTRS)

    Lund, Kurt O.

    1993-01-01

    A one-dimensional thermal model is developed to evaluate the effect of radiation on the phase change of lithium-fluoride (LiF) in an annular canister under gravitational and microgravitational conditions. Specified heat flux at the outer wall of the canister models focused solar flux; adiabatic and convective conditions are considered for the inner wall. A two-band radiation model is used for the combined-mode heat transfer within the canister, and LiF optical properties relate metal surface properties in vacuum to those in LiF. For axial gravitational conditions, the liquid LiF remains in contact with the two bounding walls, whereas a void gap is used at the outer wall to model possible microgravitational conditions. For the adiabatic cases, exact integrals are obtained for the time required for complete melting of the LiF. Melting was found to occur primarily from the outer wall in the 1-g model, whereas it occurred primarily from the inner wall in the mu-g model. For the convective cases, partially melted steady-state conditions and fully melted conditions are determined to depend on the source flux level, with radiation extending the melting times.

  14. Hot filament technique for measuring the thermal conductivity of molten lithium fluoride

    NASA Technical Reports Server (NTRS)

    Jaworske, Donald A.; Perry, William D.

    1990-01-01

    Molten salts, such as lithium fluoride, are attractive candidates for thermal energy storage in solar dynamic space power systems because of their high latent heat of fusion. However, these same salts have poor thermal conductivities which inhibit the transfer of heat into the solid phase and out of the liquid phase. One concept for improving the thermal conductivity of the thermal energy storage system is to add a conductive filler material to the molten salt. High thermal conductivity pitch-based graphite fibers are being considered for this application. Although there is some information available on the thermal conductivity of lithium fluoride solid, there is very little information on lithium fluoride liquid, and no information on molten salt graphite fiber composites. This paper describes a hot filament technique for determining the thermal conductivity of molten salts. The hot filament technique was used to find the thermal conductivity of molten lithium fluoride at 930 C, and the thermal conductivity values ranged from 1.2 to 1.6 W/mK. These values are comparable to the slightly larger value of 5.0 W/mK for lithium fluoride solid. In addition, two molten salt graphite fiber composites were characterized with the hot filament technique and these results are also presented.

  15. Nuclear quantum effects in water exchange around lithium and fluoride ions.

    PubMed

    Wilkins, David M; Manolopoulos, David E; Dang, Liem X

    2015-02-14

    We employ classical and ring polymer molecular dynamics simulations to study the effect of nuclear quantum fluctuations on the structure and the water exchange dynamics of aqueous solutions of lithium and fluoride ions. While we obtain reasonably good agreement with experimental data for solutions of lithium by augmenting the Coulombic interactions between the ion and the water molecules with a standard Lennard-Jones ion-oxygen potential, the same is not true for solutions of fluoride, for which we find that a potential with a softer repulsive wall gives much better agreement. A small degree of destabilization of the first hydration shell is found in quantum simulations of both ions when compared with classical simulations, with the shell becoming less sharply defined and the mean residence time of the water molecules in the shell decreasing. In line with these modest differences, we find that the mechanisms of the exchange processes are unaffected by quantization, so a classical description of these reactions gives qualitatively correct and quantitatively reasonable results. We also find that the quantum effects in solutions of lithium are larger than in solutions of fluoride. This is partly due to the stronger interaction of lithium with water molecules, partly due to the lighter mass of lithium and partly due to competing quantum effects in the hydration of fluoride, which are absent in the hydration of lithium.

  16. Nuclear quantum effects in water exchange around lithium and fluoride ions

    SciTech Connect

    Wilkins, David M.; Manolopoulos, David; Dang, Liem X.

    2015-02-14

    We employ classical and ring polymer molecular dynamics simulations to study the effect of nuclear quantum fluctuations on the structure and the water exchange dynamics of aqueous solutions of lithium and fluoride ions. While we obtain reasonably good agreement with experimental data for solutions of lithium by augmenting the Coulombic interactions between the ion and the water molecules with a standard Lennard-Jones ion-oxygen potential, the same is not true for solutions of fluoride, for which we find that a potential with a softer repulsive wall gives much better agreement. A small degree of destabilization of the first hydration shell is found in quantum simulations of both ions when compared with classical simulations, with the shell becoming less sharply defined and the mean residence time of the water molecules in the shell decreasing. In line with these modest differences, we find that the mechanisms of the water exchange reactions are unaffected by quantization, so a classical description of these reactions gives qualitatively correct and quantitatively reasonable results. We also find that the quantum effects in solutions of lithium are larger than in solutions of fluoride. This is partly due to the stronger interaction of lithium with water molecules, partly due to the lighter mass of lithium, and partly due to competing quantum effects in the hydration of fluoride, which are absent in the hydration of lithium. LXD was supported by US Department of Energy, Office of Science, Office of Basic Energy Sciences, Division of Chemical Sciences, Geosciences, and Biosciences.

  17. Nuclear quantum effects in water exchange around lithium and fluoride ions

    SciTech Connect

    Wilkins, David M.; Manolopoulos, David E.; Dang, Liem X.

    2015-02-14

    We employ classical and ring polymer molecular dynamics simulations to study the effect of nuclear quantum fluctuations on the structure and the water exchange dynamics of aqueous solutions of lithium and fluoride ions. While we obtain reasonably good agreement with experimental data for solutions of lithium by augmenting the Coulombic interactions between the ion and the water molecules with a standard Lennard-Jones ion-oxygen potential, the same is not true for solutions of fluoride, for which we find that a potential with a softer repulsive wall gives much better agreement. A small degree of destabilization of the first hydration shell is found in quantum simulations of both ions when compared with classical simulations, with the shell becoming less sharply defined and the mean residence time of the water molecules in the shell decreasing. In line with these modest differences, we find that the mechanisms of the exchange processes are unaffected by quantization, so a classical description of these reactions gives qualitatively correct and quantitatively reasonable results. We also find that the quantum effects in solutions of lithium are larger than in solutions of fluoride. This is partly due to the stronger interaction of lithium with water molecules, partly due to the lighter mass of lithium and partly due to competing quantum effects in the hydration of fluoride, which are absent in the hydration of lithium.

  18. Observations of the freeze/thaw performance of lithium fluoride by motion picture photography

    NASA Technical Reports Server (NTRS)

    Jaworske, D. A.; Perry, W. D.

    1991-01-01

    To gain direct observation of the molten salt phase change, a novel containerless technique was developed where the high surface tension of lithium fluoride was used to suspend a bead of the molten salt inside a specially designed wire cage. By varying the current passing through the wire, the cage also served as a variable heat source. In this way, the freeze/thaw performance of the lithium fluoride could be photographed by motion picture photography without the influence of container walls. The motion picture photography of the lithium fluoride sample revealed several zones during the phase change, a solid zone and a liquid zone, as expected, and a slush zone that was predicted by thermal analysis modeling.

  19. Observations of the freeze/thaw performance of lithium fluoride by motion picture photography

    NASA Technical Reports Server (NTRS)

    Jaworske, D. A.; Perry, W. D.

    1991-01-01

    To gain direct observation of the molten salt phase change, a novel containerless technique was developed where the high surface tension of lithium fluoride was used to suspend a bead of the molten salt inside a specially designed wire cage. By varying the current passing through the wire, the cage also served as a variable heat source. In this way, the freeze/thaw performance of the lithium fluoride could be photographed by motion picture photography without the influence of container walls. The motion picture photography of the lithium fluoride sample revealed several zones during the phase change, a solid zone and a liquid zone, as expected, and a slush zone that was predicted by thermal analysis modeling.

  20. Crystallization, Optical and Chemical Properties of Fluoride Glasses

    NASA Technical Reports Server (NTRS)

    Doremus, R. H.

    1985-01-01

    Fluoride glasses have great promise as infrared optical components, especially fibers, because they are transparent to 8 micrometers and higher. In order to optimize properties, different glass compositions are needed. Some are hard to form in a container, and may possibly be formable in a containerless furnace. Understanding of crystallization with and without a container could lead to glasses with optimum properties. Chemical durability (attack by water) can limit or extend the applicability of fluoride glasses. Progress to date is given.

  1. Crystallization, Optical and Chemical Properties of Fluoride Glasses

    NASA Technical Reports Server (NTRS)

    Doremus, R. H.

    1985-01-01

    Fluoride glasses have great promise as infrared optical components, especially fibers, because they are transparent to 8 micrometers and higher. In order to optimize properties, different glass compositions are needed. Some are hard to form in a container, and may possibly be formable in a containerless furnace. Understanding of crystallization with and without a container could lead to glasses with optimum properties. Chemical durability (attack by water) can limit or extend the applicability of fluoride glasses. Progress to date is given.

  2. Zero-gravity growth of a sodium chloride-lithium fluoride eutectic mixture

    NASA Technical Reports Server (NTRS)

    Yue, A. S.; Yeh, C. W.; Yue, B. K.

    1982-01-01

    Continuous and discontinuous lithium fluoride fibers embedded in a sodium chloride matrix were produced in space and on Earth, respectively. The production of continuous fibers in a eutectic mixture was attributed to the absence of convective current in the liquid during solidification in space. Image transmission and optical transmittance measurements of transverse sections of the space-grown and Earth-grown ingots were made with a light microscope and a spectrometer. It was found that better optical properties were obtained from samples grown in space. This was attributed to a better alignment of lithium fluoride fibers along the growth direction.

  3. Synthesis and Crystallization Behavior of Fluoride Glasses

    DTIC Science & Technology

    1989-08-22

    investigator, Professor Uhlmann. It was initiated to explore the feasibility of wet chemical (sol-gel) methods for the synthesis of heavy metal fluoride glasses... synthesis routes to the preparation of metal-organic precursors for heavy metal fluoride glasses were developed. Particular attention was directed to...demonstrated. 8. Using wet chemical synthesis routes based on sol-gel methods , barrier layers having a broad range of chemistries were prepared; and

  4. Effects of light exposure on irradiated barium fluoride crystals

    SciTech Connect

    Wuest, C.R.; Mauger, G.J.

    1993-04-20

    Small barium fluoride crystals have been irradiated using cobalt-60 gamma rays under various illumination conditions to establish the effect of photo-bleaching of the radiation-induced color centers. This paper describes results of a few different experiments conducted at LLNL over the past few weeks.

  5. Lithium-cation conductivity and crystal structure of lithium diphosphate

    SciTech Connect

    Voronin, V.I.; Sherstobitova, E.A.; Blatov, V.A.; Shekhtman, G.Sh.

    2014-03-15

    The electrical conductivity of lithium diphosphate Li{sub 4}P{sub 2}O{sub 7} has been measured and jump-like increasing of ionic conductivity at 913 K has been found. The crystal structure of Li{sub 4}P{sub 2}O{sub 7} has been refined using high temperature neutron diffraction at 300–1050 K. At 913 K low temperature triclinic form of Li{sub 4}P{sub 2}O{sub 7} transforms into high temperature monoclinic one, space group P2{sub 1}/n, a=8.8261(4) Å, b=5.2028(4) Å, c=13.3119(2) Å, β=104.372(6)°. The migration maps of Li{sup +} cations based on experimental data implemented into program package TOPOS have been explored. It was found that lithium cations in both low- and high temperature forms of Li{sub 4}P{sub 2}O{sub 7} migrate in three dimensions. Cross sections of the migrations channels extend as the temperature rises, but at the phase transition point have a sharp growth showing a strong “crystal structure – ion conductivity” correlation. -- Graphical abstract: Crystal structure of Li{sub 4}P{sub 2}O{sub 7} at 950 K. Red balls represent oxygen atoms; black lines show Li{sup +} ion migration channels in the layers perpendicular to [001] direction. Highlights: • Structure of Li{sub 4}P{sub 2}O{sub 7} has been refined using high temperature neutron diffraction. • At 913 K triclinic form of Li{sub 4}P{sub 2}O{sub 7} transforms into high temperature monoclinic one. • The migration maps of Li{sup +} implemented into program package TOPOS have been explored. • Cross sections of the migrations channels at the phase transition have a sharp growth.

  6. Improving lithium therapeutics by crystal engineering of novel ionic cocrystals.

    PubMed

    Smith, Adam J; Kim, Seol-Hee; Duggirala, Naga K; Jin, Jingji; Wojtas, Lukasz; Ehrhart, Jared; Giunta, Brian; Tan, Jun; Zaworotko, Michael J; Shytle, R Douglas

    2013-12-02

    Current United States Food and Drug Administration (FDA)-approved lithium salts are plagued with a narrow therapeutic window. Recent attempts to find alternative drugs have identified new chemical entities, but lithium's polypharmacological mechanisms for treating neuropsychiatric disorders are highly debated and are not yet matched. Thus, re-engineering current lithium solid forms in order to optimize performance represents a low cost and low risk approach to the desired therapeutic outcome. In this contribution, we employed a crystal engineering strategy to synthesize the first ionic cocrystals (ICCs) of lithium salts with organic anions. We are unaware of any previous studies that have assessed the biological efficacy of any ICCs, and encouragingly we found that the new speciation did not negatively affect established bioactivities of lithium. We also observed that lithium ICCs exhibit modulated pharmacokinetics compared to lithium carbonate. Indeed, the studies detailed herein represent an important advancement in a crystal engineering approach to a new generation of lithium therapeutics.

  7. Mechanical and optical response of [100] lithium fluoride to multi-megabar dynamic pressures

    NASA Astrophysics Data System (ADS)

    Davis, Jean-Paul; Knudson, Marcus D.; Shulenburger, Luke; Crockett, Scott D.

    2016-10-01

    An understanding of the mechanical and optical properties of lithium fluoride (LiF) is essential to its use as a transparent tamper and window for dynamic materials experiments. In order to improve models for this material, we applied iterative Lagrangian analysis to ten independent sets of data from magnetically driven planar shockless compression experiments on single crystal [100] LiF to pressures as high as 350 GPa. We found that the compression response disagreed with a prevalent tabular equation of state for LiF that is commonly used to interpret shockless compression experiments. We also present complementary data from ab initio calculations performed using the diffusion quantum Monte Carlo method. The agreement between these two data sets lends confidence to our interpretation. In order to aid in future experimental analysis, we have modified the tabular equation of state to match the new data. We have also extended knowledge of the optical properties of LiF via shock-compression and shockless compression experiments, refining the transmissibility limit, measuring the refractive index to ˜300 GPa, and confirming the nonlinear dependence of the refractive index on density. We present a new model for the refractive index of LiF that includes temperature dependence and describe a procedure for correcting apparent velocity to true velocity for dynamic compression experiments.

  8. Mechanical and optical response of [100] lithium fluoride to multi-megabar dynamic pressures

    DOE PAGES

    Davis, Jean -Paul; Knudson, Marcus D.; Shulenburger, Luke; ...

    2016-10-26

    An understanding of the mechanical and optical properties of lithium fluoride (LiF) is essential to its use as a transparent tamper and window for dynamic materials experiments. In order to improve models for this material, we applied iterative Lagrangian analysis to ten independent sets of data from magnetically driven planar shockless compression experiments on single crystal [100] LiF to pressures as high as 350 GPa. We found that the compression response disagreed with a prevalent tabular equation of state for LiF that is commonly used to interpret shockless compression experiments. We also present complementary data from ab initio calculations performedmore » using the diffusion quantum Monte Carlo method. The agreement between these two data sets lends confidence to our interpretation. In order to aid in future experimental analysis, we have modified the tabular equation of state to match the new data. We have also extended knowledge of the optical properties of LiF via shock-compression and shockless compression experiments, refining the transmissibility limit, measuring the refractive index to ~300 GPa, and confirming the nonlinear dependence of the refractive index on density. Lastly, we present a new model for the refractive index of LiF that includes temperature dependence and describe a procedure for correcting apparent velocity to true velocity for dynamic compression experiments.« less

  9. Mechanical response of lithium fluoride under off-principal dynamic shock-ramp loading

    SciTech Connect

    Seagle, Christopher T.; Davis, Jean-Paul; Knudson, Marcus D.

    2016-10-26

    Single crystal lithium fluoride (LiF), oriented [100], was shock loaded and subsequently shocklessly compressed in two experiments at the Z Machine. We employed velocimetry measurements in order to obtain an impactor velocity, shock transit times, and in-situ particle velocities for LiF samples up to ~1.8 mm thick. We also performed a dual thickness Lagrangian analysis on the in-situ velocimetry data to obtain the mechanical response along the loading path of these experiments. Finally, we observed an elastic response on one experiment during initial shockless compression from 100 GPa before yielding. The relatively large thickness differences utilized for the dual sample analyses (up to ~1.8 mm) combined with a relative timing accuracy of ~0.2 ns resulted in an uncertainty of less than 1% on density and stress at ~200 GPa peak loading on one experiment and <4% on peak loading at ~330 GPa for another. The stress-density analyses from these experiments compare favorably with recent equation of state models for LiF.

  10. Mechanical response of lithium fluoride under off-principal dynamic shock-ramp loading

    DOE PAGES

    Seagle, Christopher T.; Davis, Jean-Paul; Knudson, Marcus D.

    2016-10-26

    Single crystal lithium fluoride (LiF), oriented [100], was shock loaded and subsequently shocklessly compressed in two experiments at the Z Machine. We employed velocimetry measurements in order to obtain an impactor velocity, shock transit times, and in-situ particle velocities for LiF samples up to ~1.8 mm thick. We also performed a dual thickness Lagrangian analysis on the in-situ velocimetry data to obtain the mechanical response along the loading path of these experiments. Finally, we observed an elastic response on one experiment during initial shockless compression from 100 GPa before yielding. The relatively large thickness differences utilized for the dual samplemore » analyses (up to ~1.8 mm) combined with a relative timing accuracy of ~0.2 ns resulted in an uncertainty of less than 1% on density and stress at ~200 GPa peak loading on one experiment and <4% on peak loading at ~330 GPa for another. The stress-density analyses from these experiments compare favorably with recent equation of state models for LiF.« less

  11. Mechanical and optical response of [100] lithium fluoride to multi-megabar dynamic pressures

    SciTech Connect

    Davis, Jean -Paul; Knudson, Marcus D.; Shulenburger, Luke; Crockett, Scott D.

    2016-10-26

    An understanding of the mechanical and optical properties of lithium fluoride (LiF) is essential to its use as a transparent tamper and window for dynamic materials experiments. In order to improve models for this material, we applied iterative Lagrangian analysis to ten independent sets of data from magnetically driven planar shockless compression experiments on single crystal [100] LiF to pressures as high as 350 GPa. We found that the compression response disagreed with a prevalent tabular equation of state for LiF that is commonly used to interpret shockless compression experiments. We also present complementary data from ab initio calculations performed using the diffusion quantum Monte Carlo method. The agreement between these two data sets lends confidence to our interpretation. In order to aid in future experimental analysis, we have modified the tabular equation of state to match the new data. We have also extended knowledge of the optical properties of LiF via shock-compression and shockless compression experiments, refining the transmissibility limit, measuring the refractive index to ~300 GPa, and confirming the nonlinear dependence of the refractive index on density. Lastly, we present a new model for the refractive index of LiF that includes temperature dependence and describe a procedure for correcting apparent velocity to true velocity for dynamic compression experiments.

  12. Crystal nucleation in lithium borate glass

    NASA Technical Reports Server (NTRS)

    Smith, Gary L.; Neilson, George F.; Weinberg, Michael C.

    1988-01-01

    Crystal nucleation measurements were made on three lithium borate compositions in the vicinity of Li2O-2Br2O3. All nucleation measurements were performed at 500 C. Certain aspects of the nucleation behavior indicated (tentatively) that it proceeded by a homogeneous mechanism. The steady state nucleation rate was observed to have the largest value when the Li2O concentration was slightly in excess of the diborate composition. The change in nucleation rate with composition is controlled by the variation of viscosity as well as the change in free energy with composition. The variation of nucleation rate is explained qualitatively in these terms.

  13. Optical properties of lithium niobate single crystals

    NASA Astrophysics Data System (ADS)

    Palatnikov, M. N.; Sidorov, N. V.; Biryukova, I. V.; Kalinnikov, V. T.; Bormanis, K.

    2005-01-01

    Studies of thermal and -irradiation effects on the optical properties in congruous lithium niobate single crystals containing Y, Mg, Gd, B, and Zn dopants including samples with double dopants Y, Mg and Gd, Mg are reported. Formation of defects at irradiation and thermal treatment of the samples is explored by electron absorption spectra. Considerable increase of absorption with the dose of -radiation is observed at 500 nm. The changes of absorption examined under different conditions are explained by creation and destruction of Nb4+ defects.

  14. Test beam results of a cerium fluoride crystal matrix

    NASA Astrophysics Data System (ADS)

    Auffray, E.; Bourotte, J.; Beckers, T.; Chipaux, M.; Commichau, V.; Dafinei, I.; Depasse, P.; Djambazov, L.; Dydak, U.; El Mamouni, H.; Fay, J.; Felcini, M.; Goyot, M.; Haguenauer, M.; Hillemans, H.; Hofer, H.; Ille, B.; Kirn, T.; Kryn, D.; Lebrun, P.; Lecomte, P.; Lecoq, P.; Martin, J. P.; Maurelli, G.; Mattioli, M.; Melnikov, I.; Nessi-Tedaldi, F.; Pacciani, L.; Pirro, S.; Raghavan, R.; Ren, D.; Reynaud, M.; Röser, U.; Sahuc, P.; Schmitz, D.; Schneegans, M.; Schwenke, J.; Soric, I.; Viertel, G.; von Gunten, H. P.; Walder, J. P.; Waldmeier-Wicki, S.

    1995-11-01

    A Cerium Fluoride matrix of 3 × 3 towers with Silicon photodiode readout has been tested in electron and pion beams from 10 to 150 GeV energy. The matrix was assembled with a selection of crystals out of a total of over 40 large crystals (up to 20 cm long and 3 cm × 3 cm in cross section) from various producers. Despite less than optimal geometry and crystal quality, an energy resolution of 0.5% for energies ≥ 50 GeV has been obtained. Fast shaping amplifier prototypes were tested and their performance was found to be appropriate for operation in an LHC-like environment.

  15. Magnesium oxide doping reduces acoustic wave attenuation in lithium metatantalate and lithium metaniobate crystals

    NASA Technical Reports Server (NTRS)

    Croft, W.; Damon, R.; Kedzie, R.; Kestigian, M.; Smith, A.; Worley, J.

    1970-01-01

    Single crystals of lithium metatantalate and lithium metaniobate, grown from melts having different stoichiometries and different amounts of magnesium oxide, show that doping lowers temperature-independent portion of attenuation of acoustic waves. Doped crystals possess optical properties well suited for electro-optical and photoelastic applications.

  16. Ytterbium-doped borate fluoride laser crystals and lasers

    DOEpatents

    Schaffers, Kathleen I.; DeLoach, Laura D.; Payne, Stephen A.; Keszler, Douglas A.

    1997-01-01

    A new class of solid state laser crystals and lasers are formed from Yb-doped borate fluoride host crystals. The general formula for the host crystals is MM'(BO.sub.3)F, where M, M' are monovalent, divalent aria trivalent metal cations. A particular embodiment of the invention is Yb-doped BaCaBO.sub.3 F (Yb:BCBF). BCBF and some of the related derivative crystals are capable of nonlinear frequency conversion, whereby the fundamental of the laser is converted to a longer or shorter wavelength. In this way, these new crystals can simultaneously serve as self-frequency doubling crystals and laser materials within the laser resonator.

  17. Ytterbium-doped borate fluoride laser crystals and lasers

    DOEpatents

    Schaffers, K.I.; DeLoach, L.D.; Payne, S.A.; Keszler, D.A.

    1997-10-14

    A new class of solid state laser crystals and lasers are formed from Yb-doped borate fluoride host crystals. The general formula for the host crystals is MM{prime}(BO{sub 3})F, where M, M{prime} are monovalent, divalent aria trivalent metal cations. A particular embodiment of the invention is Yb-doped BaCaBO{sub 3}F (Yb:BCBF). BCBF and some of the related derivative crystals are capable of nonlinear frequency conversion, whereby the fundamental of the laser is converted to a longer or shorter wavelength. In this way, these new crystals can simultaneously serve as self-frequency doubling crystals and laser materials within the laser resonator. 6 figs.

  18. Quantum monte carlo study of the energetics of small hydrogenated and fluoride lithium clusters.

    PubMed

    Moreira, N L; Brito, B G A; Rabelo, J N Teixeira; Cândido, Ladir

    2016-06-30

    An investigation of the energetics of small lithium clusters doped either with a hydrogen or with a fluorine atom as a function of the number of lithium atoms using fixed-node diffusion quantum Monte Carlo (DMC) simulation is reported. It is found that the binding energy (BE) for the doped clusters increases in absolute values leading to a more stable system than for the pure ones in excellent agreement with available experimental measurements. The BE increases for pure, remains almost constant for hydrogenated, and decreases rapidly toward the bulk lithium for the fluoride as a function of the number of lithium atoms in the clusters. The BE, dissociation energy as well as the second difference in energy display a pronounced odd-even oscillation with the number of lithium atoms. The electron correlation inverts the odd-even oscillation pattern for the doped in comparison with the pure clusters and has an impact of 29%-83% to the BE being higher in the pure cluster followed by the hydrogenated and then by the fluoride. The dissociation energy and the second difference in energy indicate that the doped cluster Li3 H is the most stable whereas among the pure ones the more stable are Li2 , Li4 , and Li6 . The electron correlation energy is crucial for the stabilization of Li3 H. © 2016 Wiley Periodicals, Inc.

  19. Spectral Diversity Crystalline Fluoride Lasers,

    DTIC Science & Technology

    1981-01-01

    2 4.-. i1.34 I R TUNABLE Table IX XeF Pumoe TM3 +: YLF :1 .Tm:YLF exhibits nearly ideal parameters for high energy operation aa3x10-20cm 2 ESAT 0cm e...host crystal, lithium yttrium fluoride, LiYF*4 ( YLF )" 1..0 Introductin Within the realm of crystalline laser materials,. the class of fluorides...on the host crystal, lithium yttrium fluoride, LiYF4 - often shortened as YLF . Tables I and 12 show the mechanical, thermal, and optical properties

  20. F 3 - molecular ions in fluoride crystals

    NASA Astrophysics Data System (ADS)

    Radzhabov, E. A.

    2016-02-01

    The UV absorption spectra of F 3 - molecular ions in LaF3, SrF2, CaF2, and BaF2 crystals doped with rare-earth elements are studied. Comparison of radiation-colored and additively colored crystals reveals the absorption bands of F 3 - hole centers in the region near 6 eV. Nonempirical calculations of optical transitions agree well with experimental results.

  1. Spectroscopic Investigation of Ce(3+) Doped Fluoride Crystals

    NASA Technical Reports Server (NTRS)

    Reinhart, Donald H.; Armagan, Guzin; Marsh, Waverly; Barnes, James; Chai, B. H. T.

    1995-01-01

    Doping of the trivalent rare-earth cerium ion into fluoride crystals is of interest in producing turnable ultra-violet solid state lasers. These lasers are desirable for many applications in medicine, industry, and scientific research, including remote sensing. High absorption and stimulated emission cross sections of the dipole allowed 4f-5d transitions show promise in cerium as a laser ion in crystals. Several research groups have already reported the observation of stimulated emission of cerium in LiYF4, LiSrAlF6, and LiCaAlF6. However, the color center formation in the crystals due to the excited state absorption of ultra-violet pump light adds difficulty to achieving laser action. We have investigated the spectroscopic properties of cerium such as absorption and emission spectra, and lifetimes in four different fluoride crystals, including LiCaAlF6, LiSrAlF6, KyF4 and LiYF4. We have derived the polarized absorption and stimulated emission cross sections from transmission and fluorescence emission measurements for each of the host crystals. we have measured the lifetime of the lowest 5d level; moreover, investigated the temperature dependence of this lifetime and color center formation. Our results on absorption and stimulated emission cross sections for LiCaAlF6 and LiSrAlF6 are similar to the results already published.

  2. Spectroscopic Investigation of Ce(3+) Doped Fluoride Crystals

    NASA Technical Reports Server (NTRS)

    Reinhart, Donald H.; Armagan, Guzin; Marsh, Waverly; Barnes, James; Chai, B. H. T.

    1995-01-01

    Doping of the trivalent rare-earth cerium ion into fluoride crystals is of interest in producing turnable ultra-violet solid state lasers. These lasers are desirable for many applications in medicine, industry, and scientific research, including remote sensing. High absorption and stimulated emission cross sections of the dipole allowed 4f-5d transitions show promise in cerium as a laser ion in crystals. Several research groups have already reported the observation of stimulated emission of cerium in LiYF4, LiSrAlF6, and LiCaAlF6. However, the color center formation in the crystals due to the excited state absorption of ultra-violet pump light adds difficulty to achieving laser action. We have investigated the spectroscopic properties of cerium such as absorption and emission spectra, and lifetimes in four different fluoride crystals, including LiCaAlF6, LiSrAlF6, KyF4 and LiYF4. We have derived the polarized absorption and stimulated emission cross sections from transmission and fluorescence emission measurements for each of the host crystals. we have measured the lifetime of the lowest 5d level; moreover, investigated the temperature dependence of this lifetime and color center formation. Our results on absorption and stimulated emission cross sections for LiCaAlF6 and LiSrAlF6 are similar to the results already published.

  3. Shrinkage void formation and its effect on freeze and thaw processes of lithium and lithium-fluoride for space applications

    NASA Technical Reports Server (NTRS)

    Yang, Jae Y.; El-Genk, Mohamed S.

    1991-01-01

    The effects of shrinkage void forming during freezing of lithium and lithium fluoride on subsequent thaw processes are investigated using a numerical scheme that is based on a single (solid/liquid) cell approach. Results show that a void forming at the wall appreciably reduces the solid-liquid interface velocity, during both freeze and thaw, and causes a substantial rise in the wall temperature during thaw. However, in the case of Li, the maximum wall temperature was much lower than the melting temperature of PWC-11, which is used as the structure material in the SP-100 system. Hence, it is concluded that a formation of hot spots is unlikely during the startup or restart of the SP-100 system.

  4. An investigation of voids formation mechanisms and their effects on freeze and thaw processes of lithium and lithium fluoride

    NASA Technical Reports Server (NTRS)

    El-Genk, Mohamed S.; Yang, Jae-Young

    1991-01-01

    The mechanisms of void formation during the cooldown and freezing of lithium coolant within the primary loop of SP-100 type systems are investigated. These mechanisms are: (1) homogeneous nucleation; (2) heterogeneous nucleation; (3) normal segregation of helium gas dissolved in liquid lithium; and (4) shrinkage of lithium during freezing. To evaluate the void formation potential due to segregation, a numerical scheme that couples the freezing and mass diffusion processes in both the solid and liquid regions is developed. The results indicated that the formation of He bubbles is unlikely by either homogeneous or heterogeneous nucleation during the cooldown process. However, homogeneous nucleation of He bubbles following the segregation of dissolved He in liquid lithium ahead of the solid-liquid interface is likely to occur. Results also show that total volume of He void is insignificant when compared to that of shrinkage voids. In viewing this, the subsequent research focuses on the effects of shrinkage void forming during freezing of lithium on subsequent thaw processes are investigated using a numerical scheme that is based on a single (solid/liquid) cell approach. The cases of lithium-fluoride are also investigated to show the effect of larger volume shrinkage upon freezing on the freeze and thaw processes. Results show that a void forming at the wall appreciably reduces the solid-liquid interface velocity, during both freeze and thaw, and causes a substantial rise in the wall temperature during thaw. However, in the case of Li, the maximum wall temperature was much lower than the melting temperature of PWC-11, which is used as the structure material in the SP-100 system. Hence, it is included that a formation of hot spots is unlikely during the startup or restart of the SP-100 system.

  5. Carbon Nanohorns Carried Iron Fluoride Nanocomposite with ultrahigh rate lithium ion storage properties

    PubMed Central

    Fan, Lishuang; Li, Bingjiang; Zhang, Naiqing; Sun, Kening

    2015-01-01

    Novel hierarchical carbon nanohorns (CNHs) carried iron fluoride nanocomposites have been constructed by direct growth of FeF3·0.33H2O nanoparticles on CNHs. In the FeF3·0.33H2O@CNHs nanocomposite, the mesopore CNHs play the role as conductive matrix and robust carrier to support the FeF3·0.33H2O nanoparticles. The intimate conductive contact between the two components can build up an express way of electron transfer for rapid Li+ insertion/extraction. The CNHs can not only suppress the growth and agglomeration of FeF3·0.33H2O during the crystallization process, but also sever as an “elastic confinement” to support FeF3·0.33H2O. As was to be expected, the hierarchical FeF3·0.33H2O@CNHs nanocomposite exhibits impressive rate capability and excellent cycle performance. Markedly, the nanocomposite proves stable, ultrahigh rate lithium ion storage properties of 81 mAh g−1 at charge/discharge rate of 50 C (a discharge/charge process only takes 72 s). The integration of high electron conductivity, confined nano sized FeF3·0.33H2O (~5 nm), hierarchical mesopores CNHs and the “elastic confinement” support, the FeF3·0.33H2O@CNHs nanocomposite demonstrates excellent ultrahigh rate capability and good cycling properties. PMID:26173994

  6. Fluoride

    MedlinePlus

    ... by teeth and helps to strengthen teeth, resist acid, and block the cavity-forming action of bacteria. Fluoride usually is prescribed for children and adults whose homes have water that is not fluoridated (already has fluoride added). ...

  7. Viscosity of molten lithium, thorium and beryllium fluorides mixtures

    NASA Astrophysics Data System (ADS)

    Merzlyakov, Alexander V.; Ignatiev, Victor V.; Abalin, Sergei S.

    2011-12-01

    Considering development of Molten Salt Fast Reactor (MSFR) concept, following Molten Salt fluorides mixtures have been chosen as an object for viscosity studies in this work (in mol%): 78LiF-22ThF 4; 71LiF-27ThF 4-2BeF 2 and 75LiF-20ThF 4-5BeF 2. Additionally, the effect of the 3 mol% CeF 3 additives on viscosity of the molten 75LiF-20ThF 4-5BeF 2 (mol%) salt mixture has been investigated experimentally. The method of torsional oscillations of cylindrical crucible filled by molten fluorides mixture has been chosen for kinematic viscosity measurement at temperatures up to 800-850 °C. In temperature ranges, where melts behave as normal liquids, dependences on viscosity vs. temperature are received: ν = А exp [B/T(K)], where ν - kinematic viscosity, m 2/s; T - temperature, K. The kinematic viscosity Rout mean squares (RMS) estimated in the assumption about dispersion homoscedasticity is (0.04-0.12) × 10 -6 (m 2/s). Discrepancies left in the data of viscosity for molten mixtures of LiF, BeF 2 and ThF 4 received by different researchers need further investigations in this area to be continued.

  8. Efficient holmium:yttrium lithium fluoride laser longitudinally pumped by a semiconductor laser array

    NASA Technical Reports Server (NTRS)

    Hemmati, H.

    1987-01-01

    Optical pumping of a holmium:yttrium lithium floride (Ho:YLF) crystal with a 790-nm continuous-wave diode-laser array has generated 56 mW of 2.1-micron laser radiation with an optical-to-optical conversion slope efficiency of 33 percent while the crystal temperature is held at 77 K. The lasing threshold occurs at 7 mW of input power, and laser operation continues up to a crystal temperature of 124 K.

  9. Efficient holmium:yttrium lithium fluoride laser longitudinally pumped by a semiconductor laser array

    NASA Technical Reports Server (NTRS)

    Hemmati, H.

    1987-01-01

    Optical pumping of a holmium:yttrium lithium floride (Ho:YLF) crystal with a 790-nm continuous-wave diode-laser array has generated 56 mW of 2.1-micron laser radiation with an optical-to-optical conversion slope efficiency of 33 percent while the crystal temperature is held at 77 K. The lasing threshold occurs at 7 mW of input power, and laser operation continues up to a crystal temperature of 124 K.

  10. PHz current switching in calcium fluoride single crystal

    SciTech Connect

    Kwon, Ojoon; Kim, D.

    2016-05-09

    We demonstrate that a current can be induced and switched in a sub-femtosecond time-scale in an insulating calcium fluoride single crystal by an intense optical field. This measurement indicates that a sizable current can be generated and also controlled by an optical field in a dielectric medium, implying the capability of rapid current switching at a rate of optical frequency, PHz (10{sup 15} Hz), which is a couple of orders of magnitude higher than that of contemporary electronic signal processing. This demonstration may serve to facilitate the development of ultrafast devices in PHz frequency.

  11. An experimental analysis of a doped lithium fluoride direct absorption solar receiver

    NASA Technical Reports Server (NTRS)

    Kesseli, James; Pollak, Tom; Lacy, Dovie

    1988-01-01

    An experimental analysis of two key elements of a direct absorption solar receiver for use with Brayton solar dynamic systems was conducted. Experimental data are presented on LiF crystals doped with dysprosium, samarium, and cobalt fluorides. In addition, a simulation of the cavity/window environment was performed and a posttest inspection was conducted to evaluate chemical reactivity, transmissivity, and condensation rate.

  12. An experimental analysis of a doped lithium fluoride direct absorption solar receiver

    NASA Technical Reports Server (NTRS)

    Kesseli, James; Pollak, Tom; Lacy, Dovie

    1988-01-01

    An experimental analysis of two key elements of a direct absorption solar receiver for use with Brayton solar dynamic systems was conducted. Experimental data are presented on LiF crystals doped with dysprosium, samarium, and cobalt fluorides. In addition, a simulation of the cavity/window environment was performed and a posttest inspection was conducted to evaluate chemical reactivity, transmissivity, and condensation rate.

  13. Solid-State Lithium Conductors for Lithium Metal Batteries Based on Electrospun Nanofiber/Plastic Crystal Composites.

    PubMed

    Zhou, Yundong; Wang, Xiaoen; Zhu, Haijin; Yoshizawa-Fujita, Masahiro; Miyachi, Yukari; Armand, Michel; Forsyth, Maria; Greene, George W; Pringle, Jennifer M; Howlett, Patrick C

    2017-08-10

    Organic ionic plastic crystals (OIPCs) are a class of solid-state electrolytes with good thermal stability, non-flammability, non-volatility, and good electrochemical stability. When prepared in a composite with electrospun polyvinylidene fluoride (PVdF) nanofibers, a 1:1 mixture of the OIPC N-ethyl-N-methylpyrrolidinium bis(fluorosulfonyl)imide ([C2 mpyr][FSI]) and lithium bis(fluorosulfonyl)imide (LiFSI) produced a free-standing, robust solid-state electrolyte. These high-concentration Li-containing electrolyte membranes had a transference number of 0.37(±0.02) and supported stable lithium symmetric-cell cycling at a current density of 0.13 mA cm(-2) . The effect of incorporating PVdF in the Li-containing plastic crystal was investigated for different ratios of PVdF and [Li][FSI]/[C2 mpyr][FSI]. In addition, Li|LiNi1/3 Co1/3 Mn1/3 O2 cells were prepared and cycled at ambient temperature and displayed a good rate performance and stability. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  14. Band structure and phonon properties of lithium fluoride at high pressure

    SciTech Connect

    Panchal, J. M.; Joshi, Mitesh; Gajjar, P. N.

    2016-05-23

    High pressure structural and electronic properties of Lithium Fluoride (LiF) have been studied by employing an ab-initio pseudopotential method and a linear response scheme within the density functional theory (DFT) in conjunction with quasi harmonic Debye model. The band structure and electronic density of states conforms that the LiF is stable and is having insulator behavior at ambient as well as at high pressure up to 1 Mbar. Conclusions based on Band structure, phonon dispersion and phonon density of states are outlined.

  15. X-ray refractive-index measurement in silicon and lithium fluoride

    NASA Astrophysics Data System (ADS)

    Deutsch, Moshe; Hart, Michael

    1984-07-01

    The refractive indices n of silicon and lithium fluoride were measured noninterferometrically with Mo Kα¯ and Ag Kα¯ x rays to a sub-part-per-billion accuracy. This high accuracy allows experimental determination of the real dispersion correction f' to +/-2 millielectron accuracy. The f' values obtained are in excellent agreement with the best interferometric measurements, part of which are less accurate than the present results. The predictions of both the Cromer-Liberman and the modified Hönl theories are found to deviate significantly from the measured f' values, thus indicating the need for modification of the wave functions or, more likely, the exchange potential used.

  16. Polyethylene-supported polyvinylidene fluoride-cellulose acetate butyrate blended polymer electrolyte for lithium ion battery

    NASA Astrophysics Data System (ADS)

    Liu, Jiansheng; Li, Weishan; Zuo, Xiaoxi; Liu, Shengqi; Li, Zhao

    2013-03-01

    The polyethylene (PE)-supported polymer membranes based on the blended polyvinylidene fluoride (PVDF) and cellulose acetate butyrate (CAB) are prepared for gel polymer electrolyte (GPE) of lithium ion battery. The performances of the prepared membranes and the resulting GPEs are investigated by scanning electron microscopy, electrochemical impedance spectroscopy, linear potential sweep, and charge-discharge test. The effect of the ratio of PVDF to CAB on the performance of the prepared membranes is considered. It is found that the GPE based on the blended polymer with PVDF:CAB = 2:1 (in weight) has the largest ionic conductivity (2.48 × 10-3 S cm-1) and shows good compatibility with anode and cathode of lithium ion battery. The LiCoO2/graphite battery using this GPE exhibits superior cyclic stability at room temperature, storage performance at elevated temperature, and rate performance.

  17. Polydopamine coated electrospun poly(vinyldiene fluoride) nanofibrous membrane as separator for lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Cao, Chengying; Tan, Lei; Liu, Weiwei; Ma, Jiquan; Li, Lei

    2014-02-01

    In this study, polydopamine (PDA) coated electrospun poly(vinyldiene fluoride) (PVDF) nanofibrous membranes used as separator for lithium-ion batteries are successfully prepared. Their morphology, chemical and electrochemical characterization are investigated. The morphology and porosity measurements of the membranes show that the PDA coating does not harm to the structure of the electrospun PVDF nanofibrous membranes. Due to the PDA coating, it makes the PVDF surface hydrophilic and thus increases the electrolyte uptake and ionic conductivity, resulting in the enhanced performance of batteries. The battery using the PDA coated PVDF nanofibrous separator exhibits better cycling performance and higher power capability than that the battery using the bare PVDF nanofibrous separator. This study underlines that the PDA-coating treatment provides a promising process for the fabrication of advanced electrospun nanofibers separator in the lithium-ion battery applications.

  18. Fluoride Inhibition of Enolase: Crystal Structure and Thermodynamics

    SciTech Connect

    Qin, Jie; Chai, Geqing; Brewer, John M.; Lovelace, Leslie L.; Lebioda, Lukasz

    2010-12-03

    Enolase is a dimeric metal-activated metalloenzyme which uses two magnesium ions per subunit: the strongly bound conformational ion and the catalytic ion that binds to the enzyme-substrate complex inducing catalysis. The crystal structure of the human neuronal enolase-Mg{sub 2}F{sub 2}P{sub i} complex (enolase fluoride/phosphate inhibitory complex, EFPIC) determined at 1.36 {angstrom} resolution shows that the combination of anions effectively mimics an intermediate state in catalysis. The phosphate ion binds in the same site as the phosphate group of the substrate/product, 2-phospho-d-glycerate/phosphoenolpyruvate, and induces binding of the catalytic Mg{sup 2+} ion. One fluoride ion bridges the structural and catalytic magnesium ions while the other interacts with the structural magnesium ion and the ammonio groups of Lys 342 and Lys 393. These fluoride ion positions correspond closely to the positions of the oxygen atoms of the substrate's carboxylate moiety. To relate structural changes resulting from fluoride, phosphate, and magnesium ions binding to those that are induced by phosphate and magnesium ions alone, we also determined the structure of the human neuronal enolase-Mg{sub 2}Pi complex (enolase phosphate inhibitory complex, EPIC) at 1.92 {angstrom} resolution. It shows the closed conformation in one subunit and a mixture of open and semiclosed conformations in the other. The EPFIC dimer is essentially symmetric while the EPIC dimer is asymmetric. Isothermal titration calorimetry data confirmed binding of four fluoride ions per dimer and yielded K{sub b} values of 7.5 x 10{sup 5} {+-} 1.3 x 10{sup 5}, 1.2 x 10{sup 5} {+-} 0.2 x 10{sup 5}, 8.6 x 10{sup 4} {+-} 1.6 x 10{sup 4}, and 1.6 x 10{sup 4} {+-} 0.7 x 10{sup 4} M{sup -1}. The different binding constants indicate negative cooperativity between the subunits; the asymmetry of EPIC supports such an interpretation.

  19. Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides.

    PubMed

    McMillen, Colin D; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D; Kolis, Joseph W

    2015-12-01

    The structural variations of several alkali metal rare earth fluoride single crystals are summarized. Two different stoichiometric formulations are considered, namely those of ARE2F7 and ARE3F10 (A = K, Rb, Cs; RE = Y, La-Lu), over a wide range of ionic radii of both the alkali and rare earth (RE) ions. Previously reported and several new single-crystal structures are considered. The new single crystals are grown using hydrothermal methods and the structures are compared with literature reports of structures grown from both melts and hydrothermal fluids. The data reported here are combined with the literature data to gain a greater understanding of structural subtleties surrounding these systems. The work underscores the importance of the size of the cations to the observed structure type and also introduces synthetic technique as a contributor to the same. New insights based on single-crystal structure analysis in the work introduce a new disordered structure type in the case of ARE2F7, and examine the trends and boundaries of the ARE3F10 stoichiometry. Such fundamental structural information is useful in understanding the potential applications of these compounds as optical materials.

  20. Improving Lithium Therapeutics by Crystal Engineering of Novel Ionic Cocrystals

    PubMed Central

    2013-01-01

    Current United States Food and Drug Administration (FDA)-approved lithium salts are plagued with a narrow therapeutic window. Recent attempts to find alternative drugs have identified new chemical entities, but lithium’s polypharmacological mechanisms for treating neuropsychiatric disorders are highly debated and are not yet matched. Thus, re-engineering current lithium solid forms in order to optimize performance represents a low cost and low risk approach to the desired therapeutic outcome. In this contribution, we employed a crystal engineering strategy to synthesize the first ionic cocrystals (ICCs) of lithium salts with organic anions. We are unaware of any previous studies that have assessed the biological efficacy of any ICCs, and encouragingly we found that the new speciation did not negatively affect established bioactivities of lithium. We also observed that lithium ICCs exhibit modulated pharmacokinetics compared to lithium carbonate. Indeed, the studies detailed herein represent an important advancement in a crystal engineering approach to a new generation of lithium therapeutics. PMID:24191685

  1. Grating coupler on single-crystal lithium niobate thin film

    NASA Astrophysics Data System (ADS)

    Chen, Zhihua; Wang, Yiwen; Jiang, Yunpeng; Kong, Ruirui; Hu, Hui

    2017-10-01

    The grating coupler on single-crystal lithium niobate thin film (lithium niobate on insulator, LNOI) was designed. A bottom reflector was added in the LNOI material to improve the coupling efficiency. The grating structure was optimized by FDTD method. The material parameters such as layer thickness of lithium niobate thin film, SiO2 thickness were discussed with respect to the coupling efficiency, and the tolerances of grating period, etch depth, groove width and fiber position were also studied systematically. The simulated maximum coupling efficiency from a grating coupler with (without) bottom reflector to a single-mode fiber is about 78% (40%) in z-cut LNOI for TE polarization.

  2. Effects of fluoride on the interactions between amelogenin and apatite crystals.

    PubMed

    Tanimoto, K; Le, T; Zhu, L; Chen, J; Featherstone, J D B; Li, W; DenBesten, P

    2008-01-01

    Fluorosed enamel is more porous and less mineralized, possibly related to altered amelogenin-modulated crystal growth. The purpose of this study was to examine the role of fluoride in interactions between amelogenin and apatite crystals. Recombinant human amelogenin (rh174) was bound to carbonated hydroxyapatite containing various amounts of fluoride, and analyzed by protein assay, SDS PAGE, and AFM. Interactions between rh174 and fluoride were assayed by isothermal titration calorimetry (ITC). The initial binding rate of rh174, as well as total amount of rh174 bound to fluoride-containing carbonated hydroxyapatite, was greater than that in the control carbonated hydroxyapatite. Fluoride in solution at physiologic (5.3 micromolar, or 0.1 ppm) concentrations showed no significant effect on binding, but higher fluoride levels significantly decreased protein binding. ITC showed no interactions between fluoride and rh174. These results suggest that fluoride incorporation into the crystal lattice alters the crystal surface to enhance amelogenin binding, with no direct interactions between fluoride and amelogenin.

  3. Fluoride crystals: materials for near-infrared solid state lasers

    NASA Astrophysics Data System (ADS)

    Parisi, Daniela; Veronesi, Stefano; Volpi, Azzurra; Gemmi, Mauro; Tonelli, Mauro; Cassanho, Arlete; Jenssen, Hans P.

    2013-07-01

    In this work we present an overview of the best 2μm laser results obtained in Tm-doped fluoride hosts LiYF4(YLF), LiLuF4 (LLF) and BaY2F8 (BYF) and we report on the growth, spectroscopy and first laser test emission of a novel mixed material BaYLuF8 (BYLF), interesting as a variant of BYF material with a partial substitution of Y3+ ions by Lu3+. The novel host is interesting mainly because indications are that the mixed crystal would be sturdier than BYF. The addition of Lutetium would improve the thermo-mechanical properties going into the direction of high power applications, as suggest from works on YLF and its isomorph LLF. A detailed description of Czochralski growth of fluoride laser materials is provided, focusing on the growth parameters of the novel BYLF:Tm3+12% material grown. With regard of spectroscopy analysis, we report on the results obtained with BYLF host. Detailed absorption, fluorescence and lifetime measurements have been performed focusing on the 3H4 and 3F4 manifolds, the pumping and upper laser level. Moreover diode pumped CW laser emission at 2 μm has been achieved in BYLF: Tm3+12% sample obtaining a slope efficiency of about 28% with respect to the absorbed power.

  4. Broadband X-ray edge-enhancement imaging of a boron fibre on lithium fluoride thin film detector

    NASA Astrophysics Data System (ADS)

    Nichelatti, E.; Bonfigli, F.; Vincenti, M. A.; Cecilia, A.; Vagovič, P.; Baumbach, T.; Montereali, R. M.

    2016-10-01

    The white beam (∼6-80 keV) available at the TopoTomo X-ray beamline of the ANKA synchrotron facility (KIT, Karlsruhe, Germany) was used to perform edge-enhancement imaging tests on lithium fluoride radiation detectors. The diffracted X-ray image of a microscopic boron fibre, consisting of tungsten wire wrapped by boron cladding, was projected onto lithium fluoride thin films placed at several distances, from contact to 1 m . X-ray photons cause the local formation of primary and aggregate colour centres in lithium fluoride; these latter, once illuminated under blue light, luminesce forming visible-light patterns-acquired by a confocal laser scanning microscope-that reproduce the intensity of the X-ray diffracted images. The tests demonstrated the excellent performances of lithium fluoride films as radiation detectors at the investigated photon energies. The experimental results are here discussed and compared with those calculated with a model that takes into account all the processes that concern image formation, storing and readout.

  5. Nucleation kinetics, crystal growth and optical studies on lithium hydrogen oxalate monohydrate single crystal

    NASA Astrophysics Data System (ADS)

    Chandran, Senthilkumar; Paulraj, Rajesh; Ramasamy, P.

    2017-06-01

    Semi-organic lithium hydrogen oxalate monohydrate non-linear optical single crystals have been grown by slow evaporation solution technique at 40 °C. The nucleation parameters such as critical radius, interfacial tension, and critical free energy change have been evaluated using the experimental data. The solubility and the nucleation curve of the crystal at different temperatures have been analyzed. The crystal has a positive temperature coefficient of solubility. The metastable zone width and induction period have been determined for the aqueous solution growth of lithium hydrogen oxalate monohydrate. The UV-vis-NIR spectrum showed this crystal has high transparency. The photoconductivity studies indicate lithium hydrogen oxalate monohydrate has positive photoconductivity behaviour. The low etch pit density observed on (0 0 1) crystal surface and the high resolution x-ray difraction analysis indicate the good quality of the grown crystals

  6. Conversion Reaction Mechanisms in Lithium Ion Batteries: Study of the Binary Metal Fluoride Electrodes

    SciTech Connect

    Wang, Feng; Robert, Rosa; Chernova, Natasha A.; Pereira, Nathalie; Omenya, Fredrick; Badway, Fadwa; Hua, Xiao; Ruotolo, Michael; Zhang, Ruigang; Wu, Lijun; Volkov, Vyacheslav; Su, Dong; Key, Baris; Whittingham, M. Stanley; Grey, Clare P.; Amatucci, Glenn G.; Zhu, Yimei; Graetz, Jason

    2015-10-15

    Materials that undergo a conversion reaction with lithium (e.g., metal fluorides MF{sub 2}: M = Fe, Cu, ...) often accommodate more than one Li atom per transition-metal cation, and are promising candidates for high-capacity cathodes for lithium ion batteries. However, little is known about the mechanisms involved in the conversion process, the origins of the large polarization during electrochemical cycling, and why some materials are reversible (e.g., FeF{sub 2}) while others are not (e.g., CuF{sub 2}). In this study, we investigated the conversion reaction of binary metal fluorides, FeF{sub 2} and CuF{sub 2}, using a series of local and bulk probes to better understand the mechanisms underlying their contrasting electrochemical behavior. X-ray pair-distribution-function and magnetization measurements were used to determine changes in short-range ordering, particle size and microstructure, while high-resolution transmission electron microscopy (TEM) and electron energy-loss spectroscopy (EELS) were used to measure the atomic-level structure of individual particles and map the phase distribution in the initial and fully lithiated electrodes. Both FeF{sub 2} and CuF{sub 2} react with lithium via a direct conversion process with no intercalation step, but there are differences in the conversion process and final phase distribution. During the reaction of Li{sup +} with FeF{sub 2}, small metallic iron nanoparticles (<5 nm in diameter) nucleate in close proximity to the converted LiF phase, as a result of the low diffusivity of iron. The iron nanoparticles are interconnected and form a bicontinuous network, which provides a pathway for local electron transport through the insulating LiF phase. In addition, the massive interface formed between nanoscale solid phases provides a pathway for ionic transport during the conversion process. These results offer the first experimental evidence explaining the origins of the high lithium reversibility in FeF{sub 2}. In contrast

  7. Effect of Copper Oxide, Titanium Dioxide, and Lithium Fluoride on the Thermal Behavior and Decomposition Kinetics of Ammonium Nitrate

    NASA Astrophysics Data System (ADS)

    Vargeese, Anuj A.; Mija, S. J.; Muralidharan, Krishnamurthi

    2014-07-01

    Ammonium nitrate (AN) is crystallized along with copper oxide, titanium dioxide, and lithium fluoride. Thermal kinetic constants for the decomposition reaction of the samples were calculated by model-free (Friedman's differential and Vyzovkins nonlinear integral) and model-fitting (Coats-Redfern) methods. To determine the decomposition mechanisms, 12 solid-state mechanisms were tested using the Coats-Redfern method. The results of the Coats-Redfern method show that the decomposition mechanism for all samples is the contracting cylinder mechanism. The phase behavior of the obtained samples was evaluated by differential scanning calorimetry (DSC), and structural properties were determined by X-ray powder diffraction (XRPD). The results indicate that copper oxide modifies the phase transition behavior and can catalyze AN decomposition, whereas LiF inhibits AN decomposition, and TiO2 shows no influence on the rate of decomposition. Possible explanations for these results are discussed. Supplementary materials are available for this article. Go to the publisher's online edition of the Journal of Energetic Materials to view the free supplemental file.

  8. Building an Electronic Bridge via Ag Decoration To Enhance Kinetics of Iron Fluoride Cathode in Lithium-Ion Batteries.

    PubMed

    Li, Yu; Zhou, Xingzhen; Bai, Ying; Chen, Guanghai; Wang, Zhaohua; Li, Hui; Wu, Feng; Wu, Chuan

    2017-06-14

    As a typical multielectron cathode material for lithium-ion batteries, iron fluoride (FeF3) and its analogues suffer from poor electronic conductivity and low actual specific capacity. Herein, we introduce Ag nanoparticles by silver mirror reaction into the FeF3·0.33H2O cathode to build the electronic bridge between the solid (active materials) and liquid (electrolyte) interface. The crystal structures of as-prepared samples are characterized by X-ray diffraction and Rietveld refinement. Moreover, the density of states of FeF3·0.33H2O and FeF3·0.33H2O/Ag (Ag-decorated FeF3·0.33H2O) samples are calculated using the first principle density functional theory. The FeF3·0.33H2O/Ag cathodes exhibit significant enhancements on the electrochemical performance in terms of the cycle performance and rate capability, especially for the Ag-decorated amount of 5%. It achieves an initial capacity of 168.2 mA h g(-1) and retains a discharge capacity of 128.4 mA h g(-1) after 50 cycles in the voltage range of 2.0-4.5 V. It demonstrates that Ag decoration can reduce the band gap, improve electronic conductivity, and elevate intercalation/deintercalation kinetics.

  9. New UV instrumentation enabled by enhanced broadband reflectivity lithium fluoride coatings

    NASA Astrophysics Data System (ADS)

    Fleming, Brian T.; Quijada, Manuel A.; France, Kevin; Hoadley, Keri; Del Hoyo, Javier; Kruczek, Nicholas

    2015-08-01

    We present the results of a preliminary aging study of new enhanced broadband reflectivity lithium fluoride mirror coatings under development at the thin films laboratory at GSFC. These coatings have demonstrated greater than 80% reflectivity from the Lyman ultraviolet (~1020 Å) to the optical, and have the potential to revolutionize far-ultraviolet instrument design and capabilities. This work is part of a concept study in preparation for the fight qualification of these new coatings in a working astronomical environment. We outline the goals for TRL advancement, and discuss the instrument capabilities enabled by these high reflectivity broadband coatings on potential future space missions. We also present the early design of the first space experiment to utilize these coatings, the proposed University of Colorado sounding rocket payload SISTINE, and show how these new coatings make the science goals of SISTINE attainable on a suborbital platform.

  10. Organic photovoltaic devices with the bilayer cathode interfacial structure of pyromellitic dianhydride and lithium fluoride

    NASA Astrophysics Data System (ADS)

    Nam, Eunkyoung; Oh, Seungsik; Jung, Donggeun; Kim, Hyoungsub; Chae, Heeyeop; Yi, Junsin

    2012-10-01

    In this study, we fabricated and characterized an organic photovoltaic (OPV) device with a pyromellitic dianhydride (PMDA)/lithium fluoride (LiF) cathode interfacial layer between poly(3-hexylthiophene-2,5-diyl)(P3HT)+[6,6]-phenyl C61 butyric acid methyl ester (PCBM) and Al. Compared to the OPV device with a LiF-only cathode interfacial layer having a power conversion efficiency (PCE) of 2.7%, the OPV device with the bilayer cathode interfacial structure [PMDA (0.3 nm)/LiF (0.7 nm)] exhibited a reduced resistance and a PCE value enhanced to 3.9% under an illumination condition of 100 mW cm-2 (AM1.5). The observed improvement of the OPV characteristics was attributed to the reduced leakage current of the device by the bilayer cathode interfacial layer.

  11. Alternating Current Driven Organic Light Emitting Diodes Using Lithium Fluoride Insulating Layers

    PubMed Central

    Liu, Shang-Yi; Chang, Jung-Hung; -Wen Wu, I.; Wu, Chih-I

    2014-01-01

    We demonstrate an alternating current (AC)-driven organic light emitting diodes (OLED) with lithium fluoride (LiF) insulating layers fabricated using simple thermal evaporation. Thermal evaporated LiF provides high stability and excellent capacitance for insulating layers in AC devices. The device requires a relatively low turn-on voltage of 7.1 V with maximum luminance of 87 cd/m2 obtained at 10 kHz and 15 Vrms. Ultraviolet photoemission spectroscopy and inverse photoemission spectroscopy are employed simultaneously to examine the electronic band structure of the materials in AC-driven OLED and to elucidate the operating mechanism, optical properties and electrical characteristics. The time-resolved luminance is also used to verify the device performance when driven by AC voltage. PMID:25523436

  12. Precise, reproducible nano-domain engineering in lithium niobate crystals

    SciTech Connect

    Boes, Andreas Sivan, Vijay; Ren, Guanghui; Yudistira, Didit; Mitchell, Arnan; Mailis, Sakellaris; Soergel, Elisabeth

    2015-07-13

    We present a technique for domain engineering the surface of lithium niobate crystals with features as small as 100 nm. A film of chromium (Cr) is deposited on the lithium niobate surface and patterned using electron beam lithography and lift-off and then irradiated with a wide diameter beam of intense visible laser light. The regions patterned with chromium are domain inverted while the uncoated regions are not affected by the irradiation. With the ability to realize nanoscale surface domains, this technique could offer an avenue for fabrication of nano-photonic and phononic devices.

  13. Zr doping on lithium niobate crystals: Raman spectroscopy and chemometrics

    NASA Astrophysics Data System (ADS)

    Kokanyan, Ninel; Chapron, David; Kokanyan, Edvard; Fontana, Marc D.

    2017-03-01

    Raman measurements were investigated on Zr-doped lithium niobate LiNbO3 crystals with different concentrations. Spectra were treated by fitting procedure and principal component analysis which both provide results consistent with each other. The concentration dependence of the frequency on the main low-frequency optical phonons provides an insight of site incorporation of Zr ions in the host lattice. The threshold concentration of about 2% is evidenced, confirming the interest of Zr doping as an alternative to Mg doping for the reduction of the optical damage in lithium niobate.

  14. Crystal structures of a double-barrelled fluoride ion channel

    PubMed Central

    Stockbridge, Randy B.; Kolmakova-Partensky, Ludmila; Shane, Tania; Koide, Akiko; Koide, Shohei; Miller, Christopher; Newstead, Simon

    2016-01-01

    To contend with hazards posed by environmental fluoride, microorganisms export this anion through F--specific ion channels of the Fluc family1–4. Since the recent discovery of Fluc channels, numerous idiosyncratic features of these proteins have been unearthed, including extreme selectivity for F- over Cl- and dual-topology dimeric assembly5–6. To understand the chemical basis for F- permeation and how the antiparallel subunits convene to form a F--selective pore, we solved crystal structures of two bacterial Fluc homologues in complex with three different monobody inhibitors, with and without F- present, to a maximum resolution of 2.1 Å. The structures reveal a surprising “double-barrelled” channel architecture in which two F- ion pathways span the membrane and the dual-topology arrangement includes a centrally coordinated cation, most likely Na+. F- selectivity is proposed to arise from the very narrow pores and an unusual anion coordination that exploits the quadrupolar edges of conserved phenylalanine rings. PMID:26344196

  15. Lithium niobate single-crystal and photo-functional device

    DOEpatents

    Gopalan, Venkatraman; Mitchell, Terrence E.; Kitamura, Kenji; Furukawa, Yasunori

    2001-01-01

    Provided are lithium niobate single-crystal that requires a low voltage of not larger than 10 kV/nm for its ferroelectric polarization inversion and of which the polarization can be periodically inverted with accuracy even at such a low voltage, and a photo-functional device comprising the crystal. The crystal has a molar fraction of Li.sub.2 O/(Nb.sub.2 O.sub.5 +Li.sub.2 O) of falling between 0.49 and 0.52. The photo-functional device can convert a laser ray being incident thereon.

  16. Conformal Lithium Fluoride Protection Layer on Three-Dimensional Lithium by Nonhazardous Gaseous Reagent Freon.

    PubMed

    Lin, Dingchang; Liu, Yayuan; Chen, Wei; Zhou, Guangmin; Liu, Kai; Dunn, Bruce; Cui, Yi

    2017-06-14

    Research on lithium (Li) metal chemistry has been rapidly gaining momentum nowadays not only because of the appealing high theoretical capacity, but also its indispensable role in the next-generation Li-S and Li-air batteries. However, two root problems of Li metal, namely high reactivity and infinite relative volume change during cycling, bring about numerous other challenges that impede its practical applications. In the past, extensive studies have targeted these two root causes by either improving interfacial stability or constructing a stable host. However, efficient surface passivation on three-dimensional (3D) Li is still absent. Here, we develop a conformal LiF coating technique on Li surface with commercial Freon R134a as the reagent. In contrast to solid/liquid reagents, gaseous Freon exhibits not only nontoxicity and well-controlled reactivity, but also much better permeability that enables a uniform LiF coating even on 3D Li. By applying a LiF coating onto 3D layered Li-reduced graphene oxide (Li-rGO) electrodes, highly reduced side reactions and enhanced cycling stability without overpotential augment for over 200 cycles were proven in symmetric cells. Furthermore, Li-S cells with LiF protected Li-rGO exhibit significantly improved cyclability and Coulombic efficiency, while excellent rate capability (∼800 mAh g(-1) at 2 C) can still be retained.

  17. Polyelectrolyte effects on the crystallization phenomena of the lithium carbonate

    NASA Astrophysics Data System (ADS)

    Watamura, Hiroto; Marukawa, Hironobu; Hirasawa, Izumi

    2013-06-01

    Anionic polyelectrolyte effects on the lithium carbonate crystallization phenomena were investigated. Li2CO3 crystals were obtained by reactive crystallization with seed crystals. Polyelectrolytes were dissolved into the reactive field before the reaction. Obtained crystals were observed with scanning electron microscopy (SEM) and crystal size and agglomeration degree were measured by the SEM images. The results show that Li2CO3 crystallized different shape and size from absence of polyelectrolyte in those reactive fields. Especially polyacrylic acid (PAA) improved on the agglomeration of the crystals and shaped them high aspect needles. Thus other experimental conditions including PAA molecular weight and concentration, reaction time, supersaturation by Li concentration were investigated in addition. As a result, obtained crystals were not different in each PAA molecular weight reactive fields. Meanwhile PAA concentration has optimum range. Li2CO3 formed less agglomeration and higher aspect around 1 g/l. In the concentration, Li2CO3 did not agglomerate regardless of aging time and Li concentration. Moreover crystals became rectangle shape in higher Li concentration.(020) face intensity of the rectangle shape crystals increased according to XRD pattern. PAA affected the facial growth. These results may provide a method of morphological change and clearly crystallization of Li2CO3.

  18. Mode locking and Q switching of a diode laser pumped neodymium-doped yttrium lithium fluoride laser

    SciTech Connect

    Maker, G.T.; Ferguson, A.I.

    1989-01-30

    We have developed a mode-locked, diode pumped, neodymium-doped yttrium lithium fluoride (Nd:YLF) laser operating at 1.053 ..mu..m. The laser produces pulses of 18 ps duration at an average power level of 12 mW. When Q switched the duration of the pulse train was 140 ns, giving rise to peak powers of 15 kW.

  19. Note: Accuracy of velocity correction for impact of a laser-accelerated miniature flyer with lithium fluoride shock-compressed along the [100] axis

    SciTech Connect

    Wakabayashi, Kunihiko; Matsumura, Tomoharu; Nakayama, Yoshio; Koshi, Mitsuo

    2011-02-15

    We performed miniature flyer impact experiments to investigate the relationship between the apparent (u{sub a}) and actual (u{sub A}) particle velocities measured by a velocity interferometer in single-crystal lithium fluoride (LiF) that was shock-compressed along the [100] axis. The miniature flyer was accelerated to velocities in the range 652.5-1937.6 m/s by a tabletop pulsed laser. An empirical relationship of u{sub a}= (1.2749 {+-} 0.0102)u{sub A} was obtained. The obtained relationship agreed well with the results of a previous study within the experimental errors and its uncertainty was less than {+-}1%. This result indicates that the present experimental technique is effective for measuring the relationship between u{sub a} and u{sub A} of shocked transparent materials with a comparable accuracy to conventional methods.

  20. Optical properties of lithium fluoride fibers grown by micro-pulling-down method

    NASA Astrophysics Data System (ADS)

    Santo, A. M. E.; Courrol, L. C.; Ranieri, I. M.; Wetter, N. U.; Vieira, N. D.; Baldochi, S. L.

    2004-12-01

    Fluoride single-crystalline fibers were grown by the micro-pulling-down (μ-PD) technique. The optical properties of the LiF fiber and the bulk crystal (grown by Czochralski technique) were compared. Both samples were irradiated with 40 Mrad of gamma rays at room temperature and color centers were successfully produced. The emission spectra of the fiber and the bulk crystal when excited at 447 nm show the typical broad emission bands related to the F3+ and F2 centers, with peaks at 535 and 650 nm, respectively. Both spectra contain a very strong emission band centered at 1120 nm with the same half width of 1350 cm-1 when excited with a InGaAs diode laser at 968 nm. These results indicate a potential use of these new LiF fibers in miniaturized active optical devices.

  1. Origin of electronic transport of lithium phthalocyanine iodine crystal

    SciTech Connect

    Koike, Noritake; Oda, Masato; Shinozuka, Yuzo

    2013-12-04

    The electronic structures of Lithium Phthalocyanine Iodine are investigated using density functional theory. Comparing the band structures of several model crystals, the metallic conductivity of highly doped LiPcI{sub x} can be explained by the band of doped iodine. These results reveal that there is a new mechanism for electronic transport of doped organic semiconductors that the dopant band plays the main role.

  2. Lithium-fluoride flashover ion source cleaned with a glow discharge and irradiated with vacuum-ultraviolet radiation

    SciTech Connect

    Burns, E.J.T.; Woodworth, J.R.; Bieg, K.W.; Mehlhorn, T.A.; Stygar, W.A.; Sweeney, M.A.

    1988-01-01

    We have studied methods of varying the ion species generated by a lithium-fluoride overcoated anode in a 0.5-MV magnetically insulated ion diode. We found that cleaning the anode surface with a 13.6-MHz rf glow discharge or illuminating the anode with a pulsed soft x-ray, vacuum-ultraviolet (XUV) radiation source just before the accelerator pulse significantly altered the ion species of the ion beam produced by the diode. The glow-discharge plasma removed adsorbates (carbon, hydrogen, and oxygen) from the surface of the LiF flashover source. The ions seen were lithium and hydrogen. Unfortunately, the diode impedance with a lithium-fluoride anode was high and the ion efficiency was low; however, XUV irradiation of the surface dramatically lowered the impedance by desorbing neutrals from the ion source via photon-stimulated desorption. Current densities of ten times the Child--Langmuir space-charge limit were achieved under XUV irradiation. In particular, ion currents increased by over a factor of 3 when 12 mJ/cm/sup 2/ of XUV radiation was used. However, with XUV irradiation the largest fraction of ions were fluorine, oxygen, carbon, and hydrogen, not lithium.

  3. Electrospun montmorillonite modified poly(vinylidene fluoride) nanocomposite separators for lithium-ion batteries

    SciTech Connect

    Fang, Changjiang; Yang, Shuli; Zhao, Xinfei; Du, Pingfan; Xiong, Jie

    2016-07-15

    Highlights: • Composite separators of PVDF and MMT for lithium-ion batteries were electrospun. • Thermal dimensional stability and tensile property of composite separators get improved. • Presence of montmorillonite promotes electrical properties of PVDF fibrous separators. • Batteries consisting of PVDF/MMT-5% separator achieve the best performance. - Abstract: Composite separators of poly(vinylidene fluoride) (PVDF) with different contents of montmorillonite (MMT) for Li-ion batteries have been fabricated by electrospinning. The morphology, function group, crystallinity, and mechanical properties of membranes were investigated by scanning electron microscope (SEM), Fourier Transform infrared spectra (FT-IR), differential scanning calorimetry (DSC), and tensile test, respectively. Interlayer spacing of MMT in polymer was characterized by X-ray diffraction (XRD). In addition, the results of electrochemical measurements suggest that PVDF/MMT-5% composite membrane has maximum ionic conductivity of 4.2 mS cm{sup −1}, minimum interfacial resistance of 97 Ω, and excellent electrochemical stability. The cell comprising PVDF/MMT-5% composite membrane shows higher capacity and more stable cycle performance than the one using commercial Celgard PP membrane.

  4. Determining the refractive index of shocked [100] lithium fluoride to the limit of transmissibility

    NASA Astrophysics Data System (ADS)

    Rigg, P. A.; Knudson, M. D.; Scharff, R. J.; Hixson, R. S.

    2014-07-01

    Lithium fluoride (LiF) is a common window material used in shock- and ramp-compression experiments because it displays a host of positive attributes in these applications. Most commonly, it is used to maintain stress at an interface and velocimetry techniques are used to record the particle velocity at that interface. In this application, LiF remains transparent to stresses up to 200 GPa. In this stress range, LiF has an elastic-plastic response with a very low (<0.5 GPa) elastic precursor and exhibits no known solid-solid phase transformations. However, because the density dependence of the refractive index of LiF does not follow the Gladstone-Dale relation, the measured particle velocity at this interface is not the true particle velocity and must be corrected. For that reason, the measured velocity is often referred to as the apparent velocity in these types of experiments. In this article, we describe a series of shock-compression experiments that have been performed to determine the refractive index of LiF at the two most commonly used wavelengths (532 nm and 1550 nm) between 35 and 200 GPa to high precision. A modified form of the Gladstone-Dale relation was found to work best to fit the determined values of refractive index. In addition, we provide a direct relationship between the apparent and true particle velocity to correct experimentally obtained wave profiles by others using these velocimetry techniques.

  5. Liquid crystal deposition on poled, single crystalline lithium niobate

    NASA Astrophysics Data System (ADS)

    Bharath, S. C.; Pimputkar, K. R.; Pronschinske, A. M.; Pearl, T. P.

    2008-01-01

    For the purpose of elucidating the mechanisms for molecular organization at poled ferroelectric surfaces, single crystalline lithium niobate (LN), 'Z-cut' along the (0 0 0 1) plane, has been prepared and characterized and subsequently exposed to liquid crystal molecules. As a model system we chose to study the anchoring of 4- n-octyl-4'-cyanobiphenyl (8CB) to LN. Liquid crystalline films are of interest because of their useful electronic and optical properties as well as chemical sensing attributes. Low-energy electron diffraction (LEED), atomic force microscopy (AFM), surface contact angle measurements (CA), and X-ray photoelectron spectroscopy (XPS) were used to characterize the surface of lithium niobate as well as the nature of 8CB films grown on the surface. Atomically flat LN surfaces were prepared as a support for monolayer thick, 8CB molecular domains. 8CB liquid crystal molecules were deposited by an ambient vaporization technique and the films were analyzed using XPS and CA. Understanding electrostatic anchoring mechanisms and thin film organization for this molecule on uniformly poled surfaces allows for a fuller appreciation of how molecular deposition of other polarizable molecules on periodically poled and patterned poled lithium niobate surfaces would occur.

  6. Crystal Structures of Diaryliodonium Fluorides and their Implications for Fluorination Mechanisms.

    PubMed

    Lee, Yong Sok; Chun, Joong-Hyun; Hodošček, Milan; Pike, Victor

    2017-01-31

    The radiofluorination of diaryliodonium salts is of value for producing radiotracers for positron emission tomography. We report crystal structures for two diaryliodonium fluorides. Whereas diphenyliodon um fluoride (1a) exists as a tetramer bridged by four fluoride ions, 2-methylphenyl(phenyl)iodonium fluoride (2a) forms a fluoride-bridged dimer that is further halogen-bonded to two other monomers. We discuss the topological relationships between the two and their implications for fluorination in solution. Both radiofluorination and NMR spectroscopy show that thermolysis of 2a gives 2-fluorotoluene and fluorobenzene in a 2 to 1 ratio that is in good agreement with the ratio observed from the radiofluorination of 2-methylphenyl(phenyl)iodonium chloride (2b). The constancy of the product ratio affirms that the fluorinations occur via the same two rapidly interconverting transition states whose energy difference dictates chemoselectivity. The quantum chemical studies with density functional theory at the level of B3LYP/DGDZVP provide deeper insight into the role of 'ortho effect' in the mechanism of fluorination. By utilizing the crystal structures of 1a and 2a, the mechanisms of fluoroarene formation from diaryliodonium fluorides in their monomeric, homodimeric, heterodimeric, and tetrameric states were also investigated. According to this analysis, we propose that oligomerization energy dictates whether the fluorination occurs through a monomeric or an oligomeric pathway.

  7. A EPR Investigation of Atomic Silver and Divalent Silver in Irradiated Single Crystal of Potassium Fluoride Doped with Silver Fluoride

    NASA Astrophysics Data System (ADS)

    Yu, Cheng

    The electron paramagnetic resonance absorption spectra of a singly ionized diatomic fluoride molecule -ion F_2^-, atomic silver Ag^0 and divalent silver Ag ^{2+} contained in single crystals of potassium fluoride have been re-examined at X-band wavelengths. The F_2^- and Ag^0 centers are produced simultaneously by gamma-irradiation at liquid nitrogen temperature. The divalent silver Ag^{2+} centers are formed by subsequently warming the irradiated samples to room temperature for a few hours and then cooling to 77 K. All field strength positions of resonance absorption lines observed at low temperatures have been satisfactorily predicted by computer simulation. The high degree of resolution exhibited by the spectra is due in part to the large nuclear magnetic moment of fluorine and in part to the fact that spectral lines in KF are narrow compared to those of similar systems in other alkali halide crystals. For an atomic silver, the hexafluoride cluster is cubic. By contrast, the divalent silver center is tetragonally distorted along a crystal cube edge as a consequence of the Jahn-Teller effect. Unexpected splittings of the central lines in the resonance absorption spectrum of divalent silver are observed and interpreted as being due to second order perturbation effects.

  8. Origins of Large Voltage Hysteresis in High-Energy-Density Metal Fluoride Lithium-Ion Battery Conversion Electrodes.

    PubMed

    Li, Linsen; Jacobs, Ryan; Gao, Peng; Gan, Liyang; Wang, Feng; Morgan, Dane; Jin, Song

    2016-03-02

    Metal fluorides and oxides can store multiple lithium ions through conversion chemistry to enable high-energy-density lithium-ion batteries. However, their practical applications have been hindered by an unusually large voltage hysteresis between charge and discharge voltage profiles and the consequent low-energy efficiency (<80%). The physical origins of such hysteresis are rarely studied and poorly understood. Here we employ in situ X-ray absorption spectroscopy, transmission electron microscopy, density functional theory calculations, and galvanostatic intermittent titration technique to first correlate the voltage profile of iron fluoride (FeF3), a representative conversion electrode material, with evolution and spatial distribution of intermediate phases in the electrode. The results reveal that, contrary to conventional belief, the phase evolution in the electrode is symmetrical during discharge and charge. However, the spatial evolution of the electrochemically active phases, which is controlled by reaction kinetics, is different. We further propose that the voltage hysteresis in the FeF3 electrode is kinetic in nature. It is the result of ohmic voltage drop, reaction overpotential, and different spatial distributions of electrochemically active phases (i.e., compositional inhomogeneity). Therefore, the large hysteresis can be expected to be mitigated by rational design and optimization of material microstructure and electrode architecture to improve the energy efficiency of lithium-ion batteries based on conversion chemistry.

  9. Fluoride incorporation into apatite crystals delays amelogenin hydrolysis

    PubMed Central

    DenBesten, Pamela; Zhu, Li; Li, Wu; Tanimoto, Kotaro; Liu, Haichuan; Witkowska, Halina Ewa

    2012-01-01

    Enamel fluorosis has been related to an increase in the amount of amelogenin in fluorosed enamel as compared to normal enamel in the maturation stage. In this study we tested the hypothesis that fluoride incorporated into carbonated apatite alters amelogenin hydrolysis. Recombinant human amelogenin (rh174) was allowed to bind to 0.15 mg of carbonated hydroxyapatite (CAP) or fluoride-containing carbonated hydroxyapatite (F-CAP) synthesized to contain 100, 1000 or 4000 ppm F-. After 3 h digestion with recombinant human MMP20 or KLK4, bound protein was characterized by reverse-phase HPLC. Proteolytic fragments formed after 24 h digestion of amelogenin, were identified by LC tandem mass spectrometry (LCMS/MS). The hydrolysis of amelogenin bound to F100-CAP by both MMP20 and KLK4 was significantly reduced in a dose dependent manner as compared to CAP. After 24 h hydrolysis, the number of cleavage sites in bound amelogenin by MMP20 were similar in CAP and F100-CAP, whereas there were 24 fewer cleavage sites identified for the KLK4 hydrolysis on F100-CAP as compared to CAP. These results suggest that the reduced hydrolysis of amelogenins in fluorosed enamel may be partially due to the increased fluoride content in fluoride containing apatite, contributing to the hypomineralized enamel matrix phenotype observed in fluorosed enamel. PMID:22243219

  10. Enhancement of photorefractive sensitivity in indium-doped lithium niobate crystal

    NASA Astrophysics Data System (ADS)

    Qiao, Haijun; Xu, Jingjun; Wu, Qiang; Yu, Xuanyi; Zhang, Xinzheng; Zhang, Guangyin

    2002-09-01

    The photorefractive effect in Indium-doped litium niobate crystal was studied. We found that the enhanced photorefractive sensitivity could be realized in the so-called photorefractive resistance lithium niobate crystals, even higher than the well-known iron doped ones. We explained the unusual qualitatively. The experimental result enriches us the knowledge of the properties of doped lithium niobate crystals and provides some advice in growing specific crystal.

  11. Effect of chloride incorporation on the crystallization of zirconium-barium-lanthanum-aluminum fluoride glass

    NASA Technical Reports Server (NTRS)

    Neilson, G. F.; Smith, G. L.; Weinberg, M. C.

    1985-01-01

    One aspect of the influence of preparation procedure on the crystallization behavior of a zirconium-barium-lanthanum-aluminum fluoride glass was studied. The crystallization pattern of this glass may be affected by the chlorine concentration within it. In particular, when such glasses are heated at low temperatures, the alpha-Ba-Zr-F6 crystalline phase forms only in those glasses which contain chloride.

  12. Effect of chloride incorporation on the crystallization of zirconium-barium-lanthanum-aluminum fluoride glass

    NASA Technical Reports Server (NTRS)

    Neilson, G. F.; Smith, G. L.; Weinberg, M. C.

    1985-01-01

    One aspect of the influence of preparation procedure on the crystallization behavior of a zirconium-barium-lanthanum-aluminum fluoride glass was studied. The crystallization pattern of this glass may be affected by the chlorine concentration within it. In particular, when such glasses are heated at low temperatures, the alpha-Ba-Zr-F6 crystalline phase forms only in those glasses which contain chloride.

  13. Fluoride incorporation into apatite crystals delays amelogenin hydrolysis.

    PubMed

    DenBesten, Pamela K; Zhu, Li; Li, Wu; Tanimoto, Kotaro; Liu, Haichuan; Witkowska, Halina E

    2011-12-01

    Enamel fluorosis has been related to an increase in the amount of amelogenin in fluorosed enamel compared with normal enamel in the maturation stage. In this study we tested the hypothesis that fluoride incorporated into carbonated apatite alters amelogenin hydrolysis. Recombinant human amelogenin (rh174) was allowed to bind to 0.15 mg of carbonated hydroxyapatite (CAP) or to fluoride-containing carbonated hydroxyapatite (F-CAP) synthesized to contain 100, 1,000, or 4,000 ppm F(-). After 3 h of digestion with recombinant human matrix metalloproteinase 20 (MMP20) or kallikrein-related peptidase 4 (KLK4), bound protein was characterized by reverse-phase high-performance liquid chromatography (HPLC). Proteolytic fragments of amelogenin formed after 24h of digestion with MMP20 of KLK 4 were identified by liquid chromatography-tandem mass spectrometry (LC-MS/MS). The hydrolysis, by both MMP20 and KLK4, of amelogenin bound to F100-CAP was significantly reduced in a dose-dependent manner compared with the hydrolysis of amelogenin bound to CAP. After 24 h of hydrolysis, a similar number of MMP20 cleavage sites was found for amelogenin bound to CAP and amelogenin bound to F100-CAP; however, 24 fewer KLK4 cleavage sites were identified for amelogenin bound to F100-CAP than for amelogenin bound to CAP. These results suggest that the reduced hydrolysis of amelogenins in fluorosed enamel may be partially caused by the increased fluoride content in fluoride-containing apatite, contributing to the hypomineralized enamel matrix phenotype observed in fluorosed enamel.

  14. Generation of ionizing radiation from lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Orlikov, L. N.; Orlikov, N. L.; Arestov, S. I.; Mambetova, K. M.; Shandarov, S. M.

    2017-01-01

    The work done experimentally explores generation of electron and x-ray radiation in the process of heating and cooling monolithic and iron-doped crystals of lithium niobate. Iron doping to the concentrations in the range of 1023 m3 was carried out by adding ferric oxide into the melt during the process of crystal growth. The research into radiation generation was performed at 1-10 Pa. The speed of heating from -10 to 1070 C was 10-20 degrees a minute. Current pulses appeared at 17, 38, 56, 94, 98, 100, 105, 106, 1070 C with the interval of 1-3 minutes. The obtained electron current increased in direct proportion to the crystal surface area. The maximum current was 3mA at the design voltage 11 kV on the crystal with 14,5x10,5x10 mm3 surface area. The article describes the possibility to control the start of generation by introducing priming pulse. The results achieved are explained by the domain repolarization while heating the crystal and the appearance of electric field local strength. Bias and overcharge currents contribute to the appearance of electric strength, which stimulates breakdown and plasma formation. X-ray radiation appears both at the stage of discharge formation and during electron deceleration on gas and target material.

  15. Growth of lithium triborate crystals. II. Experimental results

    NASA Astrophysics Data System (ADS)

    Parfeniuk, C.; Samarasekera, I. V.; Weinberg, F.; Edel, J.; Fjeldsted, K.; Lent, B.

    1996-02-01

    In Part I [C. Parfeniuk, I.V. Samarasekera and F. Weinberg, J. Crystal Growth 158 (1996) 514], a mathematical model of the flux growth of lithium triborate (LBO) crystals was used to calculate the temperature distribution and fluid flow in the melt during growth. In this report the model results are related to experimental observations. Temperature measurements in the melt, for different crucible rotation rates, are compared to the corresponding temperatures determined from the model. Direct observations of fluid flow in the melt, using a transparent glycerol/water solution as a physical model, are related to the calculated flow paths and velocities. As the LBO crystal grows, the rejected MoO 3 flux concentrates ahead of the interface leading to the formation of eutectic phases. The factors leading to the formation of these phases are examined, using flow velocity values determined from the model. A number of LBO crystals were grown, first using convenient growth parameters, and then using parameters determined from the model results. The size and quality of the crystals obtained are discussed and related to the growth conditions.

  16. Divalent fluoride doped cerium fluoride scintillator

    DOEpatents

    Anderson, David F.; Sparrow, Robert W.

    1991-01-01

    The use of divalent fluoride dopants in scintillator materials comprising cerium fluoride is disclosed. The preferred divalent fluoride dopants are calcium fluoride, strontium fluoride, and barium fluoride. The preferred amount of divalent fluoride dopant is less than about two percent by weight of the total scintillator. Cerium fluoride scintillator crystals grown with the addition of a divalent fluoride have exhibited better transmissions and higher light outputs than crystals grown without the addition of such dopants. These scintillators are useful in radiation detection and monitoring applications, and are particularly well suited for high-rate applications such as positron emission tomography (PET).

  17. Structural changes of conversion metal fluoride cathodes in lithium ion batteries

    NASA Astrophysics Data System (ADS)

    Sina, Mahsa

    Currently, cathode materials for Li-ion batteries are based on intercalation processes where, during charge and discharge processes, Li intercalates into the crystal lattice while maintaining the host crystal structure. More recently, new cathode materials have been introduced based on conversion reactions involving phase transformation and complete reduction of the host transition metal. In addition, conversion reactions involve two or more Li ions with a resulting much higher capacity than obtainable for intercalation materials. However, mechanism of phase transformation and cycling reversibility are at present still poorly understood. In this study transmission electron microscopy (TEM) techniques including selected area electron diffraction (SAED) pattern, annular dark field (ADF) STEM image, and electron energy loss spectroscopy (EELS) with nanoscale spatial resolution were used to study the phase evolution and structural changes of iron fluorides (FeFe2, FeO0.7F 1.3, FeF3) after various discharge/charge cycles. Additionally, the changes of the Fe valence states upon cycling were determined using EELS by measuring the L3/L2 intensity ratio of Fe-L edge. The structural transformations of FeO0.7F1.3 during the first lithiation show that litiahation contains two regions. The first region, lithiation is an intercalation reaction with reduction of Fe 3+ to Fe2+. The second region of lithiation involves a conversion reaction, with the formation of metallic Fe, LiF, and Li 0.7Fe2+0.5O0.7F0.3 (rocksalt type) phases. The first delithiation process follows a different conversion reaction path compared to the first lithiation reaction involving the formation an amorphous rutile-type phase along with with the rocksalt-type phase. Interestingly, upon full recharge (delithiated electrode), the measured average Fe valence state returns back to its initial value of Fe2.7+. The growth of a solid electrolyte interphase (SEI) layer formation at the electrode

  18. Structure-forming components in crystals of ternary and quaternary 3d-metal complex fluorides.

    PubMed

    Peresypkina, E V; Blatov, V A

    2003-06-01

    Crystallochemical analysis and classification were performed for 139 ternary and quaternary complex fluorides with the general formula M1(n)M2(m)M3F(6), belonging to 33 structure types. Using coordination sequences and the uniformity criterion the structure-forming ionic sublattices or their combinations were found, which are responsible for the formation of stable periodic frameworks. Analysis of structure-forming motifs allows the interpretation of the crystal structures of complex fluorides as close packings of F ions with M1, M2 and M3 cations, partially occupying tetrahedral and octahedral voids, or as the packings of [M3F(6)] complex ions with M1 and M2 countercations in the voids. Cationic sublattices are noted to play an essential role, while forming crystal structures of complex fluorides. Relationships between the composition of structure-forming sublattices, the composition of compounds, and the size and charge of ions belonging to the sublattices were analysed under normal conditions, with thermal and high-pressure polymorphic transitions. Rules were formulated to predict the crystal structures of complex fluorides with a given chemical composition.

  19. Capillary electrophoresis with contactless conductivity detection for the quantification of fluoride in lithium ion battery electrolytes and in ionic liquids-A comparison to the results gained with a fluoride ion-selective electrode.

    PubMed

    Pyschik, Marcelina; Klein-Hitpaß, Marcel; Girod, Sabrina; Winter, Martin; Nowak, Sascha

    2017-02-01

    In this study, an optimized method using capillary electrophoresis (CE) with a direct contactless conductivity detector (C(4) D) for a new application field is presented for the quantification of fluoride in common used lithium ion battery (LIB) electrolyte using LiPF6 in organic carbonate solvents and in ionic liquids (ILs) after contacted to Li metal. The method development for finding the right buffer and the suitable CE conditions for the quantification of fluoride was investigated. The results of the concentration of fluoride in different LIB electrolyte samples were compared to the results from the ion-selective electrode (ISE). The relative standard deviations (RSDs) and recovery rates for fluoride were obtained with a very high accuracy in both methods. The results of the fluoride concentration in the LIB electrolytes were in very good agreement for both methods. In addition, the limit of detection (LOD) and limit of quantification (LOQ) values were determined for the CE method. The CE method has been applied also for the quantification of fluoride in ILs. In the fresh IL sample, the concentration of fluoride was under the LOD. Another sample of the IL mixed with Li metal has been investigated as well. It was possible to quantify the fluoride concentration in this sample. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. Fabrication of p-type lithium niobate crystals by molybdenum doping and polarization

    NASA Astrophysics Data System (ADS)

    Tian, Tian; Kong, Yongfa; Liu, Hongde; Liu, Shiguo; Li, Wei; Chen, Shaolin; Xu, Jiayue

    2017-06-01

    The lack of p-type lithium niobate limits it serving as an active material. A series of Mo-doped and pure congruent lithium niobate crystals were grown by Czochralski method under different polarization conditions. Their dominant carrier species were characterized by holographic experiment. The results showed dominant charge carrier species may be changed from electrons to holes when lithium niobate crystal was doped with Mo ions and polarized under the current of 70mA for 30 minutes. It indicated that p-type lithium niobate crystal could be fabricated by Mo-doping and suitably controlling the polarization condition. Mo-doped lithium niobate crystals can be a promising candidate for active components.

  1. Spectroscopy and Excitation Dynamics of the Trivalent Lanthanides THULIUM(3+) and HOLMIUM(3+) in Yttrium Lithium Fluoride.

    NASA Astrophysics Data System (ADS)

    Walsh, Brian Michael

    A detailed study of the spectroscopy and excitation dynamics of the trivalent lanthanides Tm^ {3+} and Ho^{3+} in Yttrium Lithium Fluoride, LiYF_4 (YLF), has been done. YLF is a very versatile laser host that has been used to produce laser action at many different wavelengths when doped with trivalent lanthanides. Since the early 1970's YLF has been the subject of many studies, the main goal of which has been to produce long wavelength lasers in the eye safe 2mum region. This study concentrates on a presentation and analysis of the spectroscopic features, and the temporal evolution of excitation energy in YLF crystals doped with Tm^{3+ } and Ho^{3+} ions. Absorption spectroscopy is studied to identify wavelength regions where energy can be absorbed in Holmium YLF and Thulium YLF, and to determine their respective absorption cross sections. These measurements are applied in the Judd-Ofelt theory to determine radiative transition rates of spontaneous emission. Luminescence spectroscopy is studied under cw diode laser excitation at 785nm. The effect of dopant ion concentration and excitation power on the observed luminescence are considered in these measurements. An analysis of these measurements have been used to determine channels of energy transfer between Tm^ {3+} and Ho^{3+} ions (cross relaxation, upconversion, and resonant energy transfer). The temporal response of Tm and Ho in singly and co-doped YLF to pulsed laser excitation with a Ti:Al_2O_3 laser and a CoMgF_2 laser tuned to various wavelengths have also been studied. The energy transfer mechanisms of cross relaxation, upconversion, and resonant energy transfer between Tm^ {3+} and Ho^{3+} ions have been modeled, and the model parameters extracted by a fitting procedure to the measured temporal response curves. Rate equation approaches to modeling are presented that result in predictions of rate constants for energy transfer processes, as well as more conventional approaches to modeling such as the Forster

  2. Report on the Study of Radiation Damage in Calcium Fluoride and Magnesium Fluoride Crystals for use in Excimer Laser Applications

    SciTech Connect

    None, None

    1999-10-04

    A study was performed to investigate the effects of radiation damage in calcium fluoride and magnesium fluoride crystals caused by gamma rays and UV photons from excimer lasers. The purpose was to study and correlate the damage caused by these two different mechanisms in various types of material used for fabricating optical elements in high power excimer lasers and lens systems of lithography tools. These optical systems are easily damaged by the laser itself, and it is necessary to use only the most radiation resistant materials for certain key elements. It was found that a clear correlation exists between the, radiation induced damage caused by high energy gamma rays and that produced by UV photons from the excimer laser. This correlation allows a simple procedure to be developed to select the most radiation resistant material at the ingot level, which would be later used to fabricate various components of the optical system. This avoids incurring the additional cost of fabricating actual optical elements with material that would later be damaged under prolonged use. The result of this screening procedure can result in a considerable savings in the overall cost of the lens and laser system.

  3. N-ethyl-N-methylpyrrolidinium bis(fluorosulfonyl)imide-electrospun polyvinylidene fluoride composite electrolytes: characterization and lithium cell studies.

    PubMed

    Zhou, Yundong; Wang, Xiaoen; Zhu, Haijin; Armand, Michel; Forsyth, Maria; Greene, George W; Pringle, Jennifer M; Howlett, Patrick C

    2017-01-18

    Using the organic ionic plastic crystal N-ethyl-N-methylpyrrolidinium bis(fluorosulfonyl)imide ([C2mpyr][FSI]) with electrospun nanofibers, LiFSI doped [C2mpyr][FSI]-PVdF composites were developed as solid state, self-standing electrolyte membranes. Different lithium salt concentration were investigated, with 10 mol% LiFSI found to be optimal amongst those assessed. Composites with different weight ratios of plastic crystal and polymer were prepared and 10 wt% polymer gave the highest conductivity. In addition, the effects of PVdF incorporation on the morphological, thermal, and structural properties of the organic ionic plastic crystal were investigated. Ion mobilities were also studied using solid-state nuclear magnetic resonance techniques. The electrolytes were then assembled into lithium symmetric cells and cycled galvanostatically at 0.13 mA cm(-2) at both ambient temperature and at 50 °C, for more than 500 cycles.

  4. The laser conoscopy of lithium niobate crystals of different composition

    NASA Astrophysics Data System (ADS)

    Pikoul, O. Y.; Sidorov, N. V.; Teplyakova, N. A.; Palatnikov, M. N.

    2016-11-01

    In this paper we study conoscopic patterns of single crystals of LiNbO3 congruent (Li/Nb = 0.946) and stoichiometric (Li/Nb = 1) compounds, as well as congruent crystals doped with cations: Mg2+ (0.86 wt.%), Zn2+ (0.03, 0.52, 0.62 wt.%), Cu2 + (0.015 wt.%), B3+ (0.12 wt.%), Gd3+ (0.51 wt.%), Y3+ (0.46 wt.%), Gd3+ (0.23 wt.%): Mg2+ (0.75 wt.%), Mg2+ (0.86 wt.%): Fe3+ (0.0036 wt.%), Ta5+ (1.13 wt.%): Mg2+ (0.011 wt.%), Y3+ (0.24 wt.%): Mg2+ (0.63 wt.%). Conoscopic patterns of lithium niobate crystals were recorded at excitation by He-Ne laser (λo = 632.8 nm) and the second harmonic of MLL-100 laser Y:Al garnet (λo = 532 nm, P = 1mW), which does not cause the effect of photorefractive and more powerful radiation of the second harmonic MLL-100 laser Y: Al garnet (λo = 532 nm, P = 90 mW). Irradiation of crystals radiation 632.8 nm and 532 nm (P = 1 mW) photorefractive effect is absent and there is no disclosure of the photoinduced light scattering indicatrix. In this case, conoscopic paintings reflect the state of structural defects in the crystal in the absence of photorefractive effect. When excited by MLL-100 laser radiation on Y:Al garnet (λo = 532 nm, P = 90 mW) in conoscopic patterns appear as its own crystal defects (defined composition and crystal growth conditions), and defects, induced by laser radiation. These crystals characterized by rather a low photorefractive effect. In crystals with a low effect of photorefractive optical distortions associated with the passage of laser light through the crystal is not "smeared" the strong destruction of the laser beam due to photorefractive effect, and confidently observable.

  5. Effect of Fluoride on the Morphology of Calcium Phosphate Crystals Grown on Acid-Etched Human Enamel

    PubMed Central

    Fan, Y.; Sun, Z.; Moradian-Oldak, J.

    2009-01-01

    The aim of this study was to examine the effect of fluoride ion concentration on the morphology of calcium phosphate crystals grown on acid-etched enamel as a model for tooth enamel erosion. Samples were immersed in calcification solution for 16 h and changes in crystal morphology were monitored by field emission scanning electron microscopy. Without fluoride, plate-like octacalcium phosphate crystals (20 nm thick, 2–10 μm wide) were formed. With 1–10 mg/l fluoride, arrays of denser needle-like nanocrystals (20–30 nm wide, >500 nm in length) were formed. We conclude that there is a minimal fluoride concentration (1 mg/l) that dramatically affects the morphology of calcium phosphate crystals grown on etched enamel in vitro. PMID:19321991

  6. Effect of fluoride on the morphology of calcium phosphate crystals grown on acid-etched human enamel.

    PubMed

    Fan, Y; Sun, Z; Moradian-Oldak, J

    2009-01-01

    The aim of this study was to examine the effect of fluoride ion concentration on the morphology of calcium phosphate crystals grown on acid-etched enamel as a model for tooth enamel erosion. Samples were immersed in calcification solution for 16 h and changes in crystal morphology were monitored by field emission scanning electron microscopy. Without fluoride, plate-like octacalcium phosphate crystals (20 nm thick, 2-10 microm wide) were formed. With 1-10 mg/l fluoride, arrays of denser needle-like nanocrystals (20-30 nm wide, >500 nm in length) were formed. We conclude that there is a minimal fluoride concentration (1 mg/l) that dramatically affects the morphology of calcium phosphate crystals grown on etched enamel in vitro.

  7. Hydrothermal descriptive chemistry and single crystal structure determination of cesium and rubidium thorium fluorides.

    PubMed

    Underwood, Christopher C; Mann, Matthew; McMillen, Colin D; Kolis, Joseph W

    2011-11-21

    Two new cesium thorium fluorides and three new rubidium thorium fluorides have been synthesized hydrothermally and structurally characterized. The structures of two polymorphs of CsTh(3)F(13) are described in space group P6/mmm with a = 8.2608(14) and c = 8.6519(17) and space group Pmc2(1) with a = 8.1830(16), b = 7.5780(15), and c = 8.6244(17). The analogous orthorhombic compound RbTh(3)F(13), with a = 8.1805(16), b = 7.4378(15), and c = 8.6594(17) in space group Pmc2(1), is also reported. Two other rubidium thorium fluorides are also described: RbTh(2)F(9) crystallizes in the space group Pnma where a = 8.9101(18), b = 11.829(2), and c = 7.4048(15), and Rb(7)Th(6)F(31) crystallizes in the space group R3 where a = 15.609(2) and c = 10.823(2). Comparison of these materials was made on the basis of their structures and synthesis conditions. The formation of these species in hydrothermal fluids appears to be dependent upon the concentration of the alkali fluoride mineralizer solution and, thus, the ratio of alkali ions to thorium in the system.

  8. Ammonium Fluoride Mediated Synthesis of Anhydrous Metal Fluoride-Mesoporous Carbon Nanocomposites for High-Performance Lithium Ion Battery Cathodes.

    PubMed

    Chun, Jinyoung; Jo, Changshin; Sahgong, Sunhye; Kim, Min Gyu; Lim, Eunho; Kim, Dong Hyeon; Hwang, Jongkook; Kang, Eunae; Ryu, Keun Ah; Jung, Yoon Seok; Kim, Youngsik; Lee, Jinwoo

    2016-12-28

    Metal fluorides (MFx) are one of the most attractive cathode candidates for Li ion batteries (LIBs) due to their high conversion potentials with large capacities. However, only a limited number of synthetic methods, generally involving highly toxic or inaccessible reagents, currently exist, which has made it difficult to produce well-designed nanostructures suitable for cathodes; consequently, harnessing their potential cathodic properties has been a challenge. Herein, we report a new bottom-up synthetic method utilizing ammonium fluoride (NH4F) for the preparation of anhydrous MFx (CuF2, FeF3, and CoF2)/mesoporous carbon (MSU-F-C) nanocomposites, whereby a series of metal precursor nanoparticles preconfined in mesoporous carbon were readily converted to anhydrous MFx through simple heat treatment with NH4F under solventless conditions. We demonstrate the versatility, lower toxicity, and efficiency of this synthetic method and, using XRD analysis, propose a mechanism for the reaction. All MFx/MSU-F-C prepared in this study exhibited superior electrochemical performances, through conversion reactions, as the cathode for LIBs. In particular, FeF3/MSU-F-C maintained a capacity of 650 mAh g(-1)FeF3 across 50 cycles, which is ∼90% of its initial capacity. We expect that this facile synthesis method will trigger further research into the development of various nanostructured MFx for use in energy storage and other applications.

  9. Conductivity degradation of polyvinylidene fluoride composite binder during cycling: Measurements and simulations for lithium-ion batteries

    DOE PAGES

    Grillet, Anne M.; Humplik, Thomas; Stirrup, Emily K.; ...

    2016-07-02

    The polymer-composite binder used in lithium-ion battery electrodes must both hold the electrodes together and augment their electrical conductivity while subjected to mechanical stresses caused by active material volume changes due to lithiation and delithiation. We have discovered that cyclic mechanical stresses cause significant degradation in the binder electrical conductivity. After just 160 mechanical cycles, the conductivity of polyvinylidene fluoride (PVDF):carbon black binder dropped between 45–75%. This degradation in binder conductivity has been shown to be quite general, occurring over a range of carbon black concentrations, with and without absorbed electrolyte solvent and for different polymer manufacturers. Mechanical cycling ofmore » lithium cobalt oxide (LiCoO2) cathodes caused a similar degradation, reducing the effective electrical conductivity by 30–40%. Mesoscale simulations on a reconstructed experimental cathode geometry predicted the binder conductivity degradation will have a proportional impact on cathode electrical conductivity, in qualitative agreement with the experimental measurements. Lastly, ohmic resistance measurements were made on complete batteries. Direct comparisons between electrochemical cycling and mechanical cycling show consistent trends in the conductivity decline. This evidence supports a new mechanism for performance decline of rechargeable lithium-ion batteries during operation – electrochemically-induced mechanical stresses that degrade binder conductivity, increasing the internal resistance of the battery with cycling.« less

  10. Conductivity degradation of polyvinylidene fluoride composite binder during cycling: Measurements and simulations for lithium-ion batteries

    SciTech Connect

    Grillet, Anne M.; Humplik, Thomas; Stirrup, Emily K.; Roberts, Scott A.; Barringer, David A.; Snyder, Chelsea M.; Janvrin, Madison R.; Apblett, Christopher A.

    2016-07-02

    The polymer-composite binder used in lithium-ion battery electrodes must both hold the electrodes together and augment their electrical conductivity while subjected to mechanical stresses caused by active material volume changes due to lithiation and delithiation. We have discovered that cyclic mechanical stresses cause significant degradation in the binder electrical conductivity. After just 160 mechanical cycles, the conductivity of polyvinylidene fluoride (PVDF):carbon black binder dropped between 45–75%. This degradation in binder conductivity has been shown to be quite general, occurring over a range of carbon black concentrations, with and without absorbed electrolyte solvent and for different polymer manufacturers. Mechanical cycling of lithium cobalt oxide (LiCoO2) cathodes caused a similar degradation, reducing the effective electrical conductivity by 30–40%. Mesoscale simulations on a reconstructed experimental cathode geometry predicted the binder conductivity degradation will have a proportional impact on cathode electrical conductivity, in qualitative agreement with the experimental measurements. Lastly, ohmic resistance measurements were made on complete batteries. Direct comparisons between electrochemical cycling and mechanical cycling show consistent trends in the conductivity decline. This evidence supports a new mechanism for performance decline of rechargeable lithium-ion batteries during operation – electrochemically-induced mechanical stresses that degrade binder conductivity, increasing the internal resistance of the battery with cycling.

  11. Electrical conduction in nanodomains in congruent lithium tantalate single crystal

    SciTech Connect

    Cho, Yasuo

    2014-01-27

    The electrical current flow behavior was investigated for nanodomains formed in a thin congruent lithium tantalate (LiTaO{sub 3}) single-crystal plate. When the nanodomains were relatively large, with diameters of about 100 nm, current flow was detected along the domain wall. However, when they were about 40 nm or smaller, the current flowed through the entire nanodomain. Schottky-like rectifying behavior was observed. Unlike the case of LiNbO{sub 3}, optical illumination was not required for current conduction in LiTaO{sub 3}. A clear temperature dependence of the current was found indicating that the conduction mechanism for nanodomains in LiTaO{sub 3} may involve thermally activated carrier hopping.

  12. Shock compression experiments on Lithium Deuteride single crystals.

    SciTech Connect

    Knudson, Marcus D.; Desjarlais, Michael Paul; Lemke, Raymond W.

    2014-10-01

    S hock compression exper iments in the few hundred GPa (multi - Mabr) regime were performed on Lithium Deuteride (LiD) single crystals . This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17 - 32 km/s. Measurements included pressure, density, and temperature between %7E200 - 600 GPa along the Principal Hugoniot - the locus of end states achievable through compression by large amplitude shock waves - as well as pressure and density of re - shock states up to %7E900 GPa . The experimental measurements are compared with recent density functional theory calculations as well as a new tabular equation of state developed at Los Alamos National Labs.

  13. Neutron beam test of barium fluoride crystal for dark matter direct detection

    NASA Astrophysics Data System (ADS)

    Guo, C.; Ma, X. H.; Wang, Z. M.; Bao, J.; Dai, C. J.; Guan, M. Y.; Liu, J. C.; Li, Z. H.; Ren, J.; Ruan, X. C.; Yang, C. G.; Yu, Z. Y.; Zhong, W. L.

    2016-10-01

    In order to test the capabilities of Barium Fluoride (BaF2) crystal for dark matter direct detection, nuclear recoils are studied with mono-energetic neutron beam. The energy spectra of nuclear recoils, quenching factors for elastic scattering neutrons and discrimination capability between neutron inelastic scattering events and γ events are obtained for various recoil energies of the F content in BaF2.

  14. In-Situ Crystallization of a Lithium Disilicate Glass--Effect of Pressure on Crystal Growth Rate

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Ray, C. S.; Lesher, C. E.; Day, D. E.

    2006-01-01

    Crystallization of a Li2O.2SiO2 (LS2) glass subjected to a uniform hydrostatic pressure of 4.5 GPa and 6 GPa was investigated up to a temperature of 750 C. The density of the compressed glass is about 2% greater at 4.5 GPa than at 1 atm and, depending upon the processing temperature, up to 10% greater at 6 GPa. Crystal growth rates investigated as a function of temperature and pressure show that lithium disilicate crystal growth is an order of magnitude slower at 4.5 GPa than 1 atm resulting in a shift of +45 C (plus or minus 10 C) in the growth rate curve at high pressure compared to 1 atm condition. At 6 GPa lithium disilicate crystallization is suppressed entirely, while a new high pressure lithium metasilicate crystallizes at temperatures 95 C (plus or minus 10 C) higher than those reported for lithium disilicate crystallization at 1 atm. The decrease in crystal growth rate with increasing pressure for lithium disilicate glass up to 750 C is related to an increase in viscosity with pressure associated with fundamental changes in glass structure accommodating densification.

  15. In-Situ Crystallization of a Lithium Disilicate Glass--Effect of Pressure on Crystal Growth Rate

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Ray, C. S.; Lesher, C. E.; Day, D. E.

    2006-01-01

    Crystallization of a Li2O.2SiO2 (LS2) glass subjected to a uniform hydrostatic pressure of 4.5 GPa and 6 GPa was investigated up to a temperature of 750 C. The density of the compressed glass is about 2% greater at 4.5 GPa than at 1 atm and, depending upon the processing temperature, up to 10% greater at 6 GPa. Crystal growth rates investigated as a function of temperature and pressure show that lithium disilicate crystal growth is an order of magnitude slower at 4.5 GPa than 1 atm resulting in a shift of +45 C (plus or minus 10 C) in the growth rate curve at high pressure compared to 1 atm condition. At 6 GPa lithium disilicate crystallization is suppressed entirely, while a new high pressure lithium metasilicate crystallizes at temperatures 95 C (plus or minus 10 C) higher than those reported for lithium disilicate crystallization at 1 atm. The decrease in crystal growth rate with increasing pressure for lithium disilicate glass up to 750 C is related to an increase in viscosity with pressure associated with fundamental changes in glass structure accommodating densification.

  16. Growth, spectral and crystallization perfection studies of semi organic non linear optical crystal - L-alanine lithium chloride

    NASA Astrophysics Data System (ADS)

    Redrothu, Hanumantharao; Kalainathan, S.; Bhagavannarayana, G.

    2012-06-01

    Single crystals of L-alanine lithium chloride single crystals were successfully grown using slow evaporation solution growth technique at constant temperature (303K). The formation of the new crystal has been confirmed by single-crystal X-ray diffraction, FT-IR studies. The crystalline perfection was analyzed by high-resolution X-ray diffraction (HRXRD) rocking curve measurements. The powder second harmonic generation (SHG) has been confirmed by Nd: YAG laser. The results have been discussed in detail.

  17. On the existence of ``l-threonine formate'', ``l-alanine lithium chloride'' and ``bis l-alanine lithium chloride'' crystals

    NASA Astrophysics Data System (ADS)

    Petrosyan, A. M.; Ghazaryan, V. V.; Fleck, M.

    2013-03-01

    We argue that the recently reported crystals "L-threonine formate" as well as "L-alanine lithium chloride" and "bis L-alanine lithium chloride" actually are the well-known crystals L-threonine and L-alanine, respectively.

  18. Photonic Crystal Fabrication in Lithium Nobate via Pattern Transfer Through Wet and Dry Etched Chromium Mask

    DTIC Science & Technology

    2012-10-02

    literature.8 After the chromium mask is removed, the sample can be cleaned by a simple acetone and isopropanol wash, provided all ZEP residue is...Photonic crystal fabrication in lithium niobate via pattern transfer through wet and dry etched chromium mask Ozgur Yavuzcetin, Herman P. Novikov...OCT 2012 2. REPORT TYPE 3. DATES COVERED 00-00-2012 to 00-00-2012 4. TITLE AND SUBTITLE Photonic crystal fabrication in lithium niobate via

  19. Refinement of the crystal structure of lithium-bearing uvite

    SciTech Connect

    Rozhdestvenskaya, I. V. Frank-Kamenetskaya, O. V.; Kuznetsova, L. G.; Bannova, I. I.; Bronzova, Yu. M.

    2007-03-15

    The crystal structure of a natural calcium tourmaline, i.e., uvite with a high lithium content (0.51 au per formula (aupf) at the Y site, is refined to R = 0.019, R{sub w} = 0.020, and S = 1.11. It is shown that, in nature, there exist uvites in which the charge balance in the case where the Z site is occupied by trivalent cations is provided by the replacement of part of the divalent magnesium cations at the Y site by univalent cations, divalent calcium cations at the X site by sodium cations, and univalent anions at the W site by oxygen anions. The W site is found to be split into two sites, namely, the W1 and W11 sites (the W1-W11 distance is 0.14 A), which are partially occupied by the fluorine and oxygen anions, respectively. An analysis of the results obtained in this study and the data available in the literature on the crystal structure of uvites allows the conclusion that uvite can be considered a superspecies and that the nomenclature of this mineral group needs refinement with the use of structural data.

  20. Single crystal structures of thallium (I) thorium fluorides and crystal chemistry of monovalent tetravalent cation pentafluorides

    NASA Astrophysics Data System (ADS)

    Oudahmane, Abdelghani; El-Ghozzi, Malika; Jouffret, Laurent; Avignant, Daniel

    2015-12-01

    Two thallium (I) thorium (IV) fluorides, TlTh3F13 and TlThF5 were obtained by solid state synthesis and their crystal structures determined from single crystal X-ray diffraction data recorded at room temperature with an APEX-II CCD diffractometer. TlTh3F13 is orthorhombic, space group Pmc21, with a=8.1801(2) Å, b=7.4479(2) Å, c=8.6375(2) Å, V=526.24(2) Å3, Z=2 and TlThF5 is monoclinic, space group P21/n, with a=8.1128(5) Å, b=7.2250(4) Å, c=8.8493(6) Å, β=116.683(3)°, V=463.46(5) Å3, Z=4. The structure of TlTh3F13 comprises layers of corner and edge-sharing ThF9 polyhedra further linked by chains of trans connected tricapped trigonal prisms ThF9 through corners and edges. The three dimensional thorium frameworks delimits channels parallel to [0 0 1] where the 11-coordinated Tl+ ions are arranged into double columns located in mirror planes of the structure. TlTh3F13 is isotypic with RbTh3F13, RbU3F13 and with one of the two polymorphs of CsTh3F13. The structure of TlThF5 may be regarded as a layer structure built up from the regular succession of 2∞[ M ‧F5 ] - corrugated layers further held by the Tl+ ions along the [1 0 1 ̅] direction. The layers are built up from edge and corner-sharing thorium polyhedra where each (ThF9)5- monocapped square antiprism is connected to five others by sharing three edges and two corners. TlThF5 is isostructural with β-NH4UF5 and with one of the polymorphs of CsThF5. A comparison of the different structural types of MM‧F5 pentafluorides is presented and a diagram of repartition of their structures is given. From the comparison of the Tl structures with their Rb or Cs homologs, where very similar monovalent cation environments are observed it should be concluded to a stereochemically inactivity of the 6s2 lone pair of Tl(I) in both TlTh3F13 and TlThF5, contrary to what is observed in richer Tl(I) content Tl3ThF7 fluorothorate.

  1. Growth and characterization of Cu (II) doped negatively soluble lithium sulfate monohydrate crystals

    NASA Astrophysics Data System (ADS)

    Boopathi, K.; Ramasamy, P.; Bhagavannarayana, G.

    2014-01-01

    Single crystals of pure and Cu (II) doped negatively soluble lithium sulfate monohydrate have been grown by slow evaporation solution technique. In the present work, to improve the crystalline quality of lithium sulfate monohydrate crystal, metal dopant was incorporated into the pure crystals. The as grown crystals are clear, transparent and the sizes of the crystals were up to 18×12×3 mm3 and 50×15×5 mm3. The presence of metal dopant has been confirmed by energy dispersive spectroscopy, atomic absorption spectroscopy analysis. Single crystal and powder X-ray diffraction studies were carried out to ascertain lattice parameters and identify different phase nature. Optical transmission spectrum of the grown crystals was recorded. FT-IR and thermal analysis were carried out to investigate the functional group and thermal behavior of the grown crystals respectively. The grown crystal was subjected to Vickers micro hardness, HRXRD, piezoelectric, laser damage threshold measurements and second harmonic generation efficiency studies.

  2. Mode-locking optimization with a real-time feedback system in a Nd:yttrium lithium fluoride laser cavity.

    PubMed

    Marengoni, C; Canova, F; Batani, D; Benocci, R; Librizzi, M; Narayanan, V; Gomareschi, M; Lucchini, G; Kilpio, A; Shashkov, E; Stuchebrukhov, I; Vovchenko, V; Chernomyrdin, V; Krasuyk, I; Hall, T; Bittanti, S

    2007-01-01

    We present a control system, which allows an automatic optimization of the pulse train stability in a mode-locked laser cavity. In order to obtain real-time corrections, we chose a closed loop approach. The control variable is the cavity length, mechanically adjusted by gear system acting on the rear cavity mirror, and the controlled variable is the envelope modulation of the mode-locked pulse train. Such automatic control system maintains the amplitude of the mode-locking pulse train stable within a few percent rms during the working time of the laser. Full implementation of the system on an Nd:yttrium lithium fluoride actively mode-locked laser is presented.

  3. Determining the sign of a polar surface of lithium niobate crystal by UV reflectance spectroscopy

    NASA Astrophysics Data System (ADS)

    Paranin, V. D.; Pantelei, E.

    2017-01-01

    We propose to reveal the + Z and- Z surfaces of a polar cut lithium niobate crystal by measuring its UV reflection spectrum. By the example of a congruent lithium niobate, it is shown that the intensities of light reflection from polar crystal surfaces of different signs in the region of 190—260 nm differ by up to several percent. The depth of short-wave radiation penetration into surface layers of the crystal in the spectral range of intrinsic absorption is estimated. It is shown that the proposed method can be used for determining the surface signs of polar crystal layers with thicknesses from several dozen to several hundred microns.

  4. Twin defects in thick stoichiometric lithium tantalate crystals prepared by a vapor transport equilibration method

    NASA Astrophysics Data System (ADS)

    Yang, Jinfeng; Sun, Jun; Xu, Jingjun; Li, Qinglian; Shang, Jifang; Zhang, Ling; Liu, Shiguo; Huang, Cunxin

    2016-01-01

    The twins were observed and investigated in vapor transport equilibration (VTE) treated lithium tantalate crystals by burying congruent lithium tantalate crystals (CLT) in a Li-rich polycrystalline powder. Twins and their etched patterns were observed under an optical polarizing microscope, and the geometry of the twins was discussed. Twin composition planes were the { 01 1 bar 2 } planes. The cause of twinning was analyzed and verified by experiment. The results indicate that the emergence of twins is due to sintering stress, which arises from sintered Li-rich polycrystalline powders at high temperature. 3.2 mm thick stoichiometric lithium tantalate (SLT) crystals without twins were obtained by setting corundum crucibles over the top of the crystals to make crystals free from the sintering stress. In addition, cracks were observed at the intersection of twin bands, and the stress caused by the dislocation pile-up was considered to be the reason for the formation of cracks.

  5. Optical properties of Eu2+ doped antipervoskite fluoride single crystals

    NASA Astrophysics Data System (ADS)

    Daniel, D. Joseph; Nithya, R.; Ramasamy, P.; Madhusoodanan, U.

    2013-02-01

    Single crystals of pure and Eu2+ doped LiBaF3 have been grown from melt by using a vertical Bridgman-Stockbarger method. Absorption and luminescence spectra for pure and rare-earth-doped LiBaF3 were studied. At ambient conditions the photoluminescence spectra consisted of sharp lines peaked at ˜359 nm attributed to the 6P7/2→8S7/2 transitions in the 4f7 electronic configuration of Eu2+ and a broad band extending between 370 and 450 nm attributed to Eu2+ trapped exciton recombination. The effect of 60Co gamma irradiation has also been investigated.

  6. Growth and characterization of large-diameter, lithium-free ZnO single crystals

    NASA Astrophysics Data System (ADS)

    Wang, Shaoping; Kopec, Aneta; Timmerman, Andrew G.

    2012-02-01

    Large-diameter, lithium-free ZnO single-crystal substrates of high crystalline quality will enable development and commercialization of high-performance ZnO-based semiconductor devices, such as UV and visible light emitting diodes (LEDs), UV laser diodes and solar-blind UV detectors for variety of applications. We have recently developed a novel crystal growth technique for producing lithium-free ZnO single crystal boules of 1 inch in diameter. We also fabricated ZnO single crystal wafers in sizes up to 1 inch in diameter. Chemical purity, crystalline defects, and electrical resistivity of ZnO single crystals were analyzed. Results from crystal growth and material characterization are presented and discussed. Our research results suggest that the novel crystal growth technique is a viable production technique for producing ZnO single crystals and substrates for semiconductor device applications.

  7. Dissolution of Alkali Fluoride and Chloride Crystals in Water Studied by Molecular Dynamics Simulations

    NASA Astrophysics Data System (ADS)

    Fukushima, N.; Tamura, Y.; Ohtaki, H.

    1991-02-01

    The dissolution of cubic crystals of NaF, KF, CsF, LiCl, NaCl, and KCl consisting of 32 cations and 32 anions in an isolated box containing 216 water molecules was studied at 298 K by molecular dynamics simulations. The ion-ion, ion-water and water-water interactions were described in terms of the Tosi-Fumi, Kistenmacher-Popkie-Clementi, and Matsuoka-Clementi-Yoshimine potentials, respectively. During the simulation periods of 12 ps for NaF, CsF and LiCl and 20 ps for KF, NaCl and KCl cations did not dissolve, while anions dissolved from the CsF, LiCl and NaCl crystals but not from the NaF, KF and KCl crystals. The mass effect in the dissolution of CsF was examined by giving the ceasium ions the atomic weight of the fluoride ion (18.998). In case of the "light" caesium ions in the crystal fluctuated less far and again fluoride ions but no caesium ions were dissolved.

  8. [Study on Spectral Characteristics of Two Kinds of Home-Made Novel Yb-Doped Fluoride Laser Crystals].

    PubMed

    Xu, Wen-bin; Chai, Lu; Shi, Jun-kai; Song, You-jian; Hu, Ming-lie; Wang, Qing-yue; Su, Liang-bi; Jiang, Da-peng; Xu, Jun

    2015-09-01

    Yb-doped fluoride crystals are of important another Yb-doped laser materials besides Yb-doped oxide, which are becoming one of interests for developing tunable lasers and ultrafast lasers. In this paper, the systematic and contrastive experiments of the optical spectral characteristics are presented for two types of home-made novel Yb-doped fluoride laser crystals, namely, Yb-doped CaF2-SrF2 mixed crystal and co-doped Yb, Y:CaF2 single crystal. The fluorescent features of Yb-doped CaF2-SrF2 mixed crystal and co-doped Yb, Y:CaF2 single crystal are apparently different by the fluorescence experiment. The physical mechanism of these fluorescence spectra were analyzed and proposed. The influence of doping concentrations of active Yb(3+) ions or co-doping Y ions on the absorption of Yb-doped CaF2-SrF2 mixed crystal and co-doped Yb, Y:CaF2 single crystal was experimentally investigated, and the optimal values of doping concentrations of active Yb(3+) ions or co-doping Y ions in the two types of fluoride laser crystals were obtained. Continuous-wave laser operation for the two novel fluoride laser crystals has been achieved in three-mirror-folded resonator using a laser diode as the pump source. Therein, the laser operation for the co-doped Yb, Y:CaF2 crystal is demonstrated for the first time. For the two types of fluoride laser crystals (four samples), the input-output power relational curves, the optical slope efficiencies and the laser spectra were demonstrated by the laser experiments. By comparisons between the two types of fluoride laser crystals in the absorbability, fluorescence and laser spectra, laser threshold and slope efficiency of the continuous-wave laser operation, the results show that the best one of the four samples in spectral and laser characteristics is co-doped 3at%Yb, 6at% Y:CaF2 single crystal, which has an expected potential in the application. The research results provide available references for improving further laser performance of Yb

  9. Pyroelectric generation of 2D spatial soliton sets in a bulk of lithium niobate crystal

    NASA Astrophysics Data System (ADS)

    Ryabchenok, V.; Shandarov, V.; Perin, A.

    2017-06-01

    The generation of two-dimensional bright spatial soliton sets in lithium niobate sample has been experimentally demonstrated at light wavelength of 532 nm, contribution of pyroelectric effect into nonlinear optical response of the crystal, and spatial modulation of one-dimensional beam along direction normal to the crystal optical axis. Diameters of soliton beams and channel waveguides formed within the crystal bulk by these solitons are near to 20 μm at light polarization corresponding to extraordinary wave of the crystal.

  10. Growth of high quality bulk size single crystals of inverted solubility lithium sulphate monohydrate

    SciTech Connect

    Silambarasan, A.; Rajesh, P. Ramasamy, P.

    2015-06-24

    The paper summarizes the processes of growing large lithium sulfate monohydrate (LSMH) single crystals. We have established a procedure to grow high quality bulk size single crystals of inverted solubility LSMH by a newly developed unidirectional crystallization technique called the Sankeranarayenan - Ramasamy (SR) method. The convective flow of crystal growth processes from solution and the conditions of growing crystals of various aspects were discussed. Good quality LSMH single crystal is grown of the size 20 mmX80 mm without cracks, localized-defects and inclusions. The as-grown crystals are suitable for piezoelectric and nonlinear optical applications.

  11. Interatomic Auger rates for the sodium fluoride crystal

    SciTech Connect

    Green, T.A.; Jennison, D.R.

    1987-10-15

    Interatomic Auger rates for the NaF crystal are calculated for initial 1s, 2s, and 2p holes in the Na/sup +/ ion. The crystal is simulated by a (NaF/sub 6/)/sup 5-/ cluster embedded in a large number of point ions, and the one-electron orbitals are obtained from restricted Hartree-Fock calculations of the initial state. The continuum-electron orbital is obtained from the Coulomb potential for a spherically averaged superposition of atomic charge densities for the initial state, and exchange is treated by the method of Riley and Truhlar. The continuum orbital is orthogonalized to the occupied molecular orbitals. The calculated Na(KLL) rate is about 20% greater than the experimental value. The calculated interatomic Auger widths for the transitions Na(1s)Na(2p)F(2p), Na(2s)Na(2p)F(2p), and Na(2p)F(2p)F(2p)' (following the notation of J. A. D. Matthew and Y. Komninos, Surf. Sci. 53, 716 (1975)) are 0.001 73, 0.641, and 0.153 eV, respectively. For comparison, the width of the Na(KLL) Auger transition is close to 0.26 eV. All three interatomic transitions have been identified by Citrin, Rowe, and Christman. Widths for the transitions Na(1s)Na(2p)F(2p) and Na(2p)F(2p)F(2p)' can be inferred from experimental data. Theory and experiment agree to within 50%. This represents a considerable improvement over previous theoretical treatments.

  12. Interatomic Auger rates for the sodium fluoride crystal

    NASA Astrophysics Data System (ADS)

    Green, T. A.; Jennison, D. R.

    1987-10-01

    Interatomic Auger rates for the NaF crystal are calculated for initial 1s, 2s, and 2p holes in the Na+ ion. The crystal is simulated by a (NaF6)5- cluster embedded in a large number of point ions, and the one-electron orbitals are obtained from restricted Hartree-Fock calculations of the initial state. The continuum-electron orbital is obtained from the Coulomb potential for a spherically averaged superposition of atomic charge densities for the initial state, and exchange is treated by the method of Riley and Truhlar. The continuum orbital is orthogonalized to the occupied molecular orbitals. The calculated Na(KLL) rate is about 20% greater than the experimental value. The calculated interatomic Auger widths for the transitions Na(1s)Na(2p)F(2p), Na(2s)Na(2p)F(2p), and Na(2p)F(2p)F(2p)' [following the notation of J. A. D. Matthew and Y. Komninos, Surf. Sci. 53, 716 (1975)] are 0.001 73, 0.641, and 0.153 eV, respectively. For comparison, the width of the Na(KLL) Auger transition is close to 0.26 eV. All three interatomic transitions have been identified by Citrin, Rowe, and Christman. Widths for the transitions Na(1s)Na(2p)F(2p) and Na(2p)F(2p)F(2p)' can be inferred from experimental data. Theory and experiment agree to within 50%. This represents a considerable improvement over previous theoretical treatments.

  13. Lithium

    USGS Publications Warehouse

    Jaskula, B.W.

    2011-01-01

    In 2010, lithium consumption in the United States was estimated to have been about 1 kt (1,100 st) of contained lithium, a 23-percent decrease from 2009. The United States was estimated to be the fourth largest consumer of lithium. It remained the leading importer of lithium carbonate and the leading producer of value-added lithium materials. Only one company, Chemetall Foote Corp. (a subsidiary of Chemetall GmbH of Germany), produced lithium compounds from domestic resources. In 2010, world lithium consumption was estimated to have been about 21 kt (22,000 st) of lithium contained in minerals and compounds, a 12-percent increase from 2009.

  14. Lithium

    USGS Publications Warehouse

    Jaskula, B.W.

    2010-01-01

    In 2009, lithium consumption in the United States was estimated to have been about 1.2 kt (1,300 st) of contained lithium, a 40-percent decrease from 2008. The United States was estimated to be the fourth largest consumer of lithium, and remained the leading importer of lithium carbonate and the leading producer of value-added lithium materials. Only one company, Chemetall Foote Corp. (a subsidiary of Chemetall GmbH of Germany), produced lithium compounds from domestic resources. In 2009, world lithium consumption was estimated to have been about 18.7 kt (20,600 st) of lithium contained in minerals and compounds.

  15. Lithium-free transition metal monoxides for positive electrodes in lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Jung, Sung-Kyun; Kim, Hyunchul; Cho, Min Gee; Cho, Sung-Pyo; Lee, Byungju; Kim, Hyungsub; Park, Young-Uk; Hong, Jihyun; Park, Kyu-Young; Yoon, Gabin; Seong, Won Mo; Cho, Yongbeom; Oh, Myoung Hwan; Kim, Haegyeom; Gwon, Hyeokjo; Hwang, Insang; Hyeon, Taeghwan; Yoon, Won-Sub; Kang, Kisuk

    2017-01-01

    Lithium-ion batteries based on intercalation compounds have dominated the advanced portable energy storage market. The positive electrode materials in these batteries belong to a material group of lithium-conducting crystals that contain redox-active transition metal and lithium. Materials without lithium-conducting paths or lithium-free compounds could be rarely used as positive electrodes due to the incapability of reversible lithium intercalation or the necessity of using metallic lithium as negative electrodes. These constraints have significantly limited the choice of materials and retarded the development of new positive electrodes in lithium-ion batteries. Here, we demonstrate that lithium-free transition metal monoxides that do not contain lithium-conducting paths in their crystal structure can be converted into high-capacity positive electrodes in the electrochemical cell by initially decorating the monoxide surface with nanosized lithium fluoride. This unusual electrochemical behaviour is attributed to a surface conversion reaction mechanism in contrast with the classic lithium intercalation reaction. Our findings will offer a potential new path in the design of positive electrode materials in lithium-ion batteries.

  16. The Effects of Gravity on the Crystallization Behavior of Heavy Metal Fluoride Glasses

    NASA Technical Reports Server (NTRS)

    Tucker, Dennis S.; Smith, Guy A.

    2004-01-01

    Heavy metal fluoride glasses are used in such applications as fiber lasers and laser amplifiers. ZrF4-BaF2-LaF3-AlF3-NaF (ZBLAN) is one of the more commonly used heavy metal fluoride glasses. ZBLAN is an infrared transmitter and has a theoretical attenuation coefficient of 0.002 db/km. However, due to impurities and small crystallites this attenuation coefficient has not been achieved to date. ZBLAN is a fragile glass which can lead to rapid crystallization, if the glass is not cooled rapidly to below the glass transition temperature or if the glass is reheated near the crystallization temperature for any period of time. Studies carried on at Marshall Space Flight Center and the University of Alabama in Huntsville since 1993 have shown that heating ZBLAN glass at the crystallization temperature in reduced gravity results in a suppression of crystallization when compared to ZBLAN processed in unit gravity. These studies utilized NASA's KC-135 aircraft and the Conquest sounding rocket. In the first series of experiments, short lengths of ZBLAN fiber were heated to the crystallization temperature in reduced gravity on board the KC- 135 and the Conquest sounding rocket and compared with fibers heated in unit gravity. The fibers processed in reduced gravity showed no evidence of crystallization when studied with x-ray diffraction and scanning electron microscopy. However, the fibers processed in unit gravity were completely crystallized. Subsequent experiments included heating small pieces of ZBLAN glass at the crystallization temperature while viewing with a video camera to follow the crystallization phenomenon. In this experiment crystallization was observed in reduced gravity, however, it was suppressed when compared to heating in unit gravity. In the most recent experiment on board the KC-135, rapid thermal analysis of ZBLAN was performed. A mechanism to explain the observations has been proposed. This mechanism is based on shear thinning whereby, the glass

  17. The Effects of Gravity on the Crystallization Behavior of Heavy Metal Fluoride Glasses

    NASA Technical Reports Server (NTRS)

    Tucker, Dennis S.; Smith, Guy A.

    2004-01-01

    Heavy metal fluoride glasses are used in such applications as fiber lasers and laser amplifiers. ZrF4-BaF2-LaF3-AlF3-NaF (ZBLAN) is one of the more commonly used heavy metal fluoride glasses. ZBLAN is an infrared transmitter and has a theoretical attenuation coefficient of 0.002 db/km. However, due to impurities and small crystallites this attenuation coefficient has not been achieved to date. ZBLAN is a fragile glass which can lead to rapid crystallization, if the glass is not cooled rapidly to below the glass transition temperature or if the glass is reheated near the crystallization temperature for any period of time. Studies carried on at Marshall Space Flight Center and the University of Alabama in Huntsville since 1993 have shown that heating ZBLAN glass at the crystallization temperature in reduced gravity results in a suppression of crystallization when compared to ZBLAN processed in unit gravity. These studies utilized NASA's KC-135 aircraft and the Conquest sounding rocket. In the first series of experiments, short lengths of ZBLAN fiber were heated to the crystallization temperature in reduced gravity on board the KC- 135 and the Conquest sounding rocket and compared with fibers heated in unit gravity. The fibers processed in reduced gravity showed no evidence of crystallization when studied with x-ray diffraction and scanning electron microscopy. However, the fibers processed in unit gravity were completely crystallized. Subsequent experiments included heating small pieces of ZBLAN glass at the crystallization temperature while viewing with a video camera to follow the crystallization phenomenon. In this experiment crystallization was observed in reduced gravity, however, it was suppressed when compared to heating in unit gravity. In the most recent experiment on board the KC-135, rapid thermal analysis of ZBLAN was performed. A mechanism to explain the observations has been proposed. This mechanism is based on shear thinning whereby, the glass

  18. Fluoride Binding and Crystal-Field Analysis of Lanthanide Complexes of Tetrapicolyl-Appended Cyclen.

    PubMed

    Blackburn, Octavia A; Kenwright, Alan M; Jupp, Andrew R; Goicoechea, Jose M; Beer, Paul D; Faulkner, Stephen

    2016-06-20

    Lanthanide complexes of tetrapicolyl cyclen displayed remarkably high affinities for fluoride (log K≈5) in water, and were shown to form 1:1 complexes. The behaviour of these systems can be rationalised by changes to the magnitude of the crystal-field parameter, B20 . However, such changes are not invariably accompanied by a change in sign of this parameter: for early lanthanides, the N8 donor set with a coordinated axial water molecule ensures that the magnetic anisotropy has the opposite sense to that observed in the analogous dehydrated lanthanide complexes. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  19. Lithium

    USGS Publications Warehouse

    Jaskula, B.W.

    2012-01-01

    In 2011, world lithium consumption was estimated to have been about 25 kt (25,000 st) of lithium contained in minerals and compounds, a 10-percent increase from 2010. U.S. consumption was estimated to have been about 2 kt (2,200 st) of contained lithium, a 100-percent increase from 2010. The United States was estimated to be the fourth-ranked consumer of lithium and remained the leading importer of lithium carbonate and the leading producer of value-added lithium materials. One company, Chemetall Foote Corp. (a subsidiary of Chemetall GmbH of Germany), produced lithium compounds from domestic brine resources near Silver Peak, NV.

  20. Tunable Bloch surface waves in anisotropic photonic crystals based on lithium niobate thin films.

    PubMed

    Kovalevich, Tatiana; Ndao, Abdoulaye; Suarez, Miguel; Tumenas, Saulius; Balevicius, Zigmas; Ramanavicius, Arunas; Baleviciute, Ieva; Häyrinen, Markus; Roussey, Matthieu; Kuittinen, Markku; Grosjean, Thierry; Bernal, Maria-Pilar

    2016-12-01

    We present an original type of one-dimensional photonic crystal that includes one anisotropic layer made of a lithium niobate thin film. We demonstrate the versatility of such a device sustaining different Bloch surface waves (BSWs), depending on the orientation of the incident wave. By varying the orientation of the illumination of the multilayer, we measured an angle variation of 7° between the BSWs corresponding to the extraordinary and the ordinary index of the lithium niobate thin film. The potential of such a platform opens the way to novel tunable and active planar optics based on the electro- and thermo-optical properties of lithium niobate.

  1. Sulfonic Acid- and Lithium Sulfonate-Grafted Poly(Vinylidene Fluoride) Electrospun Mats As Ionic Liquid Host for Electrochromic Device and Lithium-Ion Battery.

    PubMed

    Zhou, Rui; Liu, Wanshuang; Leong, Yew Wei; Xu, Jianwei; Lu, Xuehong

    2015-08-05

    Electrospun polymer nanofibrous mats loaded with ionic liquids (ILs) are promising nonvolatile electrolytes with high ionic conductivity. The large cations of ILs are, however, difficult to diffuse into solid electrodes, making them unappealing for application in some electrochemical devices. To address this issue, a new strategy is used to introduce proton conduction into an IL-based electrolyte. Poly(vinylidene fluoride-co-hexafluoropropylene) (P(VDF-HFP)) copolymer is functionalized with sulfonic acid through covalent attachment of taurine. The sulfonic acid-grafted P(VDF-HFP) electrospun mats consist of interconnected nanofibers, leading to remarkable improvement in dimensional stability of the mats. IL-based polymer electrolytes are prepared by immersing the modified mats in 1-butyl-3-methylimidazolium tetrafluoroborate (BMIM(+)BF4(-)). It is found that the SO3(-) groups can have Lewis acid-base interactions with the cations (BMIM(+)) of IL to promote the dissociation of ILs, and provide additional proton conduction, resulting in significantly improved ionic conductivity. Using this novel electrolyte, polyaniline-based electrochromic devices show higher transmittance contrast and faster switching behavior. Furthermore, the sulfonic acid-grafted P(VDF-HFP) electrospun mats can also be lithiated, giving additional lithium ion conduction for the IL-based electrolyte, with which Li/LiCoO2 batteries display enhanced C-rate performance.

  2. Lithium

    USGS Publications Warehouse

    Ober, J.A.

    2006-01-01

    In 2005, lithium consumption in the United States was at 2.5 kt of contained lithium, nearly 32% more than the estimate for 2004. World consumption was 14.1 kt of lithium contained in minerals and compounds in 2003. Exports from the US increased slightly compared with 2004. Due to strong demand for lithium compounds in 2005, both lithium carbonate plants in Chile were operating at or near capacity.

  3. Growth of lithium triborate single crystals from molten salt solution under various temperature gradients

    NASA Astrophysics Data System (ADS)

    Guretskii, S. A.; Ges, A. P.; Zhigunov, D. I.; Ignatenko, A. A.; Kalanda, N. A.; Kurnevich, L. A.; Luginets, A. M.; Milovanov, A. S.; Molchan, P. V.

    1995-12-01

    Single crystals of lithium triborate LiB 3O 5 (LBO) have been grown by the top-seeded solution growth method with B 2O 3 as a solvent using different temperature gradients in the zone of crystallization. Optical and nonlinear optical properties of LBO single crystals have been investigated. The influence of post-growth thermal treatment in oxygen atmosphere on the optical properties has been studied.

  4. Impact of Nanosilicates on Poly(vinylidene fluoride) Crystal Polymorphism: Part 1. Melt-crystallization at High Supercooling

    SciTech Connect

    Ince-Gunduz, B.; Alpern, R; Amare, D; Crawford, J; Dolan, B; Jones, S; Kobylarz, R; Reveley, M; Cebe, P

    2010-01-01

    Polymorphism of poly(vinylidene fluoride), PVDF, in the presence of Lucentite STN organically modified silicate (OMS) is investigated for PVDF nanocomposites melt-crystallized at high supercooling temperatures where neat PVDF crystallizes exclusively in the alpha crystalline phase. Nanocomposites were prepared from solution with 0-1.0 wt% OMS composition. Here we observed that clay addition promotes gamma phase formation in nanocomposites melt-crystallized at high supercooling (i.e., at low crystallization temperature), whereas previously we showed that even small amount of nanosilicates resulted in beta phase formation in cold-crystallized PVDF nanocomposites. Wide-angle X-ray scattering (WAXS), Fourier transform infrared spectroscopy (FTIR) and differential scanning calorimetry (DSC) studies showed that {alpha}- and {gamma}-phases co-existed in nanocomposites containing up to 0.1 wt% OMS, and the amount of {alpha}-crystals substantially diminished for higher OMS content. Formation of {gamma}-crystal phase was confirmed with morphologic observation of spherulites of low-birefringence using polarizing optical and atomic force microscopies, and their crystalline structures were verified by FTIR and Raman microscopic spectroscopy. We also address in this work the ambiguities in assessing PVDF crystallographic phases, and correct the phase identification errors which have persisted up to this point in the literature based on melting point confusion. The crystal phase identification for PVDF nanocomposites is discussed and clarified, based on X-ray scattering, vibrational spectra, and thermal analysis. For reference, we provide a vibrational band list, indicating the close, or overlapping bands, of the three phases of PVDF: {alpha}, {beta} and {gamma}.

  5. Effect of additives on size and shape of lithium carbonate crystals

    NASA Astrophysics Data System (ADS)

    Taborga, P.; Brito, I.; Graber, T. A.

    2017-02-01

    Generally, properties such internal structure, shape, and size distribution influence the reactivity, fluidity and wettability of the crystals, and may be modified by the use of additives such as polyelectrolytes or surfactants. The aim of this study was to investigate the effect of different additives on the size and morphology of lithium carbonate crystals obtained by reactive crystallization from solutions of LiCl and Na2CO3. The additives used were: polyethylenimine (PEI), polyethylene glycol (PEG), poly (4-styrenesulfonic acid), (P4SA), polyacrylic acid (PAA), sodium dodecyl sulfate (SDS), and sodium dodecyl benzenesulfonate (SDBS). Obtained crystals were observed using scanning electron microscopy, the crystal size distribution was determined by a size image analyzer, and the crystal structure were analyzed by X-ray diffraction. The results showed that the presence of PEI, PEG and P4SA, increased the length of the lithium carbonate particles. The presence of SDS decreases the crystals size. Using SDBS as additive, the crystals had a needle-like shape, Finally PAA allowed the production of Li2CO3 spherulites. Crystal structure of lithium carbonate did not change in the presence of the tested additives.

  6. Ferroelectric properties of vinylidene fluoride/tetrafluoroethylene copolymer thin films consisting of needle-like crystals

    NASA Astrophysics Data System (ADS)

    Nakagawa, Yuuta; Hashizume, Yoichiro; Nakajima, Takashi; Okamura, Soichiro

    2016-05-01

    Unique ferroelectric vinylidene fluoride (VDF)/tetrafluoroethylene (TeFE) copolymer thin films consisting of needle-like crystals were formed using Au-sputtered substrates. The VDF/TeFE films with a mixing ratio of 80:20 mol % were melted at 170 °C for 30 min and then recrystallized at 116 °C for 300 min. The molecules in the resultant needle-like crystals had a β-phase form and showed 200/110 orientation, while the direction of each needle-like crystal was random in-plane. The remanent polarization of the 450-nm-thick VDF/TeFE films consisting of the needle-like crystals were estimated to be 62 mC/m2 from the electric displacement vs electric field (D-E) hysteresis measurement at the applied field of 156 MV/m and the frequency of 10 Hz. The remanent polarization of 62 mC/m2 was approximately 50% larger than that of conventional VDF/TeFE films consisting of plate-like crystals.

  7. Polishing test of a poly-crystal calcium fluoride lens: toward the development of TMT WFOS

    NASA Astrophysics Data System (ADS)

    Ozaki, Shinobu; Miyazaki, Satoshi; Tsuzuki, Toshihiro; Tanaka, Yoko

    2016-08-01

    Wide-Field Optical Spectrograph (WFOS) is one of the first-light instruments of Thirty Meter Telescope (TMT), and developed in an international collaboration led by University of California Santa Cruz. It covers the wavelength range from 310 nm to 1 μm which is divided at around 550 nm by a dichroic mirror. Calcium Fluoride (CaF2) is very useful to reduce aberration and has good transmittance even at 310 nm. Because a large mono-crystal CaF2 is difficult to be manufactured, we might have to use a poly-crystal CaF2. Comparing a mono-crystal, the poly-crystal is expected to have worse optical index homogeneity and larger surface figure error after polishing. Those effects on an image quality are unclear. To verify those effects, we conducted a polishing test of a small poly-crystal CaF2 lens as a first step. As a result, we found figure error around the boundary. The figure error is 139 nm PV and 26 nm RMS. Comparing a Zemax simulation, it is confirmed that the figure error does not have significant effect on the image quality.

  8. Instability of Polyvinylidene Fluoride-Based Polymeric Binder in Lithium-Ion Cells: Final Report

    SciTech Connect

    Garcia, M.; Nagasubramanian, G.; Tallant, D.R.; Roth, E.P.

    1999-05-01

    Thermal instabilities were identified in SONY-type lithium-ion cells and correlated with interactions of cell constituents and reaction products. Three temperature regions of interaction were identified and associated with the state of charge (degree of Li intercalation) of the cell. Anodes were shown to undergo exothermic reactions as low as 100 degree C involving the solid electrolyte interface (SEI) layer and the LiPF(6) salt in the electrolyte (EC-PC:DEC/IM LiPF(6)). These reactions could account for the thermal runaway observed in these cells beginning at 100 degree C. Exothermic reactions were also observed in the 200 degree C to 300 degree C region between the intercalated lithium anodes, the LiPF(6) salt, and the PVDF. These reactions were followed by a high-temperature reaction region, 300 degree C to 400 degree C, also involving the PVDF binder and the intercalated lithium anodes. The solvent was not directly involved in these reactions but served as a moderator and transport medium. Cathode exothermic reactions with the PVDF binder were observed above 200 degree C and increased with the state of charge (decreasing Li content). The stability of the PVDF binder as a function of electrochemical cycling was studied using FTIR. The infrared spectra from the extracts of both electrodes indicate that PVDF is chemically modified by exposure to the lithium cell electrolyte (as well as electrochemical cycling) in conjunction with NMP extraction. Preconditioning of PVDF to dehydrohalogenation, which may be occurring by reaction with LiPf(6), makes the PVDF susceptible to attack by a range of nucleophiles.

  9. Cation-controlled crystal growth of silver stearate: cryo-TEM investigation of lithium vs sodium stearate.

    PubMed

    Dong, Jingshan; McCormick, Alon V; Davis, H Ted; Whitcomb, David R

    2010-02-16

    Cryo-TEM, SAXS, and light microscopy techniques were used to probe the morphology and kinetics of silver stearate self-assembly and crystallization from the reaction of silver nitrate with lithium stearate. Unlike the reaction of sodium stearate with silver nitrate, which proceeds via micelle aggregation, the lithium stearate forms vesicles that drastically change the reaction kinetics of the silver stearate nucleation and self-assembly process. In addition, even with excess silver nitrate present, only about 80% of the lithium stearate can be converted to silver stearate. The presence of the residual lithium stearate inhibits the silver stearate crystal growth process. Consequently, no silver stearate micelle aggregates of any significant size form, unlike the system utilizing sodium stearate. Instead, significantly smaller silver stearate crystals result from lithium stearate compared to the silver stearate crystals from sodium stearate and provide an opportunity to further control silver stearate self-assembly and crystal growth.

  10. White light upconversion emission in Yb3+/ Er3+/ Tm3+ codoped oxy-fluoride lithium tungsten tellurite glass ceramics

    NASA Astrophysics Data System (ADS)

    Ansari, Ghizal F.; Mahajan, S. K.

    2012-02-01

    The bright white upconversion emission ( tri-colour UC) is generated in Er/Tm/Yb tri -doped oxy-fluoride lithium tungsten tellurite (TWLOF)glass ceramics containing crystalline phase LiYbF4 under the excitation of 980nm laser diode. The most appropriate combination of rare-earth ions (2mol% YbF3 1mol% ErF3 and 1mol%TmF3 )of glass ceramic sample has been determined to tune the primary colour (RGB and generate white light emission. By varying the pump power, intense and weak blue (487nm, 437nm), green (525nm and 545nm) and red (662nm) emission are simultaneously observed at room temperature. The dependence of upconversion emission intensity suggest that a theephoton process is responsible for the blue emission of Tm3+ ions and red emission due to both Tm3+ and Er3+ ions , while green emission originated from two photon processes in Er3+ ions. Also tri colour upconvesion and energy transfer in this glass ceramics sample were studied under 808nm laser diode excitation. The Upconversion mechanisms and Tm3+ ions plays role of both emitter and activator (transfer energy to Er) were discussed.

  11. Thin-film encapsulation of organic electronic devices based on vacuum evaporated lithium fluoride as protective buffer layer

    NASA Astrophysics Data System (ADS)

    Peng, Yingquan; Ding, Sihan; Wen, Zhanwei; Xu, Sunan; Lv, Wenli; Xu, Ziqiang; Yang, Yuhuan; Wang, Ying; Wei, Yi; Tang, Ying

    2017-03-01

    Encapsulation is indispensable for organic thin-film electronic devices to ensure reliable operation and long-term stability. For thin-film encapsulating organic electronic devices, insulating polymers and inorganic metal oxides thin films are widely used. However, spin-coating of insulating polymers directly on organic electronic devices may destroy or introduce unwanted impurities in the underlying organic active layers. And also, sputtering of inorganic metal oxides may damage the underlying organic semiconductors. Here, we demonstrated that by utilizing vacuum evaporated lithium fluoride (LiF) as protective buffer layer, spin-coated insulating polymer polyvinyl alcohol (PVA), and sputtered inorganic material Er2O3, can be successfully applied for thin film encapsulation of copper phthalocyanine (CuPc)-based organic diodes. By encapsulating with LiF/PVA/LiF trilayer and LiF/Er2O3 bilayer films, the device lifetime improvements of 10 and 15 times can be achieved. These methods should be applicable for thin-film encapsulation of all kinds of organic electronic devices. Moisture-induced hole trapping, and Al top electrode oxidation are suggest to be the origins of current decay for the LiF/PVA/LiF trilayer and LiF/Er2O3 bilayer films encapsulated devices, respectively.

  12. Photoluminescence of radiation-induced color centers in lithium fluoride thin films for advanced diagnostics of proton beams

    SciTech Connect

    Piccinini, M. Ampollini, A.; Picardi, L.; Ronsivalle, C.; Bonfigli, F.; Libera, S.; Vincenti, M. A.; Montereali, R. M.; Ambrosini, F.; Nichelatti, E.

    2015-06-29

    Systematic irradiation of thermally evaporated 0.8 μm thick polycrystalline lithium fluoride films on glass was performed by proton beams of 3 and 7 MeV energies, produced by a linear accelerator, in a fluence range from 10{sup 11} to 10{sup 15} protons/cm{sup 2}. The visible photoluminescence spectra of radiation-induced F{sub 2} and F{sub 3}{sup +} laser active color centers, which possess almost overlapping absorption bands at about 450 nm, were measured under laser pumping at 458 nm. On the basis of simulations of the linear energy transfer with proton penetration depth in LiF, it was possible to obtain the behavior of the measured integrated photoluminescence intensity of proton irradiated LiF films as a function of the deposited dose. The photoluminescence signal is linearly dependent on the deposited dose in the interval from 10{sup 3} to about 10{sup 6 }Gy, independently from the used proton energies. This behavior is very encouraging for the development of advanced solid state radiation detectors based on optically transparent LiF thin films for proton beam diagnostics and two-dimensional dose mapping.

  13. Low operating voltage n-channel organic field effect transistors using lithium fluoride/PMMA bilayer gate dielectric

    SciTech Connect

    Kumar, S.; Dhar, A.

    2015-10-15

    Highlights: • Alternative to chemically crosslinking of PMMA to achieve low leakage in provided. • Effect of LiF in reducing gate leakage through the OFET device is studied. • Effect of gate leakage on transistor performance has been investigated. • Low voltage operable and low temperature processed n-channel OFETs were fabricated. - Abstract: We report low temperature processed, low voltage operable n-channel organic field effect transistors (OFETs) using N,N′-Dioctyl-3,4,9,10-perylenedicarboximide (PTCDI-C{sub 8}) organic semiconductor and poly(methylmethacrylate) (PMMA)/lithium fluoride (LiF) bilayer gate dielectric. We have studied the role of LiF buffer dielectric in effectively reducing the gate leakage through the device and thus obtaining superior performance in contrast to the single layer PMMA dielectric devices. The bilayer OFET devices had a low threshold voltage (V{sub t}) of the order of 5.3 V. The typical values of saturation electron mobility (μ{sub s}), on/off ratio and inverse sub-threshold slope (S) for the range of devices made were estimated to be 2.8 × 10{sup −3} cm{sup 2}/V s, 385, and 3.8 V/decade respectively. Our work thus provides a potential substitution for much complicated process of chemically crosslinking PMMA to achieve low leakage, high capacitance, and thus low operating voltage OFETs.

  14. Formation of H a - hydrogen centers upon additive coloration of alkaline-earth fluoride crystals

    NASA Astrophysics Data System (ADS)

    Radzhabov, E. A.; Egranov, A. V.; Shendrik, R. Yu.

    2017-06-01

    The mechanism of coloration of alkaline-earth fluoride crystals CaF2, SrF2, and BaF2 in calcium vapors in an autoclave with a cold zone is studied. It was found that the pressure in the autoclave upon constant evacuation by a vacuum pump within the temperature range of 500-800°C increases due to evaporation of metal calcium. In addition to the optical-absorption bands of color centers in the additively colored undoped crystals or to the bands of divalent ions in the crystals doped with rare-earth Sm, Yb, and Tm elements, there appear intense bands in the vacuum ultraviolet region at 7.7, 7.0, and 6.025 eV in CaF2, SrF2, and BaF2, respectively. These bands belong to the Ha - hydrogen centers. The formation of hydrogen centers is also confirmed by the appearance of the EPR signal of interstitial hydrogen atoms after X-ray irradiation of the additively colored crystals. Grinding of the outer edges of the colored crystals leads to a decrease in the hydrogen absorption-band intensity with depth to complete disappearance. The rate of hydrogen penetration inside the crystal is lower than the corresponding rate of color centers (anion vacancies) by a factor of tens. The visible color density of the outer regions of the hydrogen-containing crystals is several times lower than that of the inner region due to the competition between the color centers and hydrogen centers.

  15. Lithium

    USGS Publications Warehouse

    Ober, J.

    1998-01-01

    The lithium industry can be divided into two sectors: ore concentrate producers and chemical producers. Ore concentrate producers mine lithium minerals. They beneficiate the ores to produce material for use in ceramics and glass manufacturing.

  16. Crystal and electronic structures of neptunium nitrides synthesized using a fluoride route.

    PubMed

    Silva, G W Chinthaka; Weck, Philippe F; Kim, Eunja; Yeamans, Charles B; Cerefice, Gary S; Sattelberger, Alfred P; Czerwinski, Kenneth R

    2012-02-15

    A low-temperature fluoride route was utilized to synthesize neptunium mononitride, NpN. Through the development of this process, two new neptunium nitride species, NpN(2) and Np(2)N(3), were identified. The NpN(2) and Np(2)N(3) have crystal structures isomorphous to those of UN(2) and U(2)N(3), respectively. NpN(2) crystallizes in a face-centered cubic CaF(2)-type structure with a space group of Fm3m and a refined lattice parameter of 5.3236(1) Å. The Np(2)N(3) adopts the body-centered cubic Mn(2)O(3)-type structure with a space group of Ia3. Its refined lattice parameter is 10.6513(4) Å. The NpN synthesis at temperatures ≤900 °C using the fluoride route discussed here was also demonstrated. Previous computational studies of the neptunium nitride system have focused exclusively on the NpN phase because no evidence was reported experimentally on the presence of NpN(x) systems. Here, the crystal structures of NpN(2) and Np(2)N(3) are discussed for the first time, confirming the experimental results by density functional calculations (DFT). These DFT calculations were performed within the local-density approximation (LDA+U) and the generalized-gradient approximation (GGA+U) corrected with an effective Hubbard parameter to account for the strong on-site Coulomb repulsion between Np 5f electrons. The effects of the spin-orbit coupling in the GGA+U calculations have also been investigated for NpN(2) and NpN.

  17. Crystal and Electronic Structures of Neptunium Nitrides Synthesized Using a Fluoride Route

    SciTech Connect

    Silva, G W Chinthaka M; Weck, Dr. Phil F.; Eunja, Dr. Kim; Yeamans, Dr. Charles B.; Cerefice, Gary S.; Sattelberger, Alfred P; Czerwinski, Ken R.

    2012-01-01

    A low-temperature fluoride route was utilized to synthesize neptunium mononitride, NpN. Through the development of this process, two new neptunium nitride species, NpN{sub 2} and Np{sub 2}N{sub 3}, were identified. The NpN{sub 2} and Np{sub 2}N{sub 3} have crystal structures isomorphous to those of UN{sub 2} and U{sub 2}N{sub 3}, respectively. NpN{sub 2} crystallizes in a face-centered cubic CaF{sub 2}-type structure with a space group of Fm3m and a refined lattice parameter of 5.3236(1) {angstrom}. The Np{sub 2}N{sub 3} adopts the body-centered cubic Mn{sub 2}O{sub 3}-type structure with a space group of Ia{bar 3}. Its refined lattice parameter is 10.6513(4) {angstrom}. The NpN synthesis at temperatures {le} 900 C using the fluoride route discussed here was also demonstrated. Previous computational studies of the neptunium nitride system have focused exclusively on the NpN phase because no evidence was reported experimentally on the presence of NpN{sub x} systems. Here, the crystal structures of NpN{sub 2} and Np{sub 2}N{sub 3} are discussed for the first time, confirming the experimental results by density functional calculations (DFT). These DFT calculations were performed within the local-density approximation (LDA+U) and the generalized-gradient approximation (GGA+U) corrected with an effective Hubbard parameter to account for the strong on-site Coulomb repulsion between Np 5f electrons. The effects of the spin-orbit coupling in the GGA+U calculations have also been investigated for NpN{sub 2} and NpN.

  18. Effect of Preparation Methods on Crystallization Behavior and Tensile Strength of Poly(vinylidene fluoride) Membranes

    PubMed Central

    Liu, Jie; Lu, Xiaolong; Wu, Chunrui

    2013-01-01

    Poly(vinylidene fluoride) (PVDF) membranes were prepared by non solvent induced phase separation (NIPS), melt spinning and the solution-cast method. The effect of preparation methods with different membrane formation mechanisms on crystallization behavior and tensile strength of PVDF membranes was investigated. Fourier transform infrared spectroscopy-attenuated total reflectance (FTIR-ATR) and X-ray diffraction (XRD) were employed to examine the crystal form of the surface layers and the overall membranes, respectively. Spherulite morphologies and thermal behavior of the membranes were studied by polarized light optical microscopy (PLO) and differential scanning calorimetry (DSC) separately. It was found that the crystallization behavior of PVDF membranes was closely related to the preparation methods. For membranes prepared by the NIPS method, the skin layers had a mixture of α and β phases, the overall membranes were predominantly α phase, and the total crystallinity was 60.0% with no spherulite. For melt spinning membranes, the surface layers also showed a mixture of α and β phases, the overall membranes were predominantly α phase. The total crystallinity was 48.7% with perfect spherulites. Whereas the crystallization behavior of solution-cast membranes was related to the evaporation temperature and the additive, when the evaporation temperature was 140 °C with a soluble additive in the dope solution, obvious spherulites appeared. The crystalline morphology of PVDF exerted a great influence on the tensile strength of the membranes, which was much higher with perfect spherulites. PMID:24957064

  19. [H 3tren] 3+ templated iron fluorides; synthesis, crystal structures and Mössbauer studies

    NASA Astrophysics Data System (ADS)

    Ali, Amor Ben; Grenèche, Jean-Marc; Leblanc, Marc; Maisonneuve, Vincent

    2009-09-01

    The hydrothermal synthesis, using tris-(2-ethylamino)amine ( tren) as a template, and the crystal structures of three new hybrid iron fluorides, (H 3O) 2·[H 3tren] 2·(FeF 6) 2·(FeF 5(H 2O))·2H 2O ( I), [H 3tren] 2·(FeF 6) 2·(FeF 2(H 2O) 4)·8H 2O ( II) and [H 3tren] 2·(FeF 6)·(F) 3·H 2O ( III), are reported. I, II, and III are triclinic ( P-1), monoclinic ( P2 1/ c) and orthorhombic ( I222), respectively. The structure of I is built up from isolated FeF 6 and FeF 5(H 2O) distorted octahedra separated by triprotonated [H 3tren] 3+ cations, disordered H 3O + cations and H 2O molecules. In II, Fe IIIF 6 and neutral [Fe IIF 2(H 2O) 4] octahedra form, together with [H 3tren] 3+ cations, infinite (100) layers separated by extra water molecules. The structure of III consists of isolated and disordered FeF 6 octahedra, fluoride anions F - connected to [H 3tren] 3+ cations and extra fluoride anions F - disordered with H 2O molecules. All [H 3tren] 3+ cations have a "spider" type conformation. 57Fe Mössbauer characterization shows that +III valence state can only be considered for iron cations in I and III and preliminary Mössbauer results are consistent with the presence of both +II and +III valences for iron cations in II, in agreement with the crystallographic results.

  20. Growth kinetics and bulk growth of inversely soluble lithium sulfate monohydrate single crystals and their characterization

    NASA Astrophysics Data System (ADS)

    Silambarasan, A.; Rajesh, P.; Ramasamy, P.

    2017-06-01

    To facilitate controlled nucleation rate to grow good quality inversely soluble LSMH single crystals, the nucleation kinetics was studied. The number of molecules in a critical nucleus and nucleation rate in LSMH crystallization process have been determined from experimentally measured induction period using classical nucleation theory. A good quality bulk size single crystal of Lithium sulfate monohydrate (LSMH) has been grown with higher growth rate by modified Sankaranarayanan - Ramasamy (SR) method. A systematic investigation on UV-Vis-NIR transmittance, second harmonic generation and thermoluminescence (TL) properties of LSMH single crystals has been carried out to evaluate the optical behavior of the LSMH single crystal. This work also investigates the third order nonlinear optical properties of the LSMH single crystals. Finally thermal behavior of the grown crystal was studied to know the first order phase transition in the grown LSMH single crystals.

  1. Growth, Structural And Optical Studies On Bis L-alanine Lithium Chloride (BLALC) Single Crystal

    NASA Astrophysics Data System (ADS)

    Rose, A. S. J. Lucia; Selvarajan, P.; Perumal, S.

    2011-10-01

    Bis L-alanine Lithium Chloride (BLALC) single crystals were grown successfully by solution method with slow evaporation technique at room temperature. Crystals of size 15 x 9 x 4 mm3 have been obtained in 28 days. The grown crystals were colourless and transparent. Single crystal X-ray diffraction (XRD) study showed that BLALC belongs to orthorhombic system with a non-centro-symmetric space group P212121. The crystallinity of BLALC crystal was confirmed by the powder X-ray diffraction study and diffraction peaks were indexed. The functional groups of the grown crystals have been identified by FTIR studies. UV-visible transmittance spectrum was recorded to study the optical transparency of BLALC crystal. The nonlinear optical (NLO) property of the grown crystal was confirmed by Kurtz-Perry powder technique.

  2. RETRACTED: Crystal growth and spectroscopic characterization of Aloevera amino acid added lithium sulfate monohydrate: A non-linear optical crystal

    NASA Astrophysics Data System (ADS)

    Manimekalai, R.; Antony Joseph, A.; Ramachandra Raja, C.

    2014-03-01

    This article has been retracted: please see Elsevier Policy on Article Withdrawal. This article has been retracted at the request of authors. According to the author we have reported Aloevera Amino Acid added Lithium sulphate monohydrate [AALSMH] crystal is a new nonlinear optical crystal. From the recorded high performance liquid chromatography spectrum, by matching the retention times with the known compounds, the amino acids present in our extract are identified as homocystine, isoleucine, serine, leucine and tyrosine. From the thin layer chromatography and colorimetric estimation techniques, presence of isoleucine was identified and it was also confirmed by NMR spectrum. From the above studies, we came to conclude that AALSMH is new nonlinear optical crystal. After further investigation, lattice parameter values of AALSMH are coinciding with lithium sulphate. Therefore we have decided to withdraw our paper. Sorry for the inconvenience and time spent.

  3. Microporous gel electrolytes based on amphiphilic poly(vinylidene fluoride-co-hexafluoropropylene) for lithium batteries

    NASA Astrophysics Data System (ADS)

    Yu, Shicheng; Chen, Lie; Chen, Yiwang; Tong, Yongfen

    2012-03-01

    Poly(vinylidene fluoride-co-hexafluoropropylene) grafted poly(poly(ethylene glycol) methyl ether methacrylate) (PVDF-HFP-g-PPEGMA) is simply prepared by single-step synthesis directly via atom transfer radical polymerization (ATRP) of poly(ethylene glycol) methyl ether methacrylate (PEGMA) from poly(vinylidene fluoride-co-hexafluoropropylene) (PVDF-HFP). Thermal, mechanical, swelling and electrochemical properties, as well as microstructures of the prepared polymer electrolytes, are evaluated and the effects of the various contents and average molecular weights of PEGMA on those properties are also been investigated. By phase inversion technique, the copolymer membranes tend to form well-defined microporous morphology with the increase of content and average molecular weight of PEGMA, due to the competition and cooperation between the hydrophilic PEGMA segments and hydrophobic PVDF-HFP. When these membranes are gelled with 1 M LiCF3SO3 in ethylene carbonate (EC)/propylene carbonate (PC) (1:1, v/v), their saturated electrolyte uptakes (up to 323.5%) and ion conductivities (up to 2.01 × 10-3 S cm-1) are dramatically improved with respect to the pristine PVDF-HFP, ascribing to the strong affinity of the hydrophilic PEGMA segments with the electrolytes. All the polymer electrolytes are electrochemically stable up to 4.7 V versus Li/Li+, and show good mechanical properties. Coin cells based on the polymer electrolytes show stable charge-discharge cycles and deliver discharge capacities to LiFePO4 is up to 156 mAh g-1.

  4. Non-Isothermal Calorimetric Studies of the Crystallization of Lithium Disilicate Glass

    NASA Technical Reports Server (NTRS)

    Ray, C. S.; Day, D. E.; Huang, W.; Narayan, K. Lakshmi; Cull, T. S.; Kelton, K. F.

    1996-01-01

    The influence of preannealing treatments on the polymorphic crystallization of lithium disilicate glasses is examined. As expected, glasses heated at different rates through the temperature range where there is significant nucleation develop widely different numbers of nuclei. This can dramatically influence the stability and transformation characteristics of the annealed glass. Non-isothermal differential scanning calorimetry (DSC) and differential thermal analysis (DTA) measurements are demonstrated to be useful to probe the nucleation behavior. The first systematic investigations of particle size effects on the non-isothermal transformation behavior are presented and discussed. Based on DTA and microscopy experiments, we show that small particles of lithium disilicate glasses crystallize primarily by surface crystallization. The relative importance of surface versus volume crystallization is examined by varying particle size, by introducing nucleating agents and by exposing glasses to atmospheres of different water content. These data are analyzed quantitatively using a numerical model developed in a second paper following in this volume.

  5. Microraman and Photorefractivity Study of Hafnium-Doped Lithium Niobate Crystals

    NASA Astrophysics Data System (ADS)

    Galinetto, Pietro; Rossella, Francesco; Minzioni, Paolo; Razzari, Luca; Cristiani, Ilaria; Degiorgio, Vittorio; Kokanyan, Edvard P.

    We present an investigation of the properties of HfO2-doped lithium niobate crystals, in view of their possible utilization as low-photorefractivity crystals for wavelength converters operating at room temperature. MicroRaman measurements indicate that the linewidth of a specific mode can be used as a local indicator of crystal composition, and show that the grown crystals present very good uniformity. The mechanism by which the photorefractivity is strongly reduced when the HfO2 concentration is above 4 mol% is studied by combining measurements of birefringence variation, under green-light illumination, with electrical phototransport data.

  6. High index fluoride materials for 193nm immersion lithography

    NASA Astrophysics Data System (ADS)

    Nawata, T.; Inui, Y.; Masada, I.; Nishijima, E.; Satoh, H.; Fukuda, T.

    2006-03-01

    We tried to investigate various kinds of metal fluoride materials which have higher gravity than CaF II and cubic crystal system, and we found out barium lithium fluoride (BaLiF 3) and potassium yttrium fluoride (KY 3F 10) as candidates for the last lens material. We have developed unique Czochralski (CZ) machines and techniques for the growth of large calcium fluoride single crystals. And we applied these technologies to the growth of fluoride high index materials. We have succeeded to grow the large BaLiF 3 single crystal with 120mm in diameter and a KY 3F 10 single crystal, and measured their basic properties such as refractive index, VUV transmittance, birefringence, and so on. As a result of our basic research, we found out that BaLiF 3 single crystal is transparent at VUV region, and the refractive index at 193nm is 1.64, and KY 3F 10 single crystal has the index of 1.59 at the wavelength of 193nm which is slightly higher than fused silica. We expect that these fluoride high index materials are useful for the last lens material of the next generation immersion lithography.

  7. Ultraviolet laser-induced submicron spatially resolved superhydrophilicity on single crystal lithium niobate surfaces

    SciTech Connect

    Muir, A. C.; Mailis, S.; Eason, R. W.

    2007-05-15

    Lithium niobate crystal surfaces become superhydrophilic after ultraviolet laser irradiation. The crystal surface hydrophilicity, which was assessed by the contact angle of a sessile drop of de-ionized water, was found to undergo a transition from mildly hydrophobic (contact angle {theta}{sub E}{approx_equal}50 degree sign ) to a superhydrophilic state ({theta}{sub E}<5 degree sign ). Patterning of the hydrophilicity at the micron and submicron ranges has been achieved by spatially modulating the illuminating laser beam.

  8. The asymmetry between the domain walls of periodically poled lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Kong, Yongfa; Xu, Jingjun; Li, Bing; Chen, Shaolin; Huang, Ziheng; Zhang, Ling; Liu, Shiguo; Yan, Wenbo; Liu, Hongde; Xie, Xiang; Shi, Lihong; Li, Xiaochun; Zhang, Guangyin

    2004-12-01

    The domain walls of periodically poled lithium niobate (PPLN) crystals were investigated using Raman spectrum mapping. The periodical changes of Raman shift in several Raman lines along the period of PPLN have been found. The experimental results show that the domain reversal has different degree of affection on its two neighbor regions, which is related to the asymmetry of crystal lattice. This phenomenon can be used to examine the periodical domain reversal of LN non-contacted, non-destructive and easily operated.

  9. Method of forming single crystals of beta silicon carbide using liquid lithium as a solvent

    DOEpatents

    Lundberg, Lynn B.

    1982-01-01

    A method of growing single crystals of beta SiC from solution using molten lithium as a solvent for polycrystalline SiC feed material. Reasonable growth rates are accomplished at temperatures in the range of about 1330.degree. C. to about 1500.degree. C.

  10. Elastic properties of poly(vinyldene fluoride) (PVDF) crystals: A density functional theory study

    NASA Astrophysics Data System (ADS)

    Pei, Yong; Zeng, Xiao Cheng

    2011-05-01

    We computed structural and elastic properties of totally nine phases of poly(vinyldene fluoride) (PVDF) crystals using the density-functional theory (DFT) method with and without inclusion of the dispersion corrections. In addition to the four known crystalline forms, mechanic properties of five theoretically predicted crystalline forms of PVDF are also investigated. The all-trans form Ip exhibits the largest cohesive energy, bulk, and Young's modulus among the nine crystalline forms. The DFT calculations suggest that the δ crystalline forms (IIIau, IIIpu, IIIpd, and IIIad) possess poor chain rigidity among the nine PVDF crystalline forms. In contrast, a change of relative orientation of PVDF chains does not lead to significant change in cohesive energy and mechanic properties. A comparison of the cohesive energies of nine crystalline forms of PVDF suggests that the theoretically proposed crystalline forms of PVDF are quite stable.

  11. Freestanding manganese dioxide nanosheet network grown on nickel/polyvinylidene fluoride coaxial fiber membrane as anode materials for high performance lithium ion batteries

    NASA Astrophysics Data System (ADS)

    Zhang, Yan; Luo, Zhongping; Xiao, Qizhen; Sun, Tianlei; Lei, Gangtie; Li, Zhaohui; Li, Xiaojing

    2015-11-01

    A novel manganese dioxide (MnO2) nanosheet network grown on nickel/polyvinylidene fluoride (Ni/PVDF) coaxial fiber membrane is successfully fabricated by a three-step route: the polyvinylidene fluoride fiber membrane is prepared by electrospinning method, and then the Ni(shell)/PVDF(core) coaxial fiber membrane with core-shell structure can be obtained by the electroless deposition, and finally the manganese dioxide nanosheet network grown on Ni/PVDF coaxial fiber membrane can be achieved by using a simple hydrothermal treatment. This as-prepared binder-free and flexible composite membrane is directly used as anode for lithium ion batteries. The excellent electrochemical performance of the composite membrane can be attributed to the unique combinative effects of nanosized MnO2 network and conductive Ni/PVDF fiber matrix as well as the porous structure of composite fiber membrane.

  12. Optimizing the performance of bandpass photon detectors for inverse photoemission: Transmission of alkaline earth fluoride window crystals

    SciTech Connect

    Thiede, Christian Schmidt, Anke B.; Donath, Markus

    2015-08-15

    Bandpass photon detectors are widely used in inverse photoemission in the isochromat mode at energies in the vacuum-ultraviolet spectral range. The energy bandpass of gas-filled counters is usually formed by the ionization threshold of the counting gas as high-pass filter and the transmission cutoff of an alkaline earth fluoride window as low-pass filter. The transmission characteristics of the window have, therefore, a crucial impact on the detector performance. We present transmission measurements in the vacuum-ultraviolet spectral range for alkaline earth fluoride window crystals in the vicinity of the transmission cutoff as a function of crystal purity, surface finish, surface contamination, temperature, and thickness. Our findings reveal that the transmission characteristics of the window crystal and, thus, the detector performance depend critically on these window parameters.

  13. Effect of the electron irradiation of lithium fluoride on the oxidation of CO molecules on surfaces of the Au/LiF/Mo(110) system

    NASA Astrophysics Data System (ADS)

    Magkoev, T. T.; Grigorkina, G. S.; Tvauri, I. V.; Ashkhotov, O. G.; Fukutani, K.

    2017-08-01

    Oxidation of CO molecules on the surfaces of gold nanoclusters formed on a lithium fluoride film is studied using infrared spectroscopy and a temperature-programmed reaction in vacuum at a partial pressure of molecular oxygen of 10-7 Torr. It is found that the rate of oxidation increases when gold clusters 3 nm in size form on the surface of a LiF film saturated with the F-centers created during electron irradiation. This is because the electronic state of gold clusters associated with F-centers differs from that of clusters on a defect-free LiF film.

  14. Study on effect of poly (ethylene oxide) addition and in-situ porosity generation on poly (vinylidene fluoride)-glass ceramic composite membranes for lithium polymer batteries

    NASA Astrophysics Data System (ADS)

    Shubha, Nageswaran; Prasanth, Raghavan; Hng, Huey Hoon; Srinivasan, Madhavi

    2014-12-01

    The effect of blending polyethylene oxide with poly (vinylidene fluoride)-lithium aluminum germanium phosphate (LAGP) composite and in-situ porosity generation on the electrochemical performance of polymer electrolytes based on non-woven fibrous mats is studied. Electrospinning process parameters are controlled to get a fibrous membrane consisting of bead-free, multilayered, three dimensional network structure of ultrafine fibers. The electrospun membranes are subjected to a preferential polymer dissolution process to prepare a highly porous structure. The membranes show high surface roughness with uniformly sized and distributed pores on the fibers. The membranes with good mechanical strength, thermal stability and high porosity exhibit high swelling when activated with liquid electrolyte. The prepared composite polymer electrolytes show high ionic conductivity. The addition of the glass ceramic improves the mechanical and thermal stability, while blending and in-situ porosity generation improves the ionic conductivity, charge-discharge performance, cycling stability, interface properties and compatibility with lithium electrode.

  15. Laser excitation of transversal and longitudinal polar modes in lithium niobate and tantalate crystals

    NASA Astrophysics Data System (ADS)

    Gorelik, Vladimir S.; Sidorov, Nikolay V.; Sverbil, Pavel P.; Vodchits, Alexander I.

    2016-11-01

    The excitation of longitudinal and transversal electromagnetic waves in lithium niobate and tantalate crystals is of interest for establish the conditions of coherent longitudinal and transversal waves generation in media and in vacuum. In this paper the results of laser excitation of transversal and longitudinal polar modes in these crystals are presented. We have measured spontaneous Raman spectra of lithium niobate and tantalate crystals in 0° (forward), 90°, and 180° (backward) scattering geometries. We have observed Raman peaks, related to fundamental transversal and longitudinal A1(Z) and E((X,Y) polar optical modes. In addition, there were pseudoscalar symmetry A2 peaks, forbidden by selection rules in Raman spectra for point group C3v. This was explained by reducing of the point group from C3v to C3 due to the presence of impurities in real crystals. Besides, the acoustic biphonon at low frequency has been observed. High intensity of spontaneous A1(Z)LO and A1(Z)TO Raman satellites gives the opportunity for generation of coherent longitudinal and transversal terahertz waves in lithium niobate and tantalate crystals with the help of Stimulated Raman Scattering under using high-power laser pumping. The presence of pseudoscalar and biphonons mode in low frequency region results in the strong interaction with fundamental soft mode and sharp central peak near the phase transition.

  16. Growth and characterization of pure and semiorganic nonlinear optical Lithium Sulphate admixtured l-alanine crystal

    NASA Astrophysics Data System (ADS)

    Vela, T.; Selvarajan, P.; Freeda, T. H.; Balasubramanian, K.

    2013-04-01

    Lithium sulphate admixtured l-alanine (LSLA) salt was synthesized and the solubility of the commercially available l-alanine and the synthesized LSLA sample was determined in de-ionized water at various temperatures. In accordance with the solubility data, the saturated aqueous solutions of l-alanine and lithium admixtured l-alanine were prepared separately and the single crystals of the samples were grown by the solution method with a slow evaporation technique. Studying single x-ray diffraction shows that pure and LSLA crystal belong to the orthorhombic system with a non-centrosymmetric space group P212121. Using the powder x-ray diffraction study, the crystallinity of the grown crystals is confirmed and the diffraction peaks are indexed. The various functional groups present in the pure and LSLA crystal are elucidated from Fourier transform infrared spectroscopy study. UV-visible transmittance is recorded to study the optical transmittance range for the grown crystals. The powder second harmonic generation test confirms the nonlinear optical property of the grown crystals. From the microhardness test, the hardness of the grown crystals is estimated. The dielectric behaviour, such as the dielectric constant and the loss of the sample, are measured as a function of temperature and frequency. The ac conductivity of the grown crystals is also studied and the activation energy is calculated.

  17. Shape of isolated domains in lithium tantalate single crystals at elevated temperatures

    SciTech Connect

    Shur, V. Ya. Akhmatkhanov, A. R.; Baturin, I. S.; Chezganov, D. S.; Lobov, A. I.; Smirnov, M. M.

    2013-12-09

    The shape of isolated domains has been investigated in congruent lithium tantalate (CLT) single crystals at elevated temperatures and analyzed in terms of kinetic approach. The obtained temperature dependence of the growing domain shape in CLT including circular shape at temperatures above 190 °C has been attributed to increase of relative input of isotropic ionic conductivity. The observed nonstop wall motion and independent domain growth after merging in CLT as opposed to stoichiometric lithium tantalate have been attributed to difference in wall orientation. The computer simulation has confirmed applicability of the kinetic approach to the domain shape explanation.

  18. Lithium argyrodites with phosphorus and arsenic: order and disorder of lithium atoms, crystal chemistry, and phase transitions.

    PubMed

    Kong, Shiao-Tong; Deiseroth, Hans-Jörg; Reiner, Christof; Gün, Ozgül; Neumann, Elmar; Ritter, Clemens; Zahn, Dirk

    2010-02-15

    Crystal chemical data of high- (HT) and low-temperature (LT) modifications of lithium argyrodites with the compositions Li(7)PCh(6) (Ch=S, Se), Li(6)PCh(5)X (X=Cl, Br, I), Li(6)AsS(5)Br, and Li(6)AsCh(5)I (Ch=S, Se) based on single-crystal, powder X-ray (113 Kcrystal chemical basis. The Ch/X partial structures remain nearly unchanged upon the reversible phase transitions. Crystal chemical and crystallographic relations between HT and LT modifications based on the Frank-Kasper model of tetrahedral close packing are discussed. X-ray single-crystal data for HT-Li(6)PS(5)I show the electron density of the disordered Li to be smeared out over an extended region preferably inside face-sharing double tetrahedra. A series of temperature-dependent powder neutron data for Li(6)PS(5)I gives clear evidence for an HT/LT phase transition at approximately 175 K with an ordering of the Li atoms in different polyhedra with coordination numbers between three and four.

  19. Change in the structural imperfection of lithium niobate crystals doped with zinc

    SciTech Connect

    Litvinova, V. A. Litvinova, M. N.

    2015-01-15

    The changes in the degree of structural imperfection of lithium niobate (LiNbO{sub 3}) single crystals with an increase in the Li content and doping with zinc (to 1 wt %) have been investigated by the nonlinear optics methods and Raman spectroscopy. The conversion of broadband IR radiation in LiNbO{sub 3} crystals under noncritical (90°) phase-matching condition with vector interactions implemented is investigated. It is shown that the conversion efficiency, spectral width, and the position of maximum in the converted radiation spectrum depend on the ratio R = Li/Nb in LiNbO{sub 3} crystal and the impurity concentration.

  20. Impact of ionic liquid-modified multiwalled carbon nanotubes on the crystallization behavior of poly(vinylidene fluoride).

    PubMed

    Xing, Chenyang; Zhao, Liping; You, Jichun; Dong, Wenyong; Cao, Xiaojun; Li, Yongjin

    2012-07-19

    The impact of pristine multiwalled carbon nanotubes (MWCNTs), an ionic liquid (IL), 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM][PF6], and the ionic liquid-modified MWCNTs (IL-MWCNTs) on the crystallization behavior of melt-crystallized poly(vinylidene fluoride) (PVDF) has been investigated. Pristine MWCNTs accelerate crystallization of PVDF as an efficient nucleation agent, while the formed crystals are mainly nonpolar α crystal form with few polar β crystals. Incorporation of only ionic liquid results in depression of the PVDF melt crystallization rate due to the miscibility of IL with PVDF but leads to a higher content of polar crystals (β and γ forms) than MWCNTs. The ionic liquid and MWCNTs show significant synergetic effects on both the nucleation and the formation of polar crystals for PVDF by melt crystallization. Addition of IL-MWCNTs not only improves the MWCNTs dispersion in PVDF matrix but also increases the overall crystallization rate of PVDF drastically. More important, the melt-crystallized PVDF nanocomposites with IL-MWCNTs show 100% polar polymorphs but no α crystal forms. To the best of our knowledge, this is the first report on the achievements of full polar crystal form in the melt-crystallized PVDF without mechanical deformation or electric field. The IL to MWCNTs ratio and the IL-MWCNTs loading content effects on the crystallization behavior of PVDF in the nanocomposites were also studied. It is considered that the specific interactions between >CF2 with the planar cationic imidazolium ring wrapped on the MWCNTs surface lead to the full zigzag conformations of PVDF; thus, nucleation in polar crystals (β and γ forms) lattice is achieved and full polar crystals are obtained by subsequent crystal growth from the nuclei.

  1. Dynamics of dipolar defects in rare earth-doped alkaline-earth fluoride crystals

    NASA Astrophysics Data System (ADS)

    Charnock, Forrest Taylor

    Alkaline-earth fluoride crystals such as SrF2 provide an excellent sample material for investigating the physics of point defects in crystal lattices. High quality crystals are easily grown, and they readily accept many dopant ions into the lattice, particularly rare earth ions. Rare earth dopant ions (typically trivalent) occupy substitutional sites in the lattice by replacing a Sr2+ ion. Due to the extra charge of the rare earth ion, charge compensation is often provided by an extra fluoride ion (F--) located in a nearby interstitial position. If located in the nearest-neighbor (nn) interstitial position, it forms a defect with C4n symmetry; if located in the next-nearest-neighbor (nnn) intersitial position, it forms a defect with C3n symmetry. Given sufficient thermal energy, this interstitial F ion can move to adjacent interstitial sites and hence reorient the defect. The rate w at which the ion moves from one interstitial site to another is well described by a simple Arrhenius expression: w=n0e-E/kT , where n0 is the attack frequency of the F-- and E is the activation energy. This motion can profoundly affect both the electronic polarizability of the material and the polarization of light emitted or absorbed by the rare earth ion. This thesis describes the normal mode motion of interstitial ions which may occupy either nn or nnn interstitial sites. Using electron paramagnetic resonance (EPR), I observed the relative populations of nn and nnn defects in SrF2 doped with Gd3+ as a function of temperature. These measurements show that dipolar reorientation of the nnn F occurs through the nn interstitial position. Not all interstitial F-- motion is thermally driven. Fluorescence depolarization measurements of SrF2:Pr3+ indicate that optically stimulating a Pr3+ may induce interstitial motion of a nn F--. Such motion was confirmed by showing that nn defects in SrF2:Pr3+ may be polarized at very low temperatures when the sample is illuminated with resonant light. I

  2. Development of a fast radiation detector based on barium fluoride scintillation crystal

    SciTech Connect

    Han, Hetong; Zhang, Zichuan; Weng, Xiufeng; Liu, Junhong; Zhang, Kan; Li, Gang; Guan, Xingyin

    2013-07-15

    Barium fluoride (BaF{sub 2}) is an inorganic scintillation material used for the detection of X/gamma radiation due to its relatively high density, equivalent atomic number, radiation hardness, and high luminescence. BaF{sub 2} has a potential capacity to be used in gamma ray timing experiments due to the prompt decay emission components. It is known that the light output from BaF{sub 2} has three decay components: two prompt of those at approximately 195 nm and 220 nm with a decay constant around 600-800 ps and a more intense, slow component at approximately 310 nm with a decay constant around 630 ns which hinders fast timing experiments. We report here the development of a fast radiation detector based on a BaF{sub 2} scintillation crystal employing a special optical filter device, a multiple reflection multi-path ultraviolet region short-wavelength pass light guides (MRMP-short pass filter) by using selective reflection technique, for which the intensity of the slow component is reduced to less than 1%. The methods used for this study provide a novel way to design radiation detector by utilizing scintillation crystal with several emission bands.

  3. Growth and characterization of new semiorganic nonlinear optical and piezoelectric lithium sulfate monohydrate oxalate single crystals

    SciTech Connect

    Yadav, Harsh; Sinha, Nidhi; Kumar, Binay

    2015-04-15

    Highlights: • A new semiorganic single crystal of LSO grown by slow evaporation technique. • Morphological studies of the LSO crystal deduced by BFDH law. • In the UV–vis spectrum wide transparent region and large band gap were found. • SHG is equal to KDP crystal and d{sub 33} was found to be equal to 6pC/N. • Grown crystal belongs to softer category. - Abstract: New semiorganic crystal of lithium sulfate monohydrate oxalate (LSO) for nonlinear application was synthesized by controlled slow evaporation method. The growth rate of various planes of the grown crystal was estimated by morphological study. Single crystal XRD analysis confirmed that the crystal belongs to triclinic lattice with space group P1. High transparency (∼95%) with large band gap (4.57 eV) was analyzed by UV–vis studies. FTIR and Raman spectroscopy were used to identify various functional groups present in the LSO crystal. SHG efficiency was found to be equal to the KDP crystal. Thermal stability (up to 117.54 °C) and melting point (242 °C) of the crystal were studied by TG-DTA. In dielectric measurements, the value of dielectric constant decreases with increase in frequency. Hardness studies confirmed soft nature of crystals. The piezoelectric coefficient was found to be 6pC/N along [0 0 1].

  4. Ultrathin two-dimensional atomic crystals as stable interfacial layer for improvement of lithium metal anode.

    PubMed

    Yan, Kai; Lee, Hyun-Wook; Gao, Teng; Zheng, Guangyuan; Yao, Hongbin; Wang, Haotian; Lu, Zhenda; Zhou, Yu; Liang, Zheng; Liu, Zhongfan; Chu, Steven; Cui, Yi

    2014-10-08

    Stable cycling of lithium metal anode is challenging due to the dendritic lithium formation and high chemical reactivity of lithium with electrolyte and nearly all the materials. Here, we demonstrate a promising novel electrode design by growing two-dimensional (2D) atomic crystal layers including hexagonal boron nitride (h-BN) and graphene directly on Cu metal current collectors. Lithium ions were able to penetrate through the point and line defects of the 2D layers during the electrochemical deposition, leading to sandwiched lithium metal between ultrathin 2D layers and Cu. The 2D layers afford an excellent interfacial protection of Li metal due to their remarkable chemical stability as well as mechanical strength and flexibility, resulting from the strong intralayer bonds and ultrathin thickness. Smooth Li metal deposition without dendritic and mossy Li formation was realized. We showed stable cycling over 50 cycles with Coulombic efficiency ∼97% in organic carbonate electrolyte with current density and areal capacity up to the practical value of 2.0 mA/cm(2)and 5.0 mAh/cm(2), respectively, which is a significant improvement over the unprotected electrodes in the same electrolyte.

  5. Identification of electron and hole traps in lithium tetraborate (Li{sub 2}B{sub 4}O{sub 7}) crystals: Oxygen vacancies and lithium vacancies

    SciTech Connect

    Swinney, M. W.; McClory, J. W.; Petrosky, J. C.; Yang Shan; Brant, A. T.; Halliburton, L. E.; Adamiv, V. T.; Burak, Ya. V.; Dowben, P. A.

    2010-06-15

    Electron paramagnetic resonance (EPR) and electron-nuclear double resonance (ENDOR) are used to identify and characterize electrons trapped by oxygen vacancies and holes trapped by lithium vacancies in lithium tetraborate (Li{sub 2}B{sub 4}O{sub 7}) crystals. Our study includes a crystal with the natural abundances of {sup 10}B and {sup 11}B and a crystal highly enriched with {sup 10}B. The as-grown crystals contain isolated oxygen vacancies, lithium vacancies, and copper impurities, all in nonparamagnetic charge states. During an irradiation at 77 K with 60 kV x-rays, doubly ionized oxygen vacancies trap electrons while singly ionized lithium vacancies and monovalent copper impurities trap holes. The vacancies return to their preirradiation charge states when the temperature of the sample is increased to approximately 90 K. Hyperfine interactions with {sup 10}B and {sup 11}B nuclei, observed between 13 and 40 K in the radiation-induced EPR and ENDOR spectra, provide models for the two vacancy-related defects. The electron trapped by an oxygen vacancy is localized primarily on only one of the two neighboring boron ions while the hole stabilized by a lithium vacancy is localized on a neighboring oxygen ion with nearly equal interactions with the two boron ions adjacent to the oxygen ion.

  6. Influence of sodium fluoride (NaF) on the crystallization and spectral properties of L-tyrosine

    NASA Astrophysics Data System (ADS)

    Thenmozhi, M.; Suguna, K.; Sekar, C.

    2011-12-01

    L-Tyrosine (C 9H 11NO 3) is an essential amino acid in living organisms. It is also a building unit in protein, takes part in bio-synthesis of hormones, neurotransmitters, pigments and one of the organic chemical constituents of urinary stones. L-Tyrosine has been crystallized in silica gel by double diffusion technique with and without the addition of NaF. The crystals had rosette-like shape. In case of fluoride addition, two types of crystals have formed: rosette like crystallites, at the gel-solution interface and reticulate type crystallites beneath the interface. XRD results confirmed that both the products are of L-tyrosine with identical crystal structures. Crystal structure, morphology, thermal and spectral properties are analyzed using powder X-ray diffraction (XRD), scanning electron microscopy (SEM), thermogravimetric and differential thermal analysis (TG-DTA), Fourier transform infrared spectroscopy (FTIR) and UV-vis transmittance studies. The TG-DTA results suggest that the thermal stability of L-tyrosine has markedly improved due to fluoride doping. Optical band gap energy of NaF grown L-tyrosine crystallite is estimated as 4.28 eV. Second harmonic generation efficiency test indicates that L-tyrosine crystals can be used for application in nonlinear optical devices.

  7. A computer study and photoelectric property analysis of potassium-doped lithium niobate single crystals.

    PubMed

    Wang, Wei; Wang, Rui; Zhang, Wen; Xing, Lili; Xu, Yanling; Wu, Xiaohong

    2013-09-14

    First-principles theory was used to design a potassium-doped lithium niobate single crystal. The structural, electronic, optical and ferroelectric properties of the potassium-doped LiNbO3 single crystal model have been investigated using a generalized gradient approximation within density functional theory. It was found that substitution with potassium drastically changed the optical and electronic nature of the crystal and that the band gap slightly decreases. A series of LiNbO3 single crystals doped with x mol% K (x = 0, 3, 6, 9, 12 mol%) were successfully grown using the Czochralski method. The crystals were characterized using powder X-ray diffraction, UV-vis-infrared absorption spectroscopy and a ferroelectric property test. The experimental test results were consistent with the calculated predictions.

  8. One-Step Synthesis of Titanium Oxyhydroxy-Fluoride Rods and Research on the Electrochemical Performance for Lithium-ion Batteries and Sodium-ion Batteries

    NASA Astrophysics Data System (ADS)

    Li, Biao; Gao, Zhan; Wang, Dake; Hao, Qiaoyan; Wang, Yan; Wang, Yongkun; Tang, Kaibin

    2015-10-01

    Titanium oxyhydroxy-fluoride, TiO0.9(OH)0.9F1.2 · 0.59H2O rods with a hexagonal tungsten bronze (HTB) structure, was synthesized via a facile one-step solvothermal method. The structure, morphology, and component of the products were characterized by X-ray powder diffraction (XRD), thermogravimetry (TG), scanning electron microscopy (SEM), transmission electron microscopy (TEM), high-resolution TEM (HRTEM), inductively coupled plasma optical emission spectroscopy (ICP-OES), ion chromatograph, energy-dispersive X-ray (EDX) analyses, and so on. Different rod morphologies which ranged from nanoscale to submicron scale were simply obtained by adjusting reaction conditions. With one-dimension channels for Li/Na intercalation/de-intercalation, the electrochemical performance of titanium oxyhydroxy-fluoride for both lithium-ion batteries (LIBs) and sodium-ion batteries (SIBs) was also studied. Electrochemical tests revealed that, for LIBs, titanium oxyhydroxy-fluoride exhibited a stabilized reversible capacity of 200 mAh g-1 at 25 mA g-1 up to 120 cycles in the electrode potential range of 3.0-1.2 V and 140 mAh g-1 at 250 mA g-1 up to 500 cycles, especially; for SIBs, a high capacity of 100 mAh g-1 was maintained at 25 mA g-1 after 115 cycles in the potential range of 2.9-0.5 V.

  9. Zirconium dioxide nanofilled poly(vinylidene fluoride-hexafluoropropylene) complexed with lithium trifluoromethanesulfonate as composite polymer electrolyte for electrochromic devices

    SciTech Connect

    Puguan, John Marc C.; Chinnappan, Amutha; Kostjuk, Sergei V.; Kim, Hern

    2015-09-15

    Highlights: • Successful synthesis of electrolyte by blending PVdF-HFP, ZrO{sub 2} and LiCF{sub 3}SO{sub 3}. • ZrO{sub 2} increased electrolyte conductivity by two orders of magnitude. • ZrO{sub 2} doubled bulk mechanical strength of electrolyte in terms of Young’s modulus. • Electrolytes gave a optimum optical transmittance of 52.6%. - Abstract: Poly(vinylidene fluoride-hexafluoropropylene) (PVdF-HFP) polymer electrolyte containing zirconium dioxide nanocrystals (ZrO{sub 2}-NC) and lithium trifluoromethanesulfonate (LiCF{sub 3}SO{sub 3}) has been synthesized using the conventional solution casting method. The addition of ZrO2-NC into the polymeric substrate gave remarkable properties in terms of the electrolyte’s ionic conductivity as well as its bulk mechanical strength. The enhanced amorphicity of the polymeric substrate due to ZrO{sub 2} and the nanofiller’s high dielectric constant make an excellent combination to increase the ionic conductivity (above 10{sup −4} S cm{sup −1}). Increasing the nanofiller content raises the ionic conductivity of the electrolyte by two orders of magnitude of which the optimum is 2.65 × 10{sup −4} S cm{sup −1} at 13.04 wt% ZrO{sub 2}-NC loading. Also, the Young’s modulus, an indicator of electrolyte’s mechanical stability, dramatically increased to 207 MPa upon loading 13.04 wt% ZrO{sub 2}-NC. Using UV–vis spectroscopy, the electrolytes with 13.04% ZrO{sub 2}-NC scanned from 200–800 nm wavelengths exhibited a maximum optical transmittance of 52.6% at 10 μm film thickness. The enhanced conductivity, high mechanical strength and reasonable optical transmittance shown by our composite polymer electrolyte make an excellent electrolyte for future energy saving smart windows such as electrochromic devices.

  10. Neutron imaging systems utilizing lithium-containing semiconductor crystals

    DOEpatents

    Stowe, Ashley C.; Burger, Arnold

    2017-04-25

    A neutron imaging system, including: a plurality of Li-III-VI.sub.2 semiconductor crystals arranged in an array, wherein III represents a Group III element and VI represents a Group VI element; and electronics operable for detecting and a charge in each of the plurality of crystals in the presence of neutrons and for imaging the neutrons. Each of the crystals is formed by: melting the Group III element; adding the Li to the melted Group III element at a rate that allows the Li and Group III element to react, thereby providing a single phase Li-III compound; and adding the Group VI element to the single phase Li-III compound and heating. Optionally, each of the crystals is also formed by doping with a Group IV element activator.

  11. Interdomain region in single-crystal lithium niobate bimorph actuators produced by light annealing

    SciTech Connect

    Kubasov, I. V. Timshina, M. S.; Kiselev, D. A.; Malinkovich, M. D.; Bykov, A. S.; Parkhomenko, Yu. N.

    2015-09-15

    The interdomain region of a bidomain strucrture formed in 127°-cut lithium niobate single crystals using light annealing has been studied by optical and scanning probe microscopies. A periodic subdomain structure on the 180° macrodomain wall is visualized by piezoresponse force microscopy. The piezoresponse signal (polarization) is shown to be a power-law function of the domain width with an exponent n = 0.53.

  12. Controlled composition modulation in potassium lithium tantalate niobate crystals grown by off-centered TSSG method

    NASA Astrophysics Data System (ADS)

    de Oliveira, C. E. M.; Orr, G.; Axelrold, N.; Agranat, A. J.

    2004-12-01

    Off-centered top-seeded solution growth (TSSG) method is demonstrated as an effective and simple way to generate controlled composition modulation in potassium lithium tantalate niobate (KLTN) single crystals. The changes in concentration were measured by differential interference contrast (DIC) microscopy. Large length with periodic modulations ranging from 1 to 5 μm in period was grown along a KLTN sample with period dispersion lower than 2%.

  13. Growth and characterization of lithium yttrium borate single crystals

    SciTech Connect

    Singh, A. K.; Singh, S. G.; Tyagi, M.; Desai, D. G.; Sen, Shashwati

    2014-04-24

    Single crystals of 0.1% Ce doped Li{sub 6}Y(BO{sub 3}){sub 3} have been grown using the Czochralski technique. The photoluminescence study of these crystals shows a broad emission at ∼ 420 nm corresponding to Ce{sub 3+} emission from 5d→4f energy levels. The decay profile of this emission shows a fast response of ∼ 28 ns which is highly desirable for detector applications.

  14. Pyroelectric field assisted ion migration induced by ultraviolet laser irradiation and its impact on ferroelectric domain inversion in lithium niobate crystals

    SciTech Connect

    Ying, C. Y. J.; Mailis, S.; Daniell, G. J.; Steigerwald, H.; Soergel, E.

    2013-08-28

    The impact of UV laser irradiation on the distribution of lithium ions in ferroelectric lithium niobate single crystals has been numerically modelled. Strongly absorbed UV radiation at wavelengths of 244–305 nm produces steep temperature gradients which cause lithium ions to migrate and result in a local variation of the lithium concentration. In addition to the diffusion, here the pyroelectric effect is also taken into account which predicts a complex distribution of lithium concentration along the c-axis of the crystal: two separated lithium deficient regions on the surface and in depth. The modelling on the local lithium concentration and the subsequent variation of the coercive field are used to explain experimental results on the domain inversion of such UV treated lithium niobate crystals.

  15. Structure and properties of quartz crystals grown from fluoride solutions: I. The morphology of basal pinacoid habit

    SciTech Connect

    Chuvyrov, A. N.; Mazitov, R. M.

    2008-09-15

    The mechanism of growth of quartz crystals from fluoride media has been investigated. It is shown by different independent methods (selective etching, X-ray diffraction analysis, optical microscopy) that the faceted forms of autonomous growth regions (trigonal pyramids formed on nonsingular crystal faces) are unstable and degenerate during growth. This degeneracy is accompanied by torsion deformation of autonomous growth regions and, as a result, formation of a series of hollow helical channels at boundaries of autonomous growth regions, whose axes make an angle of {approx}16{sup o} with the OZ axis, and their projections on the XOY plane are directed along the +X axes.

  16. XRD, TEM, IR, Raman and NMR Spectroscopy of In Situ Crystallization of Lithium Disilicate Glass

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Mogus-Milankovic, A.; Ray, C. S.; Lesher, C. E.; Youngman, R.; Day, D. E.

    2006-01-01

    The structure of a Li2O-2SiO2 (LS2) glass was investigated as a function of pressure and temperature up to 6 GPa and 750 C respectively, using XRD, TEM, IR, Raman and NMR spectroscopy. Glass densified at 6 GPa has an average Si-O-Si bond angle approx.7deg lower than that found in glass processed at 4.5 GPa. At 4.5 GPa, lithium disilicate crystallizes from the glass, while at 6 GPa a new high pressure form of lithium metasilicate crystallizes. The new phase, while having lithium metasilicate crystal symmetry, contains at least 4 different Si sites. NMR results for 6 GPa sample indicate the presence of Q4 species with (Q(sup 4))Si-O-Si(Q(sup 4)) bond angles of approx.157deg. This is the first reported occurrence of Q(sup 4) species with such large bond angles in alumina free alkali silicate glass. No five- or six- coordinated Si are found.

  17. XRD, TEM, IR, Raman and NMR Spectroscopy of In Situ Crystallization of Lithium Disilicate Glass

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Mogus-Milankovic, A.; Ray, C. S.; Lesher, C. E.; Youngman, R.; Day, D. E.

    2006-01-01

    The structure of a Li2O-2SiO2 (LS2) glass was investigated as a function of pressure and temperature up to 6 GPa and 750 C respectively, using XRD, TEM, IR, Raman and NMR spectroscopy. Glass densified at 6 GPa has an average Si-O-Si bond angle approx.7deg lower than that found in glass processed at 4.5 GPa. At 4.5 GPa, lithium disilicate crystallizes from the glass, while at 6 GPa a new high pressure form of lithium metasilicate crystallizes. The new phase, while having lithium metasilicate crystal symmetry, contains at least 4 different Si sites. NMR results for 6 GPa sample indicate the presence of Q4 species with (Q(sup 4))Si-O-Si(Q(sup 4)) bond angles of approx.157deg. This is the first reported occurrence of Q(sup 4) species with such large bond angles in alumina free alkali silicate glass. No five- or six- coordinated Si are found.

  18. Experimental study of multiwavelength parametric generation in a two-dimensional periodically poled lithium tantalate crystal.

    PubMed

    Lazoul, Mohamed; Boudrioua, Azzedine; Simohamed, Lotfy Mokhtar; Fischer, Alexis; Peng, Lung-Han

    2013-10-01

    In this Letter, we experimentally investigate multiwavelength parametric generation in two-dimensional second-order nonlinear photonic crystals. For this purpose, a 2D periodically poled lithium tantalate crystal with rectangular lattice was fabricated and characterized. We demonstrate multiple and simultaneous wavelength generation due to the contribution of different lattice vectors. Numerical simulations emphasize the agreement of our phase matching scheme with the experimental results and made it possible to assign the observed wavelengths to the reciprocal lattice vectors involved in the parametric generation process. Moreover, our results indicate that some signals are the result of the joint contribution of more than one lattice vector.

  19. Micro-buried spiral zone plate in a lithium niobate crystal

    NASA Astrophysics Data System (ADS)

    Tian, Zhen-Nan; Hua, Jian-Guan; Hao, Juan; Yu, Yan-Hao; Chen, Qi-Dai; Sun, Hong-Bo

    2017-01-01

    We present a micro-buried spiral zone plate (MBSZP) in the lithium niobate crystal fabricated with femtosecond laser direct writing technology. The microstructures of the MBSZP are buried under the surface of the crystal, which ensures the stability of the optical performance in various refractive index environments. The optical performances of imaging and focusing capabilities were demonstrated. In addition, the experiment showed good agreement with simulation results based on the optical wave propagation method. This novel optical element will have important applications in multistate information encoding, optical manipulation, quantum communication, and computation, especially in high integration, contact coupling, and variable refractive index environments.

  20. Topographic investigation of ferroelectric domain structures in periodically-poled lithium niobate crystals by a profilometer

    SciTech Connect

    Bazzan, M.; Argiolas, N.; Bernardi, A.; Mazzoldi, P.; Sada, C

    2003-10-15

    A topographic investigation of periodically poled lithium niobate (PPLN) crystals was performed by recording a map of the crystal surface after a selective etching process using a standard profilometer. A procedure to correct for the systematic error introduced by the finite size of the tip is discussed in detail so that the width of ferroelectric domains can be mapped with an estimated tolerance of about 3% along the whole length of the sample. The method is applied to a PPLN structure obtained by the Czochralski off-center technique.

  1. Single crystal growth by gel technique and characterization of lithium hydrogen tartrate

    NASA Astrophysics Data System (ADS)

    Ahmad, Nazir; Ahmad, M. M.; Kotru, P. N.

    2015-02-01

    Single crystal growth of lithium hydrogen tartrate by gel encapsulation technique is reported. Dependence of crystal count on gel density, gel pH, reactant concentration and temperature are studied and the optimum conditions for these crystals are worked out. The stoichiometric composition of the grown crystals is determined using EDAX/AES and CH analysis. The grown crystals are characterized by X-ray diffraction, FTIR and Uv-Visible spectroscopy. It is established that crystal falls under orthorhombic system and space group P222 with the cell parameters as: a=10.971 Å, b=13.125 Å and c=5.101 Å; α=90.5o, β=γ=90°. The morphology of the crystals as revealed by SEM is illustrated. Crystallite size, micro strain, dislocation density and distortion parameters are calculated from the powder XRD results of the crystal. UV-vis spectroscopy shows indirect allowed transition with an optical band gap of~4.83 eV. The crystals are also shown to have high transmittance in the entire visible region. Dependence of dielectric constant, dielectric loss and conductivity on frequency of the applied ac field is analyzed. The frequency-dependent real part of the complex ac conductivity is found to follow the universal dielectric response: σac (ω)~ωs. The trend in the variation of frequency exponent with frequency corroborates the fact that correlated barrier hopping is the dominant charge-transport mechanism in the present system.

  2. Effect of lithium chloride on spectral, optical, thermal and mechanical behaviour of bis thiourea zinc acetate crystals.

    PubMed

    Ruby Nirmala, L; Thomas Joseph Prakash, J

    2012-11-01

    Single crystals of pure bis thiourea zinc acetate (BTZA) and lithium chloride (LiCl) doped BTZA have been synthesized and grown successfully from aqueous solutions by slow evaporation technique. The single crystals thus grown were characterized by different techniques such as single crystal XRD, AAS, FT-IR, UV-Vis, TG/DTA and SHG test. The single crystal XRD study proved that the dopant has not changed the structure of the parent crystal. The AAS study confirmed the presence of lithium in the doped crystal. The FTIR study ascertained the metal coordination of lithium chloride doped BTZA through thiourea. The optical behavior of the doped crystal has been examined by UV spectral analysis. Thermal studies TGA & DTA of the doped crystal have been investigated and found that the doped crystal is thermally more stable than the pure crystal. The SHG test using Nd: YAG Laser confirmed the NLO activity of the pure and doped crystal. The obtained results are presented and discussed.

  3. Origin of UV-induced poling inhibition in lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Steigerwald, H.; Lilienblum, M.; von Cube, F.; Ying, Y. J.; Eason, R. W.; Mailis, S.; Sturman, B.; Soergel, E.; Buse, K.

    2010-12-01

    Short-term exposure of the +z face of LiNbO3 crystals to focused UV laser light leads to persistent inhibition of ferroelectric domain reversal at the irradiated area, a phenomenon referred to as “poling inhibition.” Different types of crystals (stoichiometric, congruent, or Mg-doped ones) are exposed, creating the so-called “latent state” and domain growth during subsequent electric-field poling is visualized. The latent state is robust against thermal annealing up to 250°C and uniform illumination. With the tip of a scanning force microscope the coercive field is mapped, showing not only the expected resistance against domain reversal in the UV-irradiated region but also easier poling adjacent to the UV-irradiated section. These results and theoretical estimates point to the following mechanism of poling inhibition: the UV light-induced heating results in a local reduction of the lithium concentration, via thermodiffusion. The required charge compensation is provided by UV-excited free electrons/holes. After cooling, the lithium ions become immobile, and the reduced lithium concentration causes a strong local increase in the coercive field in the exposed area, while the increased Li concentration next to this area reduces the coercive field.

  4. Growth and properties of Lithium Salicylate single crystals

    SciTech Connect

    Zaitseva, N; Newby, J; Hull, G; Saw, C; Carman, L; Cherepy, N; Payne, S

    2009-02-13

    An attractive feature of {sup 6}Li containing fluorescence materials that determines their potential application in radiation detection is the capture reaction with slow ({approx}< 100 keV) neutrons: {sup 6}Li + n = {sup 4}He + {sup 3}H + 4.8MeV. The use of {sup 6}Li-salicylate (LiSal, LiC{sub 6}H{sub 5}O{sub 3}) for thermal neutron detection was previously studied in liquid and polycrystalline scintillators. The studies showed that both liquid and polycrystalline LiSal scintillators could be utilized in pulse shape discrimination (PSD) techniques that enable separation of neutrons from the background gamma radiation. However, it was found that the efficiency of neutron detection using LiSal in liquid solutions was severely limited by its low solubility in commonly used organic solvents like, for example, toluene or xylene. Better results were obtained with neutron detectors containing the compound in its crystalline form, such as pressed pellets, or microscopic-scale (7-14 micron) crystals dispersed in various media. The expectation drown from these studies was that further improvement of pulse height, PSD, and efficiency characteristics could be reached with larger and more transparent LiSal crystals, growth of which has not been reported so far. In this paper, we present the first results on growth and characterization of relatively large, a cm-scale size, single crystals of LiSal with good optical quality. The crystals were grown both from aqueous and anhydrous (methanol) media, mainly for neutron detection studies. However, the results on growth and structural characterization may be interesting for other fields where LiSal, together with other alkali metal salicylates, is used for biological, medical, and chemical (as catalyst) applications.

  5. Selective crystallization with preferred lithium-ion storage capability of inorganic materials

    PubMed Central

    2012-01-01

    Lithium-ion batteries are supposed to be a key method to make a more efficient use of energy. In the past decade, nanostructured electrode materials have been extensively studied and have presented the opportunity to achieve superior performance for the next-generation batteries which require higher energy and power densities and longer cycle life. In this article, we reviewed recent research activities on selective crystallization of inorganic materials into nanostructured electrodes for lithium-ion batteries and discuss how selective crystallization can improve the electrode performance of materials; for example, selective exposure of surfaces normal to the ionic diffusion paths can greatly enhance the ion conductivity of insertion-type materials; crystallization of alloying-type materials into nanowire arrays has proven to be a good solution to the electrode pulverization problem; and constructing conversion-type materials into hollow structures is an effective approach to buffer the volume variation during cycling. The major goal of this review is to demonstrate the importance of crystallization in energy storage applications. PMID:22353373

  6. Selective crystallization with preferred lithium-ion storage capability of inorganic materials.

    PubMed

    Liu, Fei; Song, Shuyan; Xue, Dongfeng; Zhang, Hongjie

    2012-02-21

    Lithium-ion batteries are supposed to be a key method to make a more efficient use of energy. In the past decade, nanostructured electrode materials have been extensively studied and have presented the opportunity to achieve superior performance for the next-generation batteries which require higher energy and power densities and longer cycle life. In this article, we reviewed recent research activities on selective crystallization of inorganic materials into nanostructured electrodes for lithium-ion batteries and discuss how selective crystallization can improve the electrode performance of materials; for example, selective exposure of surfaces normal to the ionic diffusion paths can greatly enhance the ion conductivity of insertion-type materials; crystallization of alloying-type materials into nanowire arrays has proven to be a good solution to the electrode pulverization problem; and constructing conversion-type materials into hollow structures is an effective approach to buffer the volume variation during cycling. The major goal of this review is to demonstrate the importance of crystallization in energy storage applications.

  7. Structural, optical and dielectric studies of novel non-linear Bisglycine Lithium Nitrate piezoelectric single crystal

    NASA Astrophysics Data System (ADS)

    Dalal, Jyoti; Sinha, Nidhi; Kumar, Binay

    2014-11-01

    The novel non-linear semiorganic Bisglycine Lithium Nitrate (BGLiN) single crystals were grown by slow evaporation technique. The structural analysis revealed that it belongs to non-centrosymmetric orthorhombic structure. The presence of various functional groups in the grown crystal was confirmed by FTIR and Raman analysis. Surface morphology of the grown crystal was studied by scanning electron microscopy. The optical studies show that crystal has good transmittance (more than 80%) in the entire visible region and a wide band gap (5.17 eV). The optical constants such as extinction coefficient (K), the reflectance (R) and refractive index (n) as a function of photon energy were calculated from the optical measurements. With the help of these optical constants the electric susceptibility (χc) and both the real (εr) and imaginary (εi) parts of the dielectric constants were also calculated which are required to develop optoelectronic devices. In photoluminescence studies, a broad emission band centered at 404 nm was found in addition to a small band at 352 nm. A broad transition (from 29 to 33 °C) was observed with low dielectric constant value. A high piezoelectric charge coefficient (d33) of 14 pC/N was measured at room temperature which implies its usefulness for various sensor applications. The second harmonic generation efficiency of crystal was found to be 1.5 times to that of KDP. From thermo gravimetric analysis and differential thermal analysis, thermal stability and melting point (246 °C) were investigated. The dielectric behavior, optical characterization, piezoelectric behavior and the non-linear optical properties of the Bisglycine Lithium Nitrate single crystals were reported for the first time which established the usefulness of these crystals for various piezo- and opto-electronics applications.

  8. Electro-Spun Poly(vinylidene fluoride) Nanofiber Web as Separator for Lithium Ion Batteries: Effect of Pore Structure and Thickness.

    PubMed

    Lim, Seung-Gyu; Jo, Hye-Dam; Kim, Chan; Kim, Hee-Tak; Chang, Duck-Rye

    2016-01-01

    Electro-spun nanofiber web is highly attractive as a separator for lithium ion batteries because of its high electrical properties. In moving toward wider battery applications of the nanofiber separators, a deeper understanding on the structure and property relationship is highly meaningful. In this regard, we prepared electro-spun poly(vinylidene fluoride) (PVdF) webs with various thicknesses (10.5~100 µm) and investigated their structures and electrochemical performances. As the thickness of the web is decreased, a decrease of porosity and an increase of pore size are resulted in. For the 10.5 µm-thick separator, a minor short-circuit was detected, stressing the importance of reducing pore-size on prevention of short-circuit. However, above the thickness of 21 µm, well-connected, submicron-sized pores are generated, and, with lowering the separator thickness, discharge capacity and rate capability are enhanced owing to the lowered area-specific resistance.

  9. Hydrothermal Crystal Growth of Lithium Tetraborate and Lithium Gamma-Metaborate

    DTIC Science & Technology

    2014-03-27

    Irradiation ,” Oak Ridge National Laboratory, Tech. Rep., 2000. [58] J. M. Mann, “Hydrothermal Crystal Growth of Tetravalent and Pentavalent Metal Oxides,” Ph.D...Two further operations become permissible: screw dislocations and glide planes. Both are compound motions, much like the improper rotation of the... metal , while notably symmetric in their own right, give rise to isotropic, or spherically symmetric, conductivity. Other aspects directly related to the

  10. Decomposition of the fluoroethylene carbonate additive and the glue effect of lithium fluoride products for the solid electrolyte interphase: an ab initio study.

    PubMed

    Okuno, Yukihiro; Ushirogata, Keisuke; Sodeyama, Keitaro; Tateyama, Yoshitaka

    2016-03-28

    Additives in the electrolyte solution of lithium-ion batteries (LIBs) have a large impact on the performance of the solid electrolyte interphase (SEI) that forms on the anode and is a key to the stability and durability of LIBs. We theoretically investigated effects of fluoroethylene carbonate (FEC), a representative additive, that has recently attracted considerable attention for the enhancement of cycling stability of silicon electrodes and the improvement of reversibility of sodium-ion batteries. First, we intensively examined the reductive decompositions by ring-opening, hydrogen fluoride (HF) elimination to form a vinylene carbonate (VC) additive and intermolecular chemical reactions of FEC in the ethylene carbonate (EC) electrolyte, by using density functional theory (DFT) based molecular dynamics and the blue-moon ensemble technique for the free energy profile. The results show that the most plausible product of the FEC reductive decomposition is lithium fluoride (LiF), and that the reactivity of FEC to anion radicals is found to be inert compared to the VC additive. We also investigated the effects of the generated LiF on the SEI by using two model systems; (1) LiF molecules distributed in a model aggregate of organic SEI film components (SFCs) and (2) a LiF aggregate interfaced with the SFC aggregate. DFT calculations of the former system show that F atoms form strong bindings with the Li atoms of multiple organic SFC molecules and play as a joint connecting them. In the latter interface system, the LiF aggregate adsorbs the organic SFCs through the F-Li bindings. These results suggest that LiF moieties play the role of glue in the organic SFC within the SEI film. We also examined the interface structure between a LiF aggregate and a lithiated silicon anode, and found that they are strongly bound. This strong binding is likely to be related to the effectiveness of the FEC additive in the electrolyte for the silicon anode.

  11. Research on the mechanical stability of high laser resistant coatings on lithium triborate crystal.

    PubMed

    Zhang, Jinlong; Bu, Xiaoqing; Ma, Bin; Jiao, Hongfei; Cheng, Xinbin; Wang, Zhanshan

    2017-02-01

    The thermomechanical property of the hafnium/silica antireflection (AR) coatings on lithium triborate (LBO) crystal was investigated by simulation and experiment. From the analysis of the stress and fracture toughness, it was found that the crack originated due to the high tensile stress in hafnium coating. Then we proposed the approaches of decreasing the deposition temperature and substituting the hafnium layers with alumina to improve the mechanical stability of AR coatings on LBO crystals, and cracks were effectively suppressed. The laser damage threshold of different coatings on LBO crystal was tested, and it illustrated that the alumina/silica coatings possess better laser resistance than hafnium/silica AR coatings deposited in low deposition temperature.

  12. The photorefractive characteristics of bismuth-oxide doped lithium niobate crystals

    SciTech Connect

    Zheng, Dahuai; Yao, Jiaying; Kong, Yongfa; Liu, Shiguo; Zhang, Ling; Chen, Shaolin; Xu, Jingjun

    2015-01-15

    Bismuth-doped lithium niobate (LN:Bi) crystals were grown by Czochralski method and their optical damage resistance, photorefraction, absorption spectra, and defect energy levels were investigated. The experimental results indicate that the photorefractive properties of LN:Bi were enhanced as compared with congruent one, the photorefractive response time was greatly shortened, the photorefractive sensitivity was increased, and the diffraction efficiency of near-stoichiometric LN:Bi (SLN:Bi) reached 31.72% and 49.08% at 532 nm and 488 nm laser, respectively (light intensity of 400 mW/cm{sup 2}). An absorption peak at about 350 nm was observed in the absorption spectrum of LN:Bi. And the defect energy levels simulation indicates new defect levels appear in the forbidden gap of LN:Bi crystals. Therefore bismuth can act as photorefractive centers in LN crystals.

  13. The photorefractive characteristics of bismuth-oxide doped lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Zheng, Dahuai; Kong, Yongfa; Liu, Shiguo; Yao, Jiaying; Zhang, Ling; Chen, Shaolin; Xu, Jingjun

    2015-01-01

    Bismuth-doped lithium niobate (LN:Bi) crystals were grown by Czochralski method and their optical damage resistance, photorefraction, absorption spectra, and defect energy levels were investigated. The experimental results indicate that the photorefractive properties of LN:Bi were enhanced as compared with congruent one, the photorefractive response time was greatly shortened, the photorefractive sensitivity was increased, and the diffraction efficiency of near-stoichiometric LN:Bi (SLN:Bi) reached 31.72% and 49.08% at 532 nm and 488 nm laser, respectively (light intensity of 400 mW/cm2). An absorption peak at about 350 nm was observed in the absorption spectrum of LN:Bi. And the defect energy levels simulation indicates new defect levels appear in the forbidden gap of LN:Bi crystals. Therefore bismuth can act as photorefractive centers in LN crystals.

  14. Single crystal growth from separated educts and its application to lithium transition-metal oxides

    PubMed Central

    Freund, F.; Williams, S. C.; Johnson, R. D.; Coldea, R.; Gegenwart, P.; Jesche, A.

    2016-01-01

    Thorough mixing of the starting materials is the first step of a crystal growth procedure. This holds true for almost any standard technique, whereas the intentional separation of educts is considered to be restricted to a very limited number of cases. Here we show that single crystals of α-Li2IrO3 can be grown from separated educts in an open crucible in air. Elemental lithium and iridium are oxidized and transported over a distance of typically one centimeter. In contrast to classical vapor transport, the process is essentially isothermal and a temperature gradient of minor importance. Single crystals grow from an exposed condensation point placed in between the educts. The method has also been applied to the growth of Li2RuO3, Li2PtO3 and β-Li2IrO3. A successful use of this simple and low cost technique for various other materials is anticipated. PMID:27748402

  15. Single crystal growth from separated educts and its application to lithium transition-metal oxides

    NASA Astrophysics Data System (ADS)

    Freund, F.; Williams, S. C.; Johnson, R. D.; Coldea, R.; Gegenwart, P.; Jesche, A.

    2016-10-01

    Thorough mixing of the starting materials is the first step of a crystal growth procedure. This holds true for almost any standard technique, whereas the intentional separation of educts is considered to be restricted to a very limited number of cases. Here we show that single crystals of α-Li2IrO3 can be grown from separated educts in an open crucible in air. Elemental lithium and iridium are oxidized and transported over a distance of typically one centimeter. In contrast to classical vapor transport, the process is essentially isothermal and a temperature gradient of minor importance. Single crystals grow from an exposed condensation point placed in between the educts. The method has also been applied to the growth of Li2RuO3, Li2PtO3 and β-Li2IrO3. A successful use of this simple and low cost technique for various other materials is anticipated.

  16. Low temperature dc electrical conduction in reduced lithium niobate single crystals

    NASA Astrophysics Data System (ADS)

    Dhar, Ajay; Singh, Nidhi; Singh, Rajiv K.; Singh, Ramadhar

    2013-01-01

    The direct current (dc) electrical conductivity of unreduced and reduced lithium niobate (LiNbO3) single crystals has been measured at room temperature (˜300 K). The dc conductivity and activation energy show strong dependence on the degree of oxygen reduction in LiNbO3 single crystals. The dc conductivity exhibits a peak as a function of increasing degree of oxygen reduction. These results have been analysed assuming small polaron hopping conduction between Nb4+ and Nb5+ ion sites. The temperature dependence of dc conductivity of reduced LiNbO3 single crystal, exhibiting the highest dc conductivity, has been examined in the temperature range 77-373 K. The observed dc conductivity data has been analyzed and explained in terms of Mott’s variable range hopping (VRH) conduction model involving a single phonon hopping process.

  17. Strong tendency of homeotropic alignment and anisotropic lithium ion conductivity of sulfonate functionalized zwitterionic imidazolium ionic liquid crystals.

    PubMed

    Rondla, Rohini; Lin, Joseph C Y; Yang, C T; Lin, Ivan J B

    2013-09-17

    Here, we report the first attempt to investigate the liquid crystal (LC) behavior of SO3(-) functionalized imidazolium zwitterionic (SO3(-)ImZI) salts, which display homeotropic alignment on a glass slide without the aid of any aligning approach. Doping lithium salt to ImZI salts lowers the melting temperatures and raises the clearing temperatures substantially to form room temperature ImZILCs. Excellent anisotropic lithium ion conductivity is achieved; which is strengthened by their tendency for homeotropic alignment.

  18. Crystal structures of model lithium halides in bulk phase and in clusters

    NASA Astrophysics Data System (ADS)

    Lanaro, G.; Patey, G. N.

    2017-04-01

    We employ lattice energy calculations and molecular dynamics simulations to compare the stability of wurtzite and rock salt crystal structures of four lithium halides (LiF, LiCl, LiBr, and LiI) modeled using the Tosi-Fumi and Joung-Cheatham potentials, which are models frequently used in simulation studies. Both infinite crystals and finite clusters are considered. For the Tosi-Fumi model, we find that all four salts prefer the wurtzite structure both at 0 K and at finite temperatures, in disagreement with experiments, where rock salt is the stable structure and wurtzite exists as a metastable state. For Joung-Cheatham potentials, rock salt is more stable for LiF and LiCl, but the wurtzite structure is preferred by LiBr and LiI. It is clear that the available lithium halide force fields need improvement to bring them into better accord with the experiment. Finite-size clusters that are more stable as rock salt in the bulk phase tend to solidify as small rock salt crystals. However, small clusters of salts that prefer the wurtzite structure as bulk crystals tend to form structures that have hexagonal motifs, but are not finite-size wurtzite crystals. We show that small wurtzite structures are unstable due to the presence of a dipole and rearrange into more stable, size-dependent structures. We also show that entropic contributions can act in favor of the wurtzite structure at higher temperatures. The possible relevance of our results for simulation studies of crystal nucleation from melts and/or aqueous solutions is discussed.

  19. Comment on the paper: "Crystal growth and spectroscopic characterization of Aloevera amino acid added lithium sulfate monohydrate: a non-linear optical crystal".

    PubMed

    Srinivasan, Bikshandarkoil R

    2015-01-05

    The title paper (Manimekalai et al., 2014) reports a slow evaporation solution growth of a so called 'Aloevera amino acid added lithium sulfate monohydrate' (AALSMH) crystal. In this communication, many points of criticism, concerning the crystal growth, NMR spectrum and X-ray powder pattern of this so called AALSMH nonlinear optical crystal are highlighted. Copyright © 2014 Elsevier B.V. All rights reserved.

  20. One-Step Synthesis of Titanium Oxyhydroxy-Fluoride Rods and Research on the Electrochemical Performance for Lithium-ion Batteries and Sodium-ion Batteries.

    PubMed

    Li, Biao; Gao, Zhan; Wang, Dake; Hao, Qiaoyan; Wang, Yan; Wang, Yongkun; Tang, Kaibin

    2015-12-01

    Titanium oxyhydroxy-fluoride, TiO0.9(OH)0.9F1.2 · 0.59H2O rods with a hexagonal tungsten bronze (HTB) structure, was synthesized via a facile one-step solvothermal method. The structure, morphology, and component of the products were characterized by X-ray powder diffraction (XRD), thermogravimetry (TG), scanning electron microscopy (SEM), transmission electron microscopy (TEM), high-resolution TEM (HRTEM), inductively coupled plasma optical emission spectroscopy (ICP-OES), ion chromatograph, energy-dispersive X-ray (EDX) analyses, and so on. Different rod morphologies which ranged from nanoscale to submicron scale were simply obtained by adjusting reaction conditions. With one-dimension channels for Li/Na intercalation/de-intercalation, the electrochemical performance of titanium oxyhydroxy-fluoride for both lithium-ion batteries (LIBs) and sodium-ion batteries (SIBs) was also studied. Electrochemical tests revealed that, for LIBs, titanium oxyhydroxy-fluoride exhibited a stabilized reversible capacity of 200 mAh g(-1) at 25 mA g(-1) up to 120 cycles in the electrode potential range of 3.0-1.2 V and 140 mAh g(-1) at 250 mA g(-1) up to 500 cycles, especially; for SIBs, a high capacity of 100 mAh g(-1) was maintained at 25 mA g(-1) after 115 cycles in the potential range of 2.9-0.5 V.

  1. Studying effect of MoO3 on elastic and crystallization behavior of lithium diborate glasses

    NASA Astrophysics Data System (ADS)

    Shaaban, KH. S.; Abo-naf, S. M.; Abd Elnaeim, A. M.; Hassouna, M. E. M.

    2017-06-01

    The effect of MoO3 addition on the crystallization characteristics of 2Al2O3-23Li2O-(75 - x) B2O3 glass (where x MoO3 = 0, 10, 20, and 40 mol %) has been investigated. The compositional dependence of the glass transition ( T g), and crystallization ( T c) temperatures was determined by the differential thermal analysis (DTA). It was found that both the T g and T c decrease with increasing MoO3 content. The amorphous nature of the as-quenched glass and crystallinity of the produced glass-ceramics were confirmed by X-ray powder diffraction (XRD) analysis. Glass-ceramics embedded with diomignite (lithium diborate, Li2B4O7) were produced from all investigated glasses by heat-treating the as-quenched glasses at the appropriate temperatures obtained from the DTA traces. Addition of MoO3 to the glass composition at 10% MoO3, causes the formation of lithium molybdenum oxide (Li4MoO5) crystalline phase in addition to the diomignite phase. Increasing MoO3 content to 20% causes a phase transformation of lithium molybdenum oxide from the (Li4MoO5) to the (Li2MoO4) phase and the formation of another lithium borate (Li4B2O5) phase in addition to the diomignite. Further increase of MoO3 content to 40% results in another phase transformation to the lithium aluminum molybdenum oxide [LiAl(MoO4)2], and, in this case, the molybdenum content was excess enough to crystallize the molybdate (MoO3) itself. Scanning electron microscopy (SEM) was used to characterize the morphology and microstructure of the formed solid solution phases. The values of the T g decrease with increasing the MoO3 content. The ultrasonic wave velocities and elastic moduli were determined using the pulse-echo method. Both velocities ( v L and v T) were increased as the MoO3 content, this increase can be attributed to the higher bond strength of Mo-O (607 kJ mol-1) than that of B-O (392 kJ mol-1).

  2. Solid sampling determination of magnesium in lithium niobate crystals by graphite furnace atomic absorption spectrometry

    NASA Astrophysics Data System (ADS)

    Dravecz, Gabriella; Laczai, Nikoletta; Hajdara, Ivett; Bencs, László

    2016-12-01

    The vaporization/atomization processes of Mg in high-resolution continuum source graphite furnace atomic absorption spectrometry (HR-CS-GFAAS) were investigated by evaporating solid (powder) samples of lithium niobate (LiNbO3) optical single crystals doped with various amounts of Mg in a transversally heated graphite atomizer (THGA). Optimal analytical conditions were attained by using the Mg I 215.4353 nm secondary spectral line. An optimal pyrolysis temperature of 1500 °C was found for Mg, while the compromise atomization temperature in THGAs (2400 °C) was applied for analyte vaporization. The calibration was performed against solid (powered) lithium niobate crystal standards. The standards were prepared with exactly known Mg content via solid state fusion of the oxide components of the matrix and analyte. The correlation coefficient (R value) of the linear calibration was not worse than 0.9992. The calibration curves were linear in the dopant concentration range of interest (0.74-7.25 mg/g Mg), when dosing 3-10 mg of the powder samples into the graphite sample insertion boats. The Mg content of the studied 19 samples was in the range of 1.69-4.13 mg/g. The precision of the method was better than 6.3%. The accuracy of the results was verified by means of flame atomic absorption spectrometry with solution sample introduction after digestion of several crystal samples.

  3. Efficient visible laser emission of GaN laser diode pumped Pr-doped fluoride scheelite crystals.

    PubMed

    Cornacchia, F; Di Lieto, A; Tonelli, M; Richter, A; Heumann, E; Huber, G

    2008-09-29

    In the present work we report on the growth, spectroscopy and laser results of diode pumped Pr-doped LiYF(4), LiLuF(4) and LiGdF(4) fluoride, scheelite-type structure crystals. We measured the polarisation dependent absorption and emission properties as well as the decay time of the (3)P(0) level. Exploiting the (3)P(2) absorption around 444 nm, we obtained efficient laser emission under GaN laser diode pumping on several transitions from the green to the near infrared wavelength range.

  4. Poly(vinylidene fluoride) (PVDF) Binder Degradation in Li–O2 Batteries: A Consideration for the Characterization of Lithium Superoxide

    DOE PAGES

    Papp, Joseph K.; Forster, Jason D.; Burke, Colin M.; ...

    2017-02-27

    We show that a common Li–O2 battery cathode binder, poly(vinylidene fluoride) (PVDF), degrades in the presence of reduced oxygen species during Li–O2 discharge when adventitious impurities are present. This degradation process forms products that exhibit Raman shifts (~1133 and 1525 cm–1) nearly identical to those reported to belong to lithium superoxide (LiO2), complicating the identification of LiO2 in Li–O2 batteries. We show that these peaks are not observed when characterizing extracted discharged cathodes that employ poly(tetrafluoroethylene) (PTFE) as a binder, even when used to bind iridium-decorated reduced graphene oxide (Ir-rGO)-based cathodes similar to those that reportedly stabilize bulk LiO2 formation.more » We confirm that for all extracted discharged cathodes on which the 1133 and 1525 cm–1 Raman shifts are observed, only a 2.0 e–/O2 process is identified during the discharge, and lithium peroxide (Li2O2) is predominantly formed (along with typical parasitic side product formation). In conclusion, our results strongly suggest that bulk, stable LiO2 formation via the 1 e–/O2 process is not an active discharge reaction in Li–O2 batteries.« less

  5. Closely packed x-poly(ethylene glycol diacrylate) coated polyetherimide/poly(vinylidene fluoride) fiber separators for lithium ion batteries with enhanced thermostability and improved electrolyte wettability

    NASA Astrophysics Data System (ADS)

    Zhai, Yunyun; Xiao, Ke; Yu, Jianyong; Ding, Bin

    2016-09-01

    The x-polyethylene glycol diacrylate (x-PEGDA) coated polyetherimide/polyvinylidene fluoride (PEI/PVdF) membranes are obtained by the facile combination of dip-coating and free radical polymerization of PEGDA on the electrospun PEI/PVdF fiber membranes. Successful cross-linking of PEGDA increases the average fibers diameter from 553 to 817 nm and reduces the packing density, which not only increases the tensile strength of x-PEGDA coated PEI/PVdF membranes, but also decreases the average pore diameter. Besides, the x-PEGDA coated PEI/PVdF membranes are endowed with good wettability, high electrolyte uptake, high ionic conductivity and improved electrochemical stability window because of the good affinity of PEI and PEGDA with liquid electrolyte. Benefiting from the synergetic effect of PEI and PVdF, the x-PEGDA coated PEI/PVdF membranes exhibit excellent thermal stability and nonflammability, which are beneficial for enhancing the safety of lithium ion batteries. More importantly, the x-PEGDA coated PEI/PVdF membranes based Li/LiFePO4 cell exhibits comparable cycling stability with capacity retention of 95.9% after 70 cycles and better rate capability compared with the Celgard membrane based cell. The results clearly demonstrate that the x-PEGDA coated PEI/PVdF membranes are the promising separator candidate with improved wettability and safety for next-generation lithium ion batteries.

  6. Poly(vinylidene fluoride) (PVDF) Binder Degradation in Li-O2 Batteries: A Consideration for the Characterization of Lithium Superoxide.

    PubMed

    Papp, Joseph K; Forster, Jason D; Burke, Colin M; Kim, Hyo Won; Luntz, Alan C; Shelby, Robert M; Urban, Jeffrey J; McCloskey, Bryan D

    2017-02-27

    We show that a common Li-O2 battery cathode binder, poly(vinylidene fluoride) (PVDF), degrades in the presence of reduced oxygen species during Li-O2 discharge when adventitious impurities are present. This degradation process forms products that exhibit Raman shifts (∼1133 and 1525 cm(-1)) nearly identical to those reported to belong to lithium superoxide (LiO2), complicating the identification of LiO2 in Li-O2 batteries. We show that these peaks are not observed when characterizing extracted discharged cathodes that employ poly(tetrafluoroethylene) (PTFE) as a binder, even when used to bind iridium-decorated reduced graphene oxide (Ir-rGO)-based cathodes similar to those that reportedly stabilize bulk LiO2 formation. We confirm that for all extracted discharged cathodes on which the 1133 and 1525 cm(-1) Raman shifts are observed, only a 2.0 e(-)/O2 process is identified during the discharge, and lithium peroxide (Li2O2) is predominantly formed (along with typical parasitic side product formation). Our results strongly suggest that bulk, stable LiO2 formation via the 1 e(-)/O2 process is not an active discharge reaction in Li-O2 batteries.

  7. Kagomé lattices as cathode: Effect of particle size and fluoride substitution on electrochemical lithium insertion in sodium- and ammonium Jarosites

    NASA Astrophysics Data System (ADS)

    Sandineni, Prashanth; Yaghoobnejad Asl, Hooman; Choudhury, Amitava

    2016-10-01

    Highly crystalline sodium and ammonium Jarosites, NaFe3(SO4)2(OH)6 and NH4Fe3(SO4)2(OH)6, have been synthesized employing hydrothermal synthesis routes. The structures consist of anionic layers of vertex-sharing FeO6 octahedra and SO4 tetrahedral units with interlayer space occupied by Na and ammonium ions, respectively. The corner-sharing FeO6 octahedral units form six and three rings similar to hexagonal tungsten bronze sheets also known as kagomé lattice. These sodium and ammonium Jarosites are thermally stable up to 400 °C and undergo facile electrochemical lithium insertion through the reduction of Fe3+ to Fe2+. Galvanostatic charge-discharge indicates that up to 2.25 and 2 lithium ions per formula unit can be inserted at an average voltage of 2.49 and 2.26 V to the sodium and the ammonium Jarosites, respectively, under slow discharge rate of C/50. The cycle-life and experimental achievable capacity show strong dependence on particle sizes and synthesis conditions. A small amount of fluoride substitution improves both achievable capacity and average voltage.

  8. Poly(vinylidene fluoride)/SiO2 composite membranes prepared by electrospinning and their excellent properties for nonwoven separators for lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Zhang, Feng; Ma, Xilan; Cao, Chuanbao; Li, Jili; Zhu, Youqi

    2014-04-01

    PVdF/SiO2 composite nonwoven membranes exhibiting high safety (thermal stability), high ionic conductivity and excellent electrochemical performances are firstly prepared by electrospinning poly(vinylidene fluoride) (PVdF) homopolymer and silicon dioxide (SiO2) sol synchronously for the separators of lithium-ion batteries (LIBs). Differential scanning calorimetry (DSC), thermogravimetric analysis (TGA) and hot oven tests show that the PVdF/SiO2 composite nonwoven membranes are thermally stable at a high temperature of 400 °C while the commercial Celgard 2400 PP membrane exhibits great shrinkage at 130 °C, indicating a superior thermal stability of PVdF/SiO2 composite nonwoven membranes than that of Celgard membrane. Moreover, the composite membrane exhibits fairly high ionic conductivity (7.47 × 10-3 S cm-1) that significantly improves the performance of LIBs. The PVdF/SiO2 composite membranes are also evaluated to have higher level of porosity (75-85%) and electrolyte uptake (571-646 wt%), lower interfacial resistance compared to the Celgard separator. The lithium-ion cell (using LiFePO4 cathode) assembled with the composite membrane exhibits more stable cycle performance, higher discharge capacity (159 mAh g-1) and excellent capacity retention which proves that they are promising candidates for separators of high performance rechargeable LIBs.

  9. A Newly Designed Composite Gel Polymer Electrolyte Based on Poly(Vinylidene Fluoride-Hexafluoropropylene) (PVDF-HFP) for Enhanced Solid-State Lithium-Sulfur Batteries.

    PubMed

    Xia, Yan; Wang, Xiuli; Xia, Xinhui; Xu, Ruochen; Zhang, Shengzhao; Wu, Jianbo; Liang, Yanfei; Gu, Changdong; Tu, Jiangping

    2017-09-05

    Developing high-performance solid-state electrolytes is crucial for the innovation of next-generation lithium-sulfur batteries. Herein, a facile method for preparation of a novel gel polymer electrolyte (GPE) based on poly(vinylidene fluoride-hexafluoropropylene) (PVDF-HFP) is reported. Furthermore, Li1.5 Al0.5 Ti1.5 (PO4 )3 (LATP) nanoparticles as the active fillers are uniformly embedded into the GPE to form the final PVDF-HFP/LATP composite gel polymer electrolyte (CPE). Impressively, the obtained CPE demonstrates a high lithium ion transference number of 0.51 and improved electrochemical stability as compared to commercial liquid electrolyte. In addition, the assembled solid-sate Li-S battery with the composite gel polymer electrolyte membrane presents a high initial capacity of 918 mAh g(-1) at 0.05 C, and better cycle performance than the counterparts with liquid electrolyte. Our designed PVDF-HFP/LATP composite can be a promising electrolyte for next-generation solid-state batteries with high cycling stability. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. Tetragonal hematite single crystals as anode materials for high performance lithium ion batteries

    NASA Astrophysics Data System (ADS)

    Yang, Shuanglei; Zhou, Banghong; Ding, Zhengping; Zheng, He; Huang, Lanping; Pan, Jun; Wu, Wei; Zhang, Hongbo

    2015-07-01

    Understanding the correlation between the desired morphology of nanostructures and its electrochemical properties is a prerequisite for widespread application of advanced energy materials. Herein, two types of tetragonal α-Fe2O3 single crystals with a mean size of ca. 200 nm, including cubic and thorhombic shapes, have been synthesized via a facile hydrothermal approach. The as-obtained shape of α-Fe2O3 nanocrystals depends on the addition of the metal ions precursor, the Zn2+ ions result in the cubic shape and the Cu2+ ions result in the thorhombic shape, respectively. These two different tetragonal α-Fe2O3 single crystals are used as anode materials for lithium ion batteries (LIBs), and the results reveal that cubic α-Fe2O3 single crystal exhibits a better performance than thorhombic α-Fe2O3 single crystal. The discharge capacity of cubic α-Fe2O3 single crystal is up to 1028 mAh/g, and the current density is up to 1000 mA/g (1C) after 222 cycles. Clearly, the α-Fe2O3 single crystal with controlled shapes would improve the electrochemical performance of LIBs as superior anode materials, and this approach could pave a way to develop high performance LIBs.

  11. Photo-written three-dimensional optical circuits in iron doped lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Zhang, Peng; Zhao, Jianlin; Xu, Honglai; Ma, Yanghua; Yang, Dexing

    2006-02-01

    We present our experimental results on fabricating optical waveguides by laser micromachining, structure-light illuminating, and optical spatial dark solitons in iron doped lithium niobate (LiNbO 3:Fe) crystals. After that we propose a novel approach to fabricate three-dimensional (3-D) optical circuits in LiNbO 3 crystals by combining the three light-induction techniques listed above. By employing laser micromachining, a curved and a Y-branches waveguides are successfully fabricated. With binary and SLM-prepared optical masks, Y-branches and gradient planar waveguides are experimentally demonstrated. By utilizing one-dimensional (1-D) optical spatial dark solitons, planar, Y-branches, and square channel waveguides are formed. The results show that each of the three methods can be employed to write optical waveguides in LiNbO3 crystals. By combing the three methods, 3-D light circuits can be created in 45 °-cut bulk crystals by several procedures. Initially, a quasi-planar optical circuit is created in a thin layer of the crystal by structure-light illuminating with an optical mask. Then, a planar circuit is generated by utilizing a 1-D dark soltion. And then, form multi-layer planar circuits are formed by altering the positions of the crystal or writing beam. Finally, laser micromachining is used to link the different layers to form a 3-D light circuit. Furthermore, functional 3-D integrated optical system may be implemented by using the proposed approach.

  12. Coadsorption of lithium and oxygen on W(1 1 2): nanosized facets versus single crystals.

    PubMed

    Suchorski, Y; Hupalo, M S

    2011-05-01

    Coadsorption of lithium and oxygen on a nanosized W-tip is studied using field ion appearance energy spectroscopy (FIAES). Binding energies of coadsorbed Li-adatoms are derived locally for chosen atomic sites on (1 1 2) facets for different oxygen and Li-coverages. Independently, the binding energies of Li-adatoms in coadsorbed Li/oxygen layers are determined for macroscopic W(1 1 2) single crystal samples from the adsorption isobars in adsorption-desorption equilibrium experiments and compared with the local nm-scale measurements. The comparison reveals a very good agreement of results obtained by two different methods on differing length scales.

  13. Mode analysis of photonic crystal L3 cavities in self-suspended lithium niobate membranes

    SciTech Connect

    Diziain, Séverine Geiss, Reinhard; Zilk, Matthias; Schrempel, Frank; Kley, Ernst-Bernhard; Pertsch, Thomas; Tünnermann, Andreas

    2013-12-16

    We report on a multimodal analysis of photonic crystal L3 cavities milled in lithium niobate free-standing membranes. The classical L3 cavity geometry is compared to an L3 cavity containing a second lattice superimposed on the primary one. Those two different geometries are investigated in terms of vertical radiation and quality (Q) factor for each mode of the cavities. Depending on the cavity geometry, some modes undergo an enhancement of their vertical radiation into small angles while other modes experience a higher Q factor. Experimental characterizations are corroborated by three-dimensional finite difference time domain simulations.

  14. EPR and optical absorption study of Cu2+ doped lithium sulphate monohydrate (LSMH) single crystals

    NASA Astrophysics Data System (ADS)

    Sheela, K. Juliet; Krishnan, S. Radha; Shanmugam, V. M.; Subramanian, P.

    2016-05-01

    EPR study of Cu2+ doped NLO active Lithium Sulphate monohydrate (Li2SO4.H2O) single crystals were grown successfully by slow evaporation method at room temperature. The principal values of g and A tensors indicate existence of orthorhombic symmetry around the Cu2+ ion. From the direction cosines of g and A tensors, the locations of Cu2+ in the lattice have been identified as interstitial site. Optical absorption confirms the rhombic symmetry and ground state wave function of the Cu2+ ion in a lattice as dx2-y2.

  15. Investigation of spatially nonuniform nonlinear response of a lithium niobate crystal sample at low light intensity

    NASA Astrophysics Data System (ADS)

    Dmitriev, E.; Beresina, E.; Krad`ko, V.; Ryabchenok, V.; Perin, A.; Shandarov, V.

    2016-08-01

    The spatial distribution of nonlinear optical response over a bulk of lithium niobate sample is experimentally studied through the distortions of the two-dimensional light beam intensity patterns at the sample output surface caused by the beam spatial self-action. The compensation of these distortions and the linear light beam divergence by means of the pyroelectric effect contribution into the nonlinear optical response of the crystal are also studied. The results obtained for the light wavelength of 532 nm and beam waist diameter of 13 μm demonstrate the partial or total compensation of the beam divergence depending on light power and a temperature increase at the sample heating.

  16. Refractive index changes in lithium niobate crystals by high-energy particle radiation

    SciTech Connect

    Peithmann, Konrad; Zamani-Meymian, Mohammad-Reza; Haaks, Matz; Maier, Karl; Andreas, Birk; Breunig, Ingo

    2006-10-15

    Irradiation of lithium niobate crystals with 41 MeV {sup 3}He ions causes strong changes of the ordinary and extraordinary refractive indexes. We present a detailed study of this effect. Small fluence of irradiation already yields refractive index changes about 5x10{sup -4}; the highest values reach 3x10{sup -3}. These index modulations are stable up to 100 degree sign C and can be erased thermally, for which temperatures up to 500 degree sign C are required. A direct correlation between the refractive index changes and the produced lattice vacancies is found.

  17. Lithium niobate miniature lasers and single-crystal fibers

    SciTech Connect

    Cordova-Plaza, A.

    1988-01-01

    LiNbO{sub 3} is a widely used optical material because of its excellent electro-optic and nonlinear properties. By doping LiNbO{sub 3} with an active ion such as Nd, laser oscillation and amplification are added to the panoply of LiNbO{sub 3} device possibilities. Furthermore, by providing LiNbO{sub 3} devices with the waveguide confinement of single-crystal fibers, their performance can be significantly improved. Chapter 1 introduces the subject. Chapter 2 is devoted to miniature continuous-wave Nd:MgO:LiNbO{sub 3} lasers. Important results are the first demonstration of room-temperature, true continuous-wave laser oscillation in Nd-doped LiNbO{sub 3} and the first demonstration of diode-pumped laser action in this material. The Nd:MgO:LiNbO{sub 3} lasers exhibited pump power thresholds (1.9 mW) and slope efficiencies (45%) that are among the state-of-the-art in solid state lasers. Chapter 2 also contains a detailed study on photoconductivity. It explains how the addition of MgO eliminates photorefractive damage. Chapter 3 studies Q-switched laser operation in Nd:MgO:LiNbO{sub 3}. Q-switching consists of generating very intense, nanosecond pulses by rapidly switching the cavity loss.

  18. Isothermal Analysis of the Crystallization Kinetics in Lithium Disilicate Glass using Trans Temp Furnace

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Ray, C. S.; Day, D. E.

    2006-01-01

    Crystallization kinetics for lithium disilicate, Li2O2SiO2, (LS2) glass has been studied extensively by nonisothermal methods, but only a few studies on the isothermal crystallization kinetics of LS2 are available. In the present research, isothermal crystallization experiments or the LS2 glass were conducted in a Trans Temp furnace between 600 and 635 C, and selected properties such as the activation energy for crystallization (E), crystal growth index or Avrami parameter (n), the concentration of quenched-in nuclei in the starting glass (Ni) and the crystal nucleation rate (I) were measured. The crystal nucleation rate (I) was measured at only one selected temperature of 452 C, at this time. This commercial furnace has a 13 cm long isothermal heating zone (+/- 1 C) that allows precise heat treatment of relatively large samples. By placing a thermocouple within approx. 2 mm of the sample, it was possible to detect the heat of crystallization in the form of an isothermal crystallization exotherm during isothermal heat treatment of the sample. The values of E (318 plus or minus 10 kJ/mol), n (3.6 plus or minus 0.l), and N(sub i) (1.6 x 10(exp l2) m(sup -3)) calculated by analyzing these isotherms using the standard Johnson-Mehl-Avrami (JMA) equation were reproducible and in agreement with the literature values. The value of I, 1.9 x 10(exp 10) m(sup -3) s(sup -1) at 452 C, is an order of magnitude higher than the reported value for LS2.

  19. Isothermal Analysis of the Crystallization Kinetics in Lithium Disilicate Glass using Trans Temp Furnace

    NASA Technical Reports Server (NTRS)

    Fuss, T.; Ray, C. S.; Day, D. E.

    2006-01-01

    Crystallization kinetics for lithium disilicate, Li2O2SiO2, (LS2) glass has been studied extensively by nonisothermal methods, but only a few studies on the isothermal crystallization kinetics of LS2 are available. In the present research, isothermal crystallization experiments or the LS2 glass were conducted in a Trans Temp furnace between 600 and 635 C, and selected properties such as the activation energy for crystallization (E), crystal growth index or Avrami parameter (n), the concentration of quenched-in nuclei in the starting glass (Ni) and the crystal nucleation rate (I) were measured. The crystal nucleation rate (I) was measured at only one selected temperature of 452 C, at this time. This commercial furnace has a 13 cm long isothermal heating zone (+/- 1 C) that allows precise heat treatment of relatively large samples. By placing a thermocouple within approx. 2 mm of the sample, it was possible to detect the heat of crystallization in the form of an isothermal crystallization exotherm during isothermal heat treatment of the sample. The values of E (318 plus or minus 10 kJ/mol), n (3.6 plus or minus 0.l), and N(sub i) (1.6 x 10(exp l2) m(sup -3)) calculated by analyzing these isotherms using the standard Johnson-Mehl-Avrami (JMA) equation were reproducible and in agreement with the literature values. The value of I, 1.9 x 10(exp 10) m(sup -3) s(sup -1) at 452 C, is an order of magnitude higher than the reported value for LS2.

  20. Failure mechanisms of single-crystal silicon electrodes in lithium-ion batteries

    PubMed Central

    Shi, Feifei; Song, Zhichao; Ross, Philip N.; Somorjai, Gabor A.; Ritchie, Robert O.; Komvopoulos, Kyriakos

    2016-01-01

    Long-term durability is a major obstacle limiting the widespread use of lithium-ion batteries in heavy-duty applications and others demanding extended lifetime. As one of the root causes of the degradation of battery performance, the electrode failure mechanisms are still unknown. In this paper, we reveal the fundamental fracture mechanisms of single-crystal silicon electrodes over extended lithiation/delithiation cycles, using electrochemical testing, microstructure characterization, fracture mechanics and finite element analysis. Anisotropic lithium invasion causes crack initiation perpendicular to the electrode surface, followed by growth through the electrode thickness. The low fracture energy of the lithiated/unlithiated silicon interface provides a weak microstructural path for crack deflection, accounting for the crack patterns and delamination observed after repeated cycling. On the basis of this physical understanding, we demonstrate how electrolyte additives can heal electrode cracks and provide strategies to enhance the fracture resistance in future lithium-ion batteries from surface chemical, electrochemical and material science perspectives. PMID:27297565

  1. Failure mechanisms of single-crystal silicon electrodes in lithium-ion batteries

    DOE PAGES

    Shi, Feifei; Song, Zhichao; Ross, Philip N.; ...

    2016-06-14

    Long-term durability is a major obstacle limiting the widespread use of lithium-ion batteries in heavy-duty applications and others demanding extended lifetime. As one of the root causes of the degradation of battery performance, the electrode failure mechanisms are still unknown. In this paper, we reveal the fundamental fracture mechanisms of single-crystal silicon electrodes over extended lithiation/delithiation cycles, using electrochemical testing, microstructure characterization, fracture mechanics and finite element analysis. Anisotropic lithium invasion causes crack initiation perpendicular to the electrode surface, followed by growth through the electrode thickness. The low fracture energy of the lithiated/unlithiated silicon interface provides a weak microstructural pathmore » for crack deflection, accounting for the crack patterns and delamination observed after repeated cycling. On the basis of this physical understanding, we demonstrate how electrolyte additives can heal electrode cracks and provide strategies to enhance the fracture resistance in future lithium-ion batteries from surface chemical, electrochemical and material science perspectives.« less

  2. Failure mechanisms of single-crystal silicon electrodes in lithium-ion batteries.

    PubMed

    Shi, Feifei; Song, Zhichao; Ross, Philip N; Somorjai, Gabor A; Ritchie, Robert O; Komvopoulos, Kyriakos

    2016-06-14

    Long-term durability is a major obstacle limiting the widespread use of lithium-ion batteries in heavy-duty applications and others demanding extended lifetime. As one of the root causes of the degradation of battery performance, the electrode failure mechanisms are still unknown. In this paper, we reveal the fundamental fracture mechanisms of single-crystal silicon electrodes over extended lithiation/delithiation cycles, using electrochemical testing, microstructure characterization, fracture mechanics and finite element analysis. Anisotropic lithium invasion causes crack initiation perpendicular to the electrode surface, followed by growth through the electrode thickness. The low fracture energy of the lithiated/unlithiated silicon interface provides a weak microstructural path for crack deflection, accounting for the crack patterns and delamination observed after repeated cycling. On the basis of this physical understanding, we demonstrate how electrolyte additives can heal electrode cracks and provide strategies to enhance the fracture resistance in future lithium-ion batteries from surface chemical, electrochemical and material science perspectives.

  3. Failure mechanisms of single-crystal silicon electrodes in lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Shi, Feifei; Song, Zhichao; Ross, Philip N.; Somorjai, Gabor A.; Ritchie, Robert O.; Komvopoulos, Kyriakos

    2016-06-01

    Long-term durability is a major obstacle limiting the widespread use of lithium-ion batteries in heavy-duty applications and others demanding extended lifetime. As one of the root causes of the degradation of battery performance, the electrode failure mechanisms are still unknown. In this paper, we reveal the fundamental fracture mechanisms of single-crystal silicon electrodes over extended lithiation/delithiation cycles, using electrochemical testing, microstructure characterization, fracture mechanics and finite element analysis. Anisotropic lithium invasion causes crack initiation perpendicular to the electrode surface, followed by growth through the electrode thickness. The low fracture energy of the lithiated/unlithiated silicon interface provides a weak microstructural path for crack deflection, accounting for the crack patterns and delamination observed after repeated cycling. On the basis of this physical understanding, we demonstrate how electrolyte additives can heal electrode cracks and provide strategies to enhance the fracture resistance in future lithium-ion batteries from surface chemical, electrochemical and material science perspectives.

  4. Failure mechanisms of single-crystal silicon electrodes in lithium-ion batteries

    SciTech Connect

    Shi, Feifei; Song, Zhichao; Ross, Philip N.; Somorjai, Gabor A.; Ritchie, Robert O.; Komvopoulos, Kyriakos

    2016-06-14

    Long-term durability is a major obstacle limiting the widespread use of lithium-ion batteries in heavy-duty applications and others demanding extended lifetime. As one of the root causes of the degradation of battery performance, the electrode failure mechanisms are still unknown. In this paper, we reveal the fundamental fracture mechanisms of single-crystal silicon electrodes over extended lithiation/delithiation cycles, using electrochemical testing, microstructure characterization, fracture mechanics and finite element analysis. Anisotropic lithium invasion causes crack initiation perpendicular to the electrode surface, followed by growth through the electrode thickness. The low fracture energy of the lithiated/unlithiated silicon interface provides a weak microstructural path for crack deflection, accounting for the crack patterns and delamination observed after repeated cycling. On the basis of this physical understanding, we demonstrate how electrolyte additives can heal electrode cracks and provide strategies to enhance the fracture resistance in future lithium-ion batteries from surface chemical, electrochemical and material science perspectives.

  5. Polymeric ionic liquid-plastic crystal composite electrolytes for lithium ion batteries

    NASA Astrophysics Data System (ADS)

    Li, Xiaowei; Zhang, Zhengxi; Li, Sijian; Yang, Li; Hirano, Shin-ichi

    2016-03-01

    In this work, composite polymer electrolytes (CPEs), that is, 80%[(1-x)PIL-(x)SN]-20%LiTFSI, are successfully prepared by using a pyrrolidinium-based polymeric ionic liquid (P(DADMA)TFSI) as a polymer host, succinonitrile (SN) as a plastic crystal, and lithium bis(trifluoromethanesulfonyl)imide (LiTFSI) as a lithium salt. XRD and DSC measurements confirm that the as-obtained CPEs have amorphous structures. The 80%[50%PIL-50%SN]-20%LiTFSI (50% SN) electrolyte reveals a high room temperature ionic conductivity of 5.74 × 10-4 S cm-1, a wide electrochemical window of 5.5 V, as well as good mechanical strength with a Young's modulus of 4.9 MPa. Li/LiFePO4 cells assembled with the 50% SN electrolyte at 0.1C rate can deliver a discharge capacity of about 150 mAh g-1 at 25 °C, with excellent capacity retention. Furthermore, such cells are able to achieve stable discharge capacities of 131.8 and 121.2 mAh g-1 at 0.5C and 1.0C rate, respectively. The impressive findings demonstrate that the electrolyte system prepared in this work has great potential for application in lithium ion batteries.

  6. Effect of the Crystallization Process on the Marginal and Internal Gaps of Lithium Disilicate CAD/CAM Crowns.

    PubMed

    Kim, Jae-Hong; Oh, Seunghan; Uhm, Soo-Hyuk

    2016-01-01

    The aim of this study is to quantify the effect of the crystallization process on lithium disilicate ceramic crowns fabricated using a computer-aided design/computer-aided manufacturing (CAD/CAM) system and to determine whether the effect of crystallization is clinically acceptable by comparing values of fit before and after the crystallization process. The mandibular right first molar was selected as the abutment for the experiments. Fifteen working models were prepared. Lithium disilicate crowns appropriate for each abutment were prepared using a commercial CAD/CAM system. Gaps in the marginal area and 4 internal areas of each crown were measured twice-before and after crystallization-using the silicone replica technique. The mean values of fit before and after crystallization were analyzed using a paired t-test to examine whether the conversion that occurred during crystallization affected marginal and internal gaps (α = 0.05). Gaps increased in the marginal area and decreased in the internal areas after crystallization. There were statistically significant differences in all of the investigated areas (P < 0.05). None of the values for marginal and internal fit of lithium disilicate CAD/CAM crowns after crystallization exceeded 120 μm, which is the clinically acceptable threshold.

  7. Size-controlled synthesis of hierarchical nanoporous iron based fluorides and their high performances in rechargeable lithium ion batteries.

    PubMed

    Lu, Yan; Wen, Zhao-yin; Jin, Jun; Wu, Xiang-wei; Rui, Kun

    2014-06-21

    High performance nanostructured iron fluorides with controllable sizes were successfully synthesized using oleylamine as a size tuning agent for the first time. They exhibited excellent cathode performances with large retensive capacities exceeding 200 mA h g(-1) after 50 cycles and outstanding rate performances of nearly 100 mA h g(-1) even at 10 C.

  8. Anomalous dielectric relaxation in lithium-potassium tantalate crystals

    NASA Astrophysics Data System (ADS)

    Doussineau, P.; Farssi, Y.; Frénois, C.; Levelut, A.; Toulouse, J.; Ziolkiewicz, S.

    1994-08-01

    In order to describe the unusual dielectric properties observed in Ki{1-χ}Li{χ}TaO3. crystals a new approchh is proposed. The dynamical Glauber theory, previously applied to spinglasses, is modifiéd by the introduction of the spectral distribution of the random interactions between the dipoles associated with the Li+ ions. Moreover, the dipole corrélations are taken into account by the Onsager réaction field. As a result, the calculated dielectric constant reproduces well the unusual features of the Argand diagrams and, in particular, their finite slope at low frequencies and infinite slope at high frequencies (strophoidal shape). The temperature dépendance of some parameters shows, however, the limits of a spin-glass type model in describing the collective behaviour of randomly distributed dipoles in a highly polarizable medium. Une nouvelle approche est présentée qui permet de décrire les propriétés diélectriques particulières de cristaux mixtes de Ki{1-χ}Li{χ}TaO3. Elle s'appuie sur la théorie dynamique de Glauber, déjà utilisée pour les verres de spins, et modifiée par l'introduction d'une distribution spectrale spécifique aux interactions aléatoires des dipôles électriques associés aux ions Li+. En outre, les corrélations entre dipôles sont prises en compte par le champ de réaction d'Onsager. II s'ensuit que la constante diélectrique complexe ainsi calculée reproduit fidèlement les particularités des diagrammes d'Argand, telles que la pente finie aux basses fréquences et la pente infinie aux hautes fréquences (forme strophoïdale). La dépendance en température de certains paramètres déterminés par le calcul montre les limites de l'analogie avec les verres de spins et met en évidence le rôle d'un réseau très polarisable dans le comportement collectif d'une assemblée de dipôles électriques.

  9. Spectroscopic and Crystal Field Consequences of Fluoride Binding by [Yb⋅DTMA]3+ in Aqueous Solution

    PubMed Central

    Blackburn, Octavia A; Chilton, Nicholas F; Keller, Katharina; Tait, Claudia E; Myers, William K; McInnes, Eric J L; Kenwright, Alan M; Beer, Paul D; Timmel, Christiane R; Faulkner, Stephen

    2015-01-01

    Yb⋅DTMA forms a ternary complex with fluoride in aqueous solution by displacement of a bound solvent molecule from the lanthanide ion. [Yb⋅DTMA⋅F]2+ and [Yb⋅DTMA⋅OH2]3+ are in slow exchange on the relevant NMR timescale (<2000 s−1), and profound differences are observed in their respective NMR and EPR spectra of these species. The observed differences can be explained by drastic modification of the ligand field states due to the fluoride binding. This changes the magnetic anisotropy of the YbIII ground state from easy-axis to easy-plane type, and this change is easily detected in the observed magnetic anisotropy despite thermal population of more than just the ground state. The spectroscopic consequences of such drastic changes to the ligand field represent important new opportunities in developing fluoride-responsive complexes and contrast agents. PMID:26223970

  10. Realisation of an all solid state lithium battery using solid high temperature plastic crystal electrolytes exhibiting liquid like conductivity.

    PubMed

    Shekibi, Youssof; Rüther, Thomas; Huang, Junhua; Hollenkamp, Anthony F

    2012-04-07

    Replacement of volatile and combustible electrolytes in conventional lithium batteries is desirable for two reasons: safety concerns and increase in specific energy. In this work we consider the use of an ionic organic plastic crystal material (IOPC), N-ethyl-N-methylpyrrolidinium tetrafluoroborate, [C2mpyr][BF(4)], as a solid-state electrolyte for lithium battery applications. The effect of inclusion of 1 to 33 mol% lithium tetrafluoroborate, LiBF(4), into [C2mpyr][BF(4)] has been investigated over a wide temperature range by differential scanning calorimetry (DSC), impedance spectroscopy, cyclic voltammetry and cycling of full Li|LiFePO(4) batteries. The increases in ionic conductivity by orders of magnitude observed at higher temperature are most likely associated with an increase in Li ion mobility in the highest plastic phase. At concentrations >5 mol% LiBF(4) the ionic conductivity of these solid-state composites is comparable to the ionic conductivity of room temperature ionic liquids. Galvanostatic cycling of Li|Li symmetrical cells showed that the reversibility of the lithium metal redox reaction at the interface of this plastic crystal electrolyte is sufficient for lithium battery applications. For the first time we demonstrate an all solid state lithium battery incorporating solid electrolytes based on IOPC as opposed to conventional flammable organic solvents.

  11. Crystallization, Microstructure, and Viscosity Evolutions in Lithium Aluminosilicate Glass-Ceramics

    NASA Astrophysics Data System (ADS)

    Fu, Qiang; Wheaton, Bryan; Geisinger, Karen; Credle, Allen; Wang, Jie

    2016-11-01

    Lithium aluminosilicate glass-ceramics have found widespread commercial success in areas such as consumer products, telescope mirrors, fireplace windows, etc. However, there is still much to learn regarding the fundamental mechanisms of crystallization, especially related to the evolution of viscosity as a function of the crystallization (ceramming) process. In this study, the impact of phase assemblage and microstructure on the viscosity was investigated using high temperature X-ray diffraction (HTXRD), beam bending viscometry (BBV), and transmission electron microscopy (TEM). Results from this study provide a first direct observation of viscosity evolution as a function of ceramming time and temperature. Sharp viscosity increases due to phase separation, nucleation and phase transformation are noticed through BBV measurement. A near-net shape ceramming can be achieved in TiO2-containing compositions by keeping the glass at a high viscosity (> 109 Pa.s) throughout the whole thermal treatment.

  12. Local Lattice Structure and Dopant Occupancy of Doped Lithium Niobate Crystals

    NASA Astrophysics Data System (ADS)

    Zhang, Zhigang; Xue, Dongfeng

    We present a systematic study of the local distortions produced upon doping metal ions to lithium niobate (LiNbO3, LN) single crystals. The impurity bond length can be predicted by a radial force constant model, when the dopant ions substitute for Li+ or Nb5+ ions in the LN crystallographic frame. From the viewpoint of constituent chemical bonds, the lattice energy can be described as the function of bond valence on the basis of Born-Haber cycle for the formation of an ionic oxide MmOn. The dopant occupancy in the LN matrix can be determined by comparing the deviation of its lattice energy in different locations at both Li+ and Nb5+ sites, on the basis of the bond length relaxation of impurity ions, which can agree well with the experiment results. The effect of impurity ions on the property modification of LN crystals is also discussed according to our calculated results.

  13. A Novel Coupled Resonator Photonic Crystal Design in Lithium Niobate for Electrooptic Applications

    DOE PAGES

    Ozturk, Birol; Yavuzcetin, Ozgur; Sridhar, Srinivas

    2015-01-01

    High-aspect-ratio photonic crystal air-hole fabrication on bulk Lithium Niobate (LN) substrates is extremely difficult due to its inherent resistance to etching, resulting in conical structures and high insertion losses. Here, we propose a novel coupled resonator photonic crystal (CRPC) design, combining a coupled resonator approach with that of Bragg gratings. CRPC design parameters were optimized by analytical calculations and FDTD simulations. CRPC structures with optimized parameters were fabricated and electrooptically tested on bulk LN annealed proton exchange waveguides. Low insertion loss and large electrooptic effect were observed with the fabricated devices, making the CRPC design a promising structure for electroopticmore » device applications.« less

  14. A thermodynamic and crystal structure study of thermally aged lithium ion cells

    NASA Astrophysics Data System (ADS)

    Maher, Kenza; Yazami, Rachid

    2014-09-01

    Lithium ion batteries in the coin-cell form factor (2032) initially charged to 4.2 V at ambient temperature are stored at 60 °C and 70 °C for up to 8 weeks. The cells discharge capacity (Qd) and thermodynamic properties, including open-circuit potential (OCP), entropy (ΔS) and enthalpy (ΔH) are measured after each completed ageing week. Post-mortem analysis of aged anodes and cathodes is investigated by X-ray diffractometry (XRD) and Raman Scattering spectrometry (RS) in an attempt to correlate thermodynamic data to changes in the crystal structure characteristics. It is found that degradation of the electrode materials' crystal structure accounts for most of the observed changes in the cells' thermodynamics with well quantified and distinct contributions from anode and cathode.

  15. The H+ related defects in near-stoichiometric lithium niobate crystals investigated by domain reversal

    NASA Astrophysics Data System (ADS)

    Yan, Wenbo; Kong, Yongfa; Shi, Lihong; Xie, Xiang; Li, Xiaochun; Xu, Jingjun; Lou, Cibo; Liu, Hongde; Zhang, Wanlin; Zhang, Guangyin

    2004-07-01

    Domain reversal and heat treatment were carried out on near-stoichiometric lithium niobate crystals and H+ related defect structure of this crystal was studied through infrared absorption spectra. It is found that the position and halfwidth of some deconvoluted peaks of absorption band change apparently during domain reversal and heat treatment. According to these experimental results, a more suitable model about the location of Li-vacancy in LiNbO3 is introduced. In this model, the four Li vacancies, charge-compensating an anti-site Nb5+ ion (Nb4+Li), occupy two types of lattice positions: three of them at the nearest Li-sites Nb4+Li and the other one at a nearer Li-site above the same oxygen plane with Nb4+Li.

  16. EPR and optical absorption study of Cr 3+-doped ammonium lithium sulphate single crystals

    NASA Astrophysics Data System (ADS)

    Kripal, Ram; Govind, Har

    2008-10-01

    EPR study of Cr 3+-doped ammonium lithium sulphate single crystals is carried out at room temperature. The crystal field and spin Hamiltonian parameters are evaluated from the resonance line positions of different lines observed in the EPR spectra. The spin Hamiltonian parameters are found to be g=2.0003±0.0002, D=(269±2)×10 -4 cm -1 and E=(82±2)×10 -4 cm -1 for site I and g=1.9904±0.0002, D=(251±2)×10 -4 cm -1 and E=(79±2)×10 -4 cm -1 for site II, respectively. EPR data indicate that the site symmetry of Cr 3+ ion in the crystal is distorted octahedron and it enters the lattice substitutionally replacing NH4+ sites and bind to the neighbouring extra Li + vacancies necessary for charge compensation. From optical study, the energy values of different orbital levels are estimated. Further, the bonding parameters are obtained by correlating optical and EPR data and the nature of bonding in the crystal is discussed. The values of Racah parameters ( B and C), crystal field parameter ( Dq) and nephelauxetic parameters ( h and k) are obtained to be B=908, C=3553, Dq=1974 cm -1, h=0.052 and k=0.21.

  17. Resonance laser-plasma excitation of coherent terahertz phonons in the bulk of fluorine-bearing crystals under high-intensity femtosecond laser irradiation

    SciTech Connect

    Potemkin, F V; Mareev, E I; Khodakovskii, N G; Mikheev, P M

    2013-08-31

    The dynamics of coherent phonons in fluorine-containing crystals was investigated by pump-probe technique in the plasma production regime. Several phonon modes, whose frequencies are overtones of the 0.38-THz fundamental frequency, were simultaneously observed in a lithium fluoride crystal. Phonons with frequencies of 1 and 0.1 THz were discovered in a calcium fluoride crystal and coherent phonons with frequencies of 1 THz and 67 GHz were observed in a barium fluoride crystal. Furthermore, in the latter case the amplitudes of phonon mode oscillations were found to significantly increase 15 ps after laser irradiation. (interaction of laser radiation with matter)

  18. Anion Dependent Potential Pre-Cycling Effects on Lithium Deposition/Dissolution Reaction Studied by Electrochemical Quartz Crystal Microbalance.

    PubMed

    Smaran, Kumar Sai; Shibata, Sae; Omachi, Asami; Ohama, Ayano; Tomizawa, Eika; Kondo, Toshihiro

    2017-10-05

    The electrochemical quartz crystal microbalance technique was employed to study the initial stage of the electrodeposition and dissolution of lithium utilizing three kinds of electrolyte solutions such as LiPF6, LiTFSI, or LiFSI in tetraglyme. The native-SEI (solid electrolyte interphase) formed by potential pre-scan before the lithium deposition/dissolution in all three solutions. Simultaneous additional SEI (add-SEI) deposition and its dissolution with lithium deposition and dissolution, respectively, were observed in LiPF6 and LiTFSI. Conversely, the add-SEI dissolution with lithium deposition and its deposition with lithium dissolution were observed in LiFSI. With the pre-SEI, only lithium deposition/dissolution were significantly observed in LiTFSI and LiFSI. Based on the potential dependences of the mass and resistance changes, the anion dependent effects of such a pre-SEI layer presence/absence on the lithium deposition/dissolution processes were discussed.

  19. Bending waveguides made in x-cut lithium niobate crystals for technological applications

    NASA Astrophysics Data System (ADS)

    Guarepi, V.; Perrone, C.; Aveni, M.; Videla, F.; Torchia, GA

    2015-12-01

    In this paper we analyse the performance of several designs of integrated optical deviators made in x-cut lithium niobate crystals by means of femtosecond laser writing using the double line approach. Straight and bent guiding structures have been designed and implemented using this technique. Well-confined propagation modes at communication wavelengths (1.55 μm) were conducted in these structures with acceptable overall losses (less than 2 dB cm-1). Further, a discussion about the optical propagation losses for curved and straight deviators devices is included in this work. At a low aperture angle (less than 0.2°), as expected, low losses were determined for both structures; however, a weak output light was observed for large angles (greater than 0.2°) in the straight optical circuits. In contrast, a smooth variation of the output was measured for the bent structures. The results presented in this paper support the possibility of the technological implementation of integrated optical circuits for optical communications fabricated with ultrashort laser writing in lithium niobate crystals. In addition, some hypotheses of loss mechanisms that are normally not considered are discussed in order to explain the differences between the measured values and predictions obtained by calculating with the usual models.

  20. Effect of the Crystallization Process on the Marginal and Internal Gaps of Lithium Disilicate CAD/CAM Crowns

    PubMed Central

    Kim, Jae-Hong; Oh, Seunghan; Uhm, Soo-Hyuk

    2016-01-01

    The aim of this study is to quantify the effect of the crystallization process on lithium disilicate ceramic crowns fabricated using a computer-aided design/computer-aided manufacturing (CAD/CAM) system and to determine whether the effect of crystallization is clinically acceptable by comparing values of fit before and after the crystallization process. The mandibular right first molar was selected as the abutment for the experiments. Fifteen working models were prepared. Lithium disilicate crowns appropriate for each abutment were prepared using a commercial CAD/CAM system. Gaps in the marginal area and 4 internal areas of each crown were measured twice—before and after crystallization—using the silicone replica technique. The mean values of fit before and after crystallization were analyzed using a paired t-test to examine whether the conversion that occurred during crystallization affected marginal and internal gaps (α = 0.05). Gaps increased in the marginal area and decreased in the internal areas after crystallization. There were statistically significant differences in all of the investigated areas (P < 0.05). None of the values for marginal and internal fit of lithium disilicate CAD/CAM crowns after crystallization exceeded 120 μm, which is the clinically acceptable threshold. PMID:27123453

  1. The H+ related defects involved in domain reversal for both near-stoichiometric and heavily Mg-doped lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Yan, W.; Kong, Y.; Shi, L.; Yao, J.; Chen, S.; Sun, L.; Zhao, D.; Xu, J.; Zhang, G.

    2005-02-01

    Domain reversal was performed on both near-stoichiometric and heavily Mg-doped lithium niobate crystals. H+ related defect structures in these two types of crystals were studied through the infrared absorption spectra. It is found that the intensity of some decomposed peaks of absorption band change apparently during domain reversal for near-stoichiometric lithium niobate crystals but not for heavily Mg-doped lithium niobate crystals. According to these experimental results, distinct models about H+ related defect structure in LiNbO3 lattice were supposed for them. Nb4+Li and Mg3-Nb were considered as the centers of H+ related defect complex for near-stoichiometric and heavily Mg-doped lithium niobate crystals respectively. Different behavior of them was used to explain the difference of infrared absorption spectra during domain reversal between two types of crystals.

  2. Two-dimensional mapping of electro-optic phase retardation in lithium niobate crystals by digital holography.

    PubMed

    de Angelis, M; De Nicola, S; Finizio, A; Pierattini, G; Ferraro, P; Grilli, S; Paturzo, M; Sansone, L; Alfieri, D; De Natale, P

    2005-07-01

    We demonstrate accurate two-dimensional mapping of the phase retardation induced by the electro-optic effect in lithium niobate crystals. Off-axis digital holography is used to investigate congruent z-cut crystals. The spatially resolved optical path difference is interferometrically measured while a linearly rising voltage ramp is applied to the crystal. This procedure provides information on the uniformity of crystals' electro-optic properties and offers the ability to detect the presence of defects that is of fundamental importance for reliable processing of photonic devices.

  3. Growth, spectroscopic, dielectric and nonlinear optical studies of semi organic nonlinear optical crystal - L-Alanine lithium chloride

    NASA Astrophysics Data System (ADS)

    Hanumantharao, Redrothu; Kalainathan, S.

    2012-02-01

    A new and efficient semi organic nonlinear optical crystal (NLO) from the amino acid family L-alanine lithium chloride (LAL) has been grown by slow evaporation technique from aqueous solution. The functional groups were identified from NMR spectral studies. Mass spectral analysis shows the molecular ion mass. Dielectric studies has been done for the grown crystal and relative SHG efficiency is measured by Kurtz and Perry method and found to about 0.43 times that of standard potassium dihydrogen phosphate (KDP) crystals. The compound crystallized in non-centrosymmetric space group Pna21. The results have been discussed in detail.

  4. Growth, spectroscopic, dielectric and nonlinear optical studies of semi organic nonlinear optical crystal--L-alanine lithium chloride.

    PubMed

    Hanumantharao, Redrothu; Kalainathan, S

    2012-02-01

    A new and efficient semi organic nonlinear optical crystal (NLO) from the amino acid family L-alanine lithium chloride (LAL) has been grown by slow evaporation technique from aqueous solution. The functional groups were identified from NMR spectral studies. Mass spectral analysis shows the molecular ion mass. Dielectric studies has been done for the grown crystal and relative SHG efficiency is measured by Kurtz and Perry method and found to about 0.43 times that of standard potassium dihydrogen phosphate (KDP) crystals. The compound crystallized in non-centrosymmetric space group Pna21. The results have been discussed in detail.

  5. Microwave Crystallization of Lithium Aluminum Germanium Phosphate Solid-State Electrolyte.

    PubMed

    Mahmoud, Morsi M; Cui, Yuantao; Rohde, Magnus; Ziebert, Carlos; Link, Guido; Seifert, Hans Juergen

    2016-06-23

    Lithium aluminum germanium phosphate (LAGP) glass-ceramics are considered as promising solid-state electrolytes for Li-ion batteries. LAGP glass was prepared via the regular conventional melt-quenching method. Thermal, chemical analyses and X-ray diffraction (XRD) were performed to characterize the prepared glass. The crystallization of the prepared LAGP glass was done using conventional heating and high frequency microwave (MW) processing. Thirty GHz microwave (MW) processing setup were used to convert the prepared LAGP glass into glass-ceramics and compared with the conventionally crystallized LAGP glass-ceramics that were heat-treated in an electric conventional furnace. The ionic conductivities of the LAGP samples obtained from the two different routes were measured using impedance spectroscopy. These samples were also characterized using XRD and scanning electron microscopy (SEM). Microwave processing was successfully used to crystallize LAGP glass into glass-ceramic without the aid of susceptors. The MW treated sample showed higher total, grains and grain boundary ionic conductivities values, lower activation energy and relatively larger-grained microstructure with less porosity compared to the corresponding conventionally treated sample at the same optimized heat-treatment conditions. The enhanced total, grains and grain boundary ionic conductivities values along with the reduced activation energy that were observed in the MW treated sample was considered as an experimental evidence for the existence of the microwave effect in LAGP crystallization process. MW processing is a promising candidate technology for the production of solid-state electrolytes for Li-ion battery.

  6. Crystal structure of a lithium salt of a glucosyl derivative of lithocholic acid.

    PubMed

    Gubitosi, Marta; Meijide, Francisco; D'Annibale, Andrea; Vázquez Tato, José; Jover, Aida; Galantini, Luciano; Travaglini, Leana; di Gregorio, Maria Chiara; Pavel, Nicolae V

    2016-09-01

    The crystal structure of a Li(+) salt of a glucosyl derivative of lithocholic acid (lithium 3α-(α-d-glucopyranosyl)-5β-cholan-24-oate) has been solved. The crystal belongs to the orthorhombic system, P212121 spatial group, and includes acetone and water in the structure with a 1:1:2 stoichiometry. Monolayers, having a hydrophobic interior and hydrophilic edges, are recognized in the crystal structure. Li(+) is coordinated to three hydroxyl groups of three different glucose residues, with two of them belonging to the same monolayer. A fourth molecule, located in this monolayer, is involved in the coordination of the cation through the carboxylate ion by an electrostatic interaction, thus completing a distorted tetrahedron. All Li(+)-oxygen distances values are very close to the sum of the ionic radius of Li(+) and van der Waals radius of oxygen. Each steroid molecule is linked to other five steroid molecules through hydrogen bonds. Water and acetone are also involved in the hydrogen bond network. A hierarchical organization can be recognized in the crystal, the helical assembly along 21 screw axes being left-handed.

  7. Optical and mechanical properties of MgO crystals implanted with lithium ions

    NASA Astrophysics Data System (ADS)

    Savoini, B.; Cáceres, D.; Vergara, I.; González, R.; da Silva, R. C.; Alves, E.; Chen, Y.

    2004-03-01

    Defect profile induced by implantation of Li+ ions with an energy of 175 keV and a fluence of 1×1017ions/cm2 in MgO single crystals was characterized by Rutherford backscattering and optical absorption measurements. Several absorption bands at 5.0, 3.49, 2.16, and 1.27 eV, identical to those found in neutron irradiated crystals, were observed and have been previously associated with oxygen vacancies and higher-order point defects involving oxygen vacancies. Despite the high fluence of Li+ ions, no evidence was found for the formation of Li nanocolloids during implantation. Nanoindentation experiments demonstrated that both the hardness and Young's modulus were higher in the implanted layer than in the sample before implantation. The maximum values were H=(17.4±0.4) and E=(358±9) GPa, respectively, at a contact depth of ≈165 nm. Thermal annealings in flowing argon at increasing temperatures improved the crystalline quality of the implanted layer. After annealing at 500 K, two extinction bands at ≈2.75 and 3.80 eV emerged. These bands are attributed to Mie scattering from metallic lithium nanocolloids with either a face-centered- or a body-centered-cubic structure. The latter band was almost absent by 950 K. The former reached a maximum intensity after the thermal treatment at 1050 K and disappeared by 1250 K. The behavior of these bands can be satisfactorily explained by the Maxwell-Garnett theory. The decrease in hardening cannot be correlated with the thermal destruction of the absorption bands at 5.0, 3.49, 2.16, and 1.27 eV, but rather with the annihilation of both lithium and oxygen interstitials. Lithium outdiffusion from the implanted region takes place at temperatures of ≈1100 K. It is concluded that the hardening observed in the implanted region was primarily due to the extraordinarily large concentration of both lithium and oxygen interstitials.

  8. Development of a versatile high temperature top seeded solution growth unit for growing cesium lithium borate crystals.

    PubMed

    Reddy, Babu; Elizabeth, Suja; Bhat, H L; Karnal, A K

    2009-01-01

    The design and fabrication of a state of the art high temperature top seeded solution growth (HTTSSG) unit with seed and crucible rotation options is discussed. Crystals from solid solutions of high viscosity could be grown using the setup. The fabricated setup is used to grow high optical quality single crystals of cesium lithium borate with dimensions 50x40x40 mm(3) for frequency conversion of ir to UV laser through harmonic generation.

  9. Calcium - niobium - gallium and calcium - lithium - niobium - gallium garnet crystals as active media for diode-pumped lasers

    SciTech Connect

    Voronko, Yu K; Es'kov, N A; Podstavkin, A S; Ryabochkina, P A; Sobol, A A; Ushakov, S N

    2001-06-30

    The energy and spectral parameters of calcium - niobium - gallium and calcium - lithium - niobium - gallium garnet crystals pumped by a 2 - W laser diode are studied. The stable parameters of laser radiation are demonstrated upon small variations in the temperature of the pump laser diode. (lasers, active media)

  10. Formation of waveguide channels by dark spatial solitons in a planar waveguide optically induced in a lithium niobate crystal

    SciTech Connect

    Shandarov, V M; Shandarova, K V

    2005-10-31

    The formation of optical waveguide channels is experimentally demonstrated upon the photorefractive self-action of a phased light beam in a planar waveguide optically induced in an iron-doped lithium niobate crystal. Planar and channel waveguides were produced by using a 633-nm He-Ne laser with output powers 1 mW and {approx}10 {mu}W, respectively. (waveguides)

  11. Fluoride-modified electrical properties of lead borate glasses and electrochemically induced crystallization in the glassy state

    SciTech Connect

    M'Peko, Jean-Claude; Souza, Jose E. de; Rojas, Seila S.; Hernandes, Antonio C.

    2008-02-15

    Lead fluoroborate glasses were prepared by the melt-quenching technique and characterized in terms of (micro)structural and electrical properties. The study was conducted on as prepared as well as temperature- and/or electric field-treated glass samples. The results show that, in the as-prepared glassy-state materials, electrical conductivity improved with increasing the PbF{sub 2} glass content. This result involves both an increase of the fluoride charge carrier density and, especially, a decrease of the activation energy from a glass structure expansion improving charge carrier mobility. Moreover, for the electric field-treated glass samples, surface crystallization was observed even below the glass transition temperature. As previously proposed in literature, and shown here, the occurrence of this phenomenon arose from an electrochemically induced redox reaction at the electrodes, followed by crystallite nucleation. Once nucleated, growth of {beta}-PbF{sub 2} crystallites, with the indication of incorporating reduced lead ions (Pb{sup +}), was both (micro)structurally and electrically detectable and analyzed. The overall crystallization-associated features observed here adapt well with the floppy-rigid model that has been proposed to further complete the original continuous-random-network model by Zachariasen for closely addressing not only glasses' structure but also crystallization mechanism. Finally, the crystallization-modified kinetic picture of the glasses' electrical properties, through application of polarization/depolarization measurements originally combined with impedance spectroscopy, was extensively explored.

  12. Fluoride-modified electrical properties of lead borate glasses and electrochemically induced crystallization in the glassy state

    NASA Astrophysics Data System (ADS)

    M'Peko, Jean-Claude; De Souza, José E.; Rojas, Seila S.; Hernandes, Antonio C.

    2008-02-01

    Lead fluoroborate glasses were prepared by the melt-quenching technique and characterized in terms of (micro)structural and electrical properties. The study was conducted on as prepared as well as temperature- and/or electric field-treated glass samples. The results show that, in the as-prepared glassy-state materials, electrical conductivity improved with increasing the PbF2 glass content. This result involves both an increase of the fluoride charge carrier density and, especially, a decrease of the activation energy from a glass structure expansion improving charge carrier mobility. Moreover, for the electric field-treated glass samples, surface crystallization was observed even below the glass transition temperature. As previously proposed in literature, and shown here, the occurrence of this phenomenon arose from an electrochemically induced redox reaction at the electrodes, followed by crystallite nucleation. Once nucleated, growth of β-PbF2 crystallites, with the indication of incorporating reduced lead ions (Pb+), was both (micro)structurally and electrically detectable and analyzed. The overall crystallization-associated features observed here adapt well with the floppy-rigid model that has been proposed to further complete the original continuous-random-network model by Zachariasen for closely addressing not only glasses' structure but also crystallization mechanism. Finally, the crystallization-modified kinetic picture of the glasses' electrical properties, through application of polarization/depolarization measurements originally combined with impedance spectroscopy, was extensively explored.

  13. Emission cross sections and energy extraction for the mid-infrared transitions of Er, Tm, and Ho in oxide and fluoride crystals

    SciTech Connect

    Chase, L.L.; Payne, S.A.; Smith, L.K.; Kway, W.L.; Krupke, W.F.

    1991-04-01

    Emission cross sections have been measured for the transitions between the two lowest spin orbit multiplets of Er, Tm, and Ho in several fluoride and oxide crystals. Properties affecting energy extraction efficiency are summarized and pulsed extraction performance is calculated for several of these quasi-three-level laser media. 4 refs., 9 figs.

  14. 5 d-4 f luminescence of Nd3+, Gd3+, Er3+, Tm3+, and Ho3+ ions in crystals of alkaline earth fluorides

    NASA Astrophysics Data System (ADS)

    Radzhabov, E. A.; Prosekina, E. A.

    2011-09-01

    The vacuum ultraviolet emission spectra of alkaline-earth fluoride (CaF2, SrF2, BaF2) crystals with rare earth impurity ions (Nd, Gd, Er, Tm, Ho) have been investigated. The main luminescence bands are described well by the transitions from the lowest excited 5 d state to different 4 f levels of rare earth ions.

  15. A graphene loading heterogeneous hydrated forms iron based fluoride nanocomposite as novel and high-capacity cathode material for lithium/sodium ion batteries

    NASA Astrophysics Data System (ADS)

    Shen, Yongqiang; Wang, Xianyou; Hu, Hai; Jiang, Miaoling; Yang, Xiukang; Shu, Hongbo

    2015-06-01

    A graphene loading heterogeneous hydrated forms iron based fluoride (abbreviated as FeF3·xH2O/G) nanocomposite is successfully designed and synthesized for the first time by a sol-gel method. It found that the FeF3·xH2O nanoparticles distribute randomly on the surface of the graphene, stacking together to form a nanocomposite with high specific surface and abundant mesporous structure. The FeF3·xH2O was consisted of FeF3·3H2O and FeF2.5·0.5H2O with pyrochlore phase structure and FeF3·0.33H2O with hexagonal-tungsten-bronze-type structure (HTB). The FeF3·xH2O/G was used as cathode materials of rechargeable lithium/sodium batteries, respectively. It has been found that it can deliver a large reversible capacity exceeding 200 mAh g-1 and excellent cyclic performance with a residual capacity of 183 mAh g-1 after 100 cycles at 0.2C and 149 mAh g-1 after 200 cycles at 1C, especially, an outstanding rate performance exceeding 130 mAh g-1 at 5C in the voltage range of 1.5-4.5 V for Li-ion batteries. Moreover, when FeF3·xH2O/G is used as cathode material of Na-ion batteries, it exhibits also a high reversible capacity of 101 mAh g-1 after 30 cycles in the voltage range of 1.0-4.0 V at 0.1C. Therefore, FeF3·xH2O/G will a promising cathode material for high-performance lithium/sodium ion batteries.

  16. Lithium vanadyl oxalatophosphite: Influence of the water content on the crystal structures and the dehydration scheme

    SciTech Connect

    Auguste, S.; Alonzo, V.; Bataille, T.; Le Pollès, L.; Cañón-Mancisidor, W.; Venegas-Yazigi, D.; Le Fur, E.

    2014-03-15

    Two new lithium vanadyl oxalatophosphites have been synthesized by hydrothermal treatment. The respective formula are Li{sub 2}(VOHPO{sub 3}){sub 2}C{sub 2}O{sub 4} 6H{sub 2}O (1) and Li{sub 2}(VOHPO{sub 3}){sub 2}C{sub 2}O{sub 4} 4H{sub 2}O (2). The structures of the compounds have been determined by single crystal X-ray diffraction. Compound 1 crystallizes in triclinic symmetry in space group P-1, a=6.3592(2) Å, b=8.0789(3) Å, c=9.1692(3) Å, α=64.390(2), β=87.277(2)°, γ=67.624(2) and, compound 2 in monoclinic symmetry, space group P2{sub 1}/a, a=6.3555(2) Å b=12.6368(7) Å c=9.0242(4) Å β=105.167(3)°. The vanadium phosphite framework consists of infinite chains of corner-sharing vanadium octahedra and hydrogenophosphite tetrahedra. The oxalate groups ensure the connection between the chains. The lithium ions and the water molecules are located between the anionic [(VO){sub 2}(HPO{sub 3}){sub 2}C{sub 2}O{sub 4}]{sup 2−} layers. Thermal behavior of both compounds was carefully studied by combining thermogravimetric analyses and thermal dependant X-ray diffraction in order to study the thermal stability of the layered oxalatophosphites and to see the influence of the decomposition of the carbon-based anions into the final lithium vanadyl phosphate. Various intermediate phases were evidenced and for both compounds the final product was LiVOPO{sub 4}. -- Graphical abstract: Two new lithium vanadyl oxalatophosphites layered compounds, Li{sub 2} (VOHPO{sub 3}){sub 2}C{sub 2}O{sub 4} 6H{sub 2}O (1) and Li{sub 2} (VOHPO{sub 3}){sub 2}C{sub 2}O{sub 4} 4H{sub 2}O (2) have been hydrothermally synthesized. Lithium ions and water molecules are located between the anionic [(VO){sub 2}(HPO{sub 3}){sub 2}C{sub 2}O{sub 4}]{sup 2−} layers. Thermal behaviors were carefully studied by thermogravimetric and thermal dependant X-ray diffraction. Various intermediate phases were evidenced and for both compounds the final product was LiVOPO{sub 4}. Highlights: • The first

  17. Spectroscopic and Crystal Field Consequences of Fluoride Binding by [Yb⋅DTMA]3+ in Aqueous Solution

    PubMed Central

    Blackburn, Octavia A.; Chilton, Nicholas F.; Keller, Katharina; Tait, Claudia E.; Myers, William K.; McInnes, Eric J. L.; Kenwright, Alan M.; Beer, Paul D.; Timmel, Christiane R.

    2015-01-01

    Abstract Yb⋅DTMA forms a ternary complex with fluoride in aqueous solution by displacement of a bound solvent molecule from the lanthanide ion. [Yb⋅DTMA⋅F]2+ and [Yb⋅DTMA⋅OH2]3+ are in slow exchange on the relevant NMR timescale (<2000 s−1), and profound differences are observed in their respective NMR and EPR spectra of these species. The observed differences can be explained by drastic modification of the ligand field states due to the fluoride binding. This changes the magnetic anisotropy of the YbIII ground state from easy‐axis to easy‐plane type, and this change is easily detected in the observed magnetic anisotropy despite thermal population of more than just the ground state. The spectroscopic consequences of such drastic changes to the ligand field represent important new opportunities in developing fluoride‐responsive complexes and contrast agents. PMID:27478267

  18. Investigation of pyroelectric electron emission from monodomain lithium niobate single crystals

    NASA Astrophysics Data System (ADS)

    Bourim, El Mostafa; Moon, Chang-Wook; Lee, Seung-Woon; Kyeong Yoo, In

    2006-09-01

    The behaviors of thermally stimulated electron emission from pyroelectric monodomain lithium niobate single crystal (LiNbO 3) were investigated by utilizing a Si p-n junction photodiode as electron detector and a receptive electron beam resist (E-beam resist) as electron collector. In high vacuum (10 -6 Torr), the pyroelectric electron emission (PEE) was found to depend on the exposed emitting polar crystal surface (+ Z face or - Z face) and was significantly influenced by the emitter-electron receiver gap distances. Thus, the PEE from + Z face was detected during heating and was activated, in small gaps (<2 mm), by field emission effect on which was superposed an intense field ionization effect that primed intermittent runway ionizations (plasma breakdown into a glow discharge). In large gaps (>2 mm) the emission was simply mastered by field emission effect. Whereas, The PEE from - Z face was detected during cooling and was solely due to the field ionization effect. Therewith, for small gaps (<2 mm) the emission was governed by intermittent runway ionization ignitions resulting from a high ionization degree leading to dense plasma formation, and for large gaps (>2 mm) PEE was governed by field ionization generating a soft and continuous plasma ambient atmosphere. Significant decrease of electron emission current was observed from + Z face after successive thermal cycles. A fast and fully emission recovery was established after a brief exposure of crystal to a poor air vacuum of 10 -1 Torr.

  19. Thermoluminescence kinetic features of Lithium Iodide (LiI) single crystal grown by vertical Bridgman technique

    NASA Astrophysics Data System (ADS)

    Daniel, D. Joseph; Kim, H. J.; Kim, Sunghwan; Khan, Sajid

    2017-08-01

    Single crystal of pure Lithium Iodide (LiI) has been grown from melt by using the vertical Bridgman technique. Thermoluminescence (TL) Measurements were carried out at 1 K/s following X-ray irradiation. The TL glow curve consists of a dominant peak at (peak-maximum Tm) 393 K and one low temperature peak of weaker intensity at 343 K. The order of kinetics (b), activation energy (E), and the frequency factor (S) for a prominent TL glow peak observed around 393 K for LiI crystals are reported for the first time. The peak shape analysis of the glow peak indicates the kinetics to be of the first order. The value of E is calculated using various standard methods such as initial rise (IR), whole glow peak (WGP), peak shape (PS), computerized glow curve deconvolution (CGCD) and Variable Heating rate (VHR) methods. An average value of 1.06 eV is obtained in this case. In order to validate the obtained parameters, numerically integrated TL glow curve has been generated using experimentally determined kinetic parameters. The effective atomic number (Zeff) for this material was determined and found to be 52. X-ray induced emission spectra of pure LiI single crystal are studied at room temperature and it is found that the sample exhibit sharp emission at 457 nm and broad emission at 650 nm.

  20. Multicore-shell nanofiber architecture of polyimide/polyvinylidene fluoride blend for thermal and long-term stability of lithium ion battery separator.

    PubMed

    Park, Sejoon; Son, Chung Woo; Lee, Sungho; Kim, Dong Young; Park, Cheolmin; Eom, Kwang Sup; Fuller, Thomas F; Joh, Han-Ik; Jo, Seong Mu

    2016-11-11

    Li-ion battery, separator, multicoreshell structure, thermal stability, long-term stability. A nanofibrous membrane with multiple cores of polyimide (PI) in the shell of polyvinylidene fluoride (PVdF) was prepared using a facile one-pot electrospinning technique with a single nozzle. Unique multicore-shell (MCS) structure of the electrospun composite fibers was obtained, which resulted from electrospinning a phase-separated polymer composite solution. Multiple PI core fibrils with high molecular orientation were well-embedded across the cross-section and contributed remarkable thermal stabilities to the MCS membrane. Thus, no outbreaks were found in its dimension and ionic resistance up to 200 and 250 °C, respectively. Moreover, the MCS membrane (at ~200 °C), as a lithium ion battery (LIB) separator, showed superior thermal and electrochemical stabilities compared with a widely used commercial separator (~120 °C). The average capacity decay rate of LIB for 500 cycles was calculated to be approximately 0.030 mAh/g/cycle. This value demonstrated exceptional long-term stability compared with commercial LIBs and with two other types (single core-shell and co-electrospun separators incorporating with functionalized TiO2) of PI/PVdF composite separators. The proper architecture and synergy effects of multiple PI nanofibrils as a thermally stable polymer in the PVdF shell as electrolyte compatible polymers are responsible for the superior thermal performance and long-term stability of the LIB.

  1. Multicore-shell nanofiber architecture of polyimide/polyvinylidene fluoride blend for thermal and long-term stability of lithium ion battery separator

    NASA Astrophysics Data System (ADS)

    Park, Sejoon; Son, Chung Woo; Lee, Sungho; Kim, Dong Young; Park, Cheolmin; Eom, Kwang Sup; Fuller, Thomas F.; Joh, Han-Ik; Jo, Seong Mu

    2016-11-01

    Li-ion battery, separator, multicoreshell structure, thermal stability, long-term stability. A nanofibrous membrane with multiple cores of polyimide (PI) in the shell of polyvinylidene fluoride (PVdF) was prepared using a facile one-pot electrospinning technique with a single nozzle. Unique multicore-shell (MCS) structure of the electrospun composite fibers was obtained, which resulted from electrospinning a phase-separated polymer composite solution. Multiple PI core fibrils with high molecular orientation were well-embedded across the cross-section and contributed remarkable thermal stabilities to the MCS membrane. Thus, no outbreaks were found in its dimension and ionic resistance up to 200 and 250 °C, respectively. Moreover, the MCS membrane (at ~200 °C), as a lithium ion battery (LIB) separator, showed superior thermal and electrochemical stabilities compared with a widely used commercial separator (~120 °C). The average capacity decay rate of LIB for 500 cycles was calculated to be approximately 0.030 mAh/g/cycle. This value demonstrated exceptional long-term stability compared with commercial LIBs and with two other types (single core-shell and co-electrospun separators incorporating with functionalized TiO2) of PI/PVdF composite separators. The proper architecture and synergy effects of multiple PI nanofibrils as a thermally stable polymer in the PVdF shell as electrolyte compatible polymers are responsible for the superior thermal performance and long-term stability of the LIB.

  2. Preparation and characterization of lithium ion conducting polymer electrolytes based on a blend of poly(vinylidene fluoride-co-hexafluoropropylene) and poly(methyl methacrylate).

    PubMed

    Gebreyesus, Merhawi Abreha; Purushotham, Y; Kumar, J Siva

    2016-07-01

    Ion conducting polymer electrolytes composed of poly(vinylidene fluoride-co-hexafluoropropylene) (PVdF-HFP), poly(methyl methacrylate) (PMMA) and lithium triflate (LiTf) were prepared using the solution casting method. Structural change and complex formation in the blend electrolyte systems were confirmed from the X-ray diffraction (XRD), Fourier transform infrared (FTIR) spectroscopy and scanning electron microscopy (SEM) studies. Thermal properties of the samples were investigated by the differential scanning calorimetry (DSC) technique. The ionic conductivity of these polymer electrolytes was studied by impedance spectroscopy at various temperatures ranging from 303-393 K. The results reveal that the ionic conductivity of the polymer blend electrolytes depends on the PVdF-HFP:PMMA composition as well as the temperature. Maximum room temperature conductivity of [Formula: see text] S cm(-1) was achieved with 22.5 wt.% PMMA. The blending of PVdF-HFP with PMMA improved the thermal stability and ionic conductivity of the polymer electrolyte. Estimated transference numbers suggest the charge transport is predominantly ionic.

  3. Crystal structure and chemistry of lithium-bearing trioctahedral micas-3T

    USGS Publications Warehouse

    Brigatti, M.F.; Kile, D.E.; Poppi, L.

    2003-01-01

    Chemical analyses and crystal structure refinements were performed on lithian siderophyllite-3T crystals from granitic pegmatites of the anorogenic Pikes Peak batholith (Colorado) to characterize the crystal chemistry and relations with trioctahedral lithium-bearing micas showing different stacking sequences. Chemical data show that the studied samples fall on the siderophyllite-polylithionite join, closer to the siderophyllite end-member. Single-crystal X-ray refinements were carried out on three samples (two of which were taken from core and rim of the same crystal) in space-group P31 12 (the agreement factor, Robs, varies between 0.034 and 0.036). Mean bond distances and mean electron counts of M1, M2 and M3 octahedral sites indicate an ordered cation distribution with M1 and M3 positions substantially larger than M2. In the sample with the largest iron content, the M2 mean electron count increases as well as the mean distance, whereas remains smaller than or . The tetrahedral cation-oxygen atom mean distances range from 1.614 to 1.638 A and from 1.663 to 1.678 A for T1 and T2 sites, respectively, being consistent with Al3+ enrichment in the T2 sites. The tetrahedral rotation angle, α, is generally small (3.1 ≤ α ≤ 4.6) and decreases with siderophyllite content. As Fe increases, the T1 tetrahedron becomes flatter (112.4 ≤ t1 ≤ 110.5??), whereas T2 tetrahedron distortion appears unchanged (110.7 ≤ T2 ≤ 110.9).

  4. Fabrication and Characterization of Linear Terahertz Detector Arrays Based on Lithium Tantalate Crystal

    NASA Astrophysics Data System (ADS)

    Li, Weizhi; Wang, Jun; Gou, Jun; Huang, Zehua; Jiang, Yadong

    2015-01-01

    Two samples of 30-pixel linear terahertz detector arrays (TDAs) were fabricated based on lithium tantalate (LT) crystals. Pixel readout circuit (ROC) was designed to extract the weak current signal of TDAs. A test platform was established for performance evaluation of TDA+ROC components. By using a 2.52THz laser as radiation source, the test results reveal that average voltage responsivities of the components were larger than 7000V/W and non-uniformity no more than 2.1%. Average noise equivalent power ( NEP) of one sample was measured to be 1.5×10-9 W/Hz1/2, which is low enough and desirable for high performance THz detector.

  5. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    DOE PAGES

    Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.

    2016-12-21

    Shock compression experiments in the few hundred GPa (multi-Mbar) regime were performed on Lithium Deuteride single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17–32 km/s. Measurements included pressure, density, and temperature between ~190 and 570 GPa along the Principal Hugoniot—the locus of end states achievable through compression by large amplitude shock waves—as well as pressure and density of reshock states up to ~920 GPa. As a result, the experimental measurements are compared with density functional theory calculations, tabular equation ofmore » state models, and legacy nuclear driven results that have been reanalyzed using modern equations of state for the shock wave standards used in the experiments.« less

  6. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    SciTech Connect

    Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.

    2016-12-21

    Shock compression experiments in the few hundred GPa (multi-Mbar) regime were performed on Lithium Deuteride single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17–32 km/s. Measurements included pressure, density, and temperature between ~190 and 570 GPa along the Principal Hugoniot—the locus of end states achievable through compression by large amplitude shock waves—as well as pressure and density of reshock states up to ~920 GPa. As a result, the experimental measurements are compared with density functional theory calculations, tabular equation of state models, and legacy nuclear driven results that have been reanalyzed using modern equations of state for the shock wave standards used in the experiments.

  7. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    SciTech Connect

    Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.

    2016-12-21

    Shock compression experiments in the few hundred GPa (multi-Mabr) regime were performed on Lithium Deuteride (LiD) single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17-32 km/s. Measurements included pressure, density, and temperature between ~200-600 GPa along the Principal Hugoniot – the locus of end states achievable through compression by large amplitude shock waves – as well as pressure and density of re - shock states up to ~900 GPa. Lastly, the experimental measurements are compared with recent density functional theory calculations as well as a new tabular equation of state developed at Los Alamos National Labs.

  8. Integrated opto-microfluidics platforms in lithium niobate crystals for sensing applications

    NASA Astrophysics Data System (ADS)

    Bettella, G.; Pozza, G.; Zaltron, A.; Ciampolillo, M. V.; Argiolas, N.; Sada, C.; Chauvet, M.; Guichardaz, B.

    2015-02-01

    In micro-analytical chemistry and biology applications, droplet microfluidic technology holds great promise for efficient lab-on-chip systems where higher levels of integration of different stages on the same platform is constantly addressed. The possibility of integration of opto-microfluidic functionalities in lithium niobate (LiNbO3) crystals is presented. Microfluidic channels were directly engraved in a LiNbO3 substrate by precision saw cutting, and illuminated by optical waveguides integrated on the same substrate. The morphological characterization of the microfluidic channel and the optical response of the coupled optical waveguide were tested. In particular, the results indicate that the optical properties of the constituents dispersed in the fluid flowing in the microfluidic channel can be monitored in situ, opening to new compact optical sensor prototypes based on droplets generation and optical analysis of the relative constituents.

  9. Fabrication and investigation of TIPE waveguide lenses based on lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Volkov, V. A.; Vyrelkin, V. P.; Gan'shin, V. A.; Kvasha, M. Iu.; Korkishko, Iu. N.

    1987-06-01

    The titanium-interdiffused-proton-exchange (TIPE) process for fabricating waveguide lenses is briefly characterized, and a simpler version of the process is proposed. In this process, a single-mode (wavelength, 0.63 micron) Ti:LiNbO3 waveguide is diffused onto the Y-section of lithium niobate at 980 C for 6 hr. An SiO-SiO2 film is then deposited on the crystal surface which serves as a mask for proton-exchange diffusion. Proton exchange diffusion is carried out in the melts of some stable acid salts, making it possible to fabricate TIPE waveguides in open crucibles in air rather than inside evacuated containers. Experimental results are presented for three hyperbolic structures fabricated by the process described here.

  10. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    SciTech Connect

    Knudson, Marcus D.; Desjarlais, Michael P.; Lemke, Raymond W.

    2014-10-01

    Shock compression experiments in the few hundred GPa (multi-Mabr) regime were performed on Lithium Deuteride (LiD) single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17-32 km/s. Measurements included pressure, density, and temperature between ~200-600 GPa along the Principal Hugoniot – the locus of end states achievable through compression by large amplitude shock waves – as well as pressure and density of re - shock states up to ~900 GPa. Lastly, the experimental measurements are compared with recent density functional theory calculations as well as a new tabular equation of state developed at Los Alamos National Labs.

  11. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    NASA Astrophysics Data System (ADS)

    Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.

    2016-12-01

    Shock compression experiments in the few hundred GPa (multi-Mbar) regime were performed on Lithium Deuteride single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17-32 km/s. Measurements included pressure, density, and temperature between ˜190 and 570 GPa along the Principal Hugoniot—the locus of end states achievable through compression by large amplitude shock waves—as well as pressure and density of reshock states up to ˜920 GPa. The experimental measurements are compared with density functional theory calculations, tabular equation of state models, and legacy nuclear driven results that have been reanalyzed using modern equations of state for the shock wave standards used in the experiments.

  12. Shock compression experiments on Lithium Deuteride (LiD) single crystals

    DOE PAGES

    Knudson, M. D.; Desjarlais, M. P.; Lemke, R. W.

    2016-12-21

    Shock compression experiments in the few hundred GPa (multi-Mabr) regime were performed on Lithium Deuteride (LiD) single crystals. This study utilized the high velocity flyer plate capability of the Sandia Z Machine to perform impact experiments at flyer plate velocities in the range of 17-32 km/s. Measurements included pressure, density, and temperature between ~200-600 GPa along the Principal Hugoniot – the locus of end states achievable through compression by large amplitude shock waves – as well as pressure and density of re - shock states up to ~900 GPa. Lastly, the experimental measurements are compared with recent density functional theorymore » calculations as well as a new tabular equation of state developed at Los Alamos National Labs.« less

  13. Trace phase formation, crystallization kinetics and crystallographic evolution of a lithium disilicate glass probed by synchrotron XRD technique

    PubMed Central

    Huang, Saifang; Huang, Zhaohui; Gao, Wei; Cao, Peng

    2015-01-01

    X-ray diffraction technique using a laboratory radiation has generally shown limitation in detectability. In this work, we investigated the in situ high-temperature crystallization of a lithium disilicate glass-ceramic in the SiO2–Li2O–CaO–P2O5–ZrO2 system with the aid of synchrotron radiation. The formation of lithium metasilicate and other intermediate phases in trace amount was successfully observed by synchrotron X-ray diffraction (SXRD). The crystallization mechanism in this glass was thus intrinsically revised to be the co-nucleation of lithium metasilicate and disilicate, instead of the nucleation of lithium disilicate only. The phase content, crystallite size and crystallographic evolutions of Li2Si2O5 in the glass-ceramic as a function of annealing temperature were studied by performing Rietveld refinements. It is found that the growth of Li2Si2O5 is constrained by Li2SiO3 phase at 580–700°C. The relationship between the crystallographic evolution and phase transition was discussed, suggesting a common phenomenon of structural response of Li2Si2O5 along its c axis to other silicon-related phases during glass crystallization. PMID:25778878

  14. The role of alkali additives in the crystallization of ferroelectric potassium lithium niobate crystals

    NASA Astrophysics Data System (ADS)

    Péter, Á.; Hajdara, I.; Szaller, Zs.; Lengyel, K.; Kovács, L.

    2013-05-01

    Ferroelectric K3Li2Nb5O15 (KLN-1) crystals have been grown by the top-seeded solution growth method from pure, Na+, Rb+ and Cs+ doped melt. The impact of alkali additives was assessed all over the entire pulling range by investigating the variation of the structural and physical properties by using spectroscopic and dielectric methods. The incorporation of alkali homologs has been correlated with their ionic radii: Na+ ions were found to enter both Li and K sites with high segregation coefficient (k˜1.6), Rb+ ions were detected only at K sites (k˜0.34) and Cs+ ions practically did not incorporate into the lattice (k˜0.12). Alkali additives have been found to play a dual role in the growth process by affecting the crystallization temperature and promoting the K and Li site occupancy. By decreasing the crystallization temperature the Cs2O additive reduced the concentration both of the antisite Nb ions at Li site and that of alkali vacancies; therefore it can be considered as a promising fluxing agent in the growth of KLN crystals.

  15. Fluoridation Basics

    MedlinePlus

    ... Water Fluoridation Journal Articles for Community Water Fluoridation Water Fluoridation Basics Recommend on Facebook Tweet Share Compartir ... because of tooth decay. History of Fluoride in Water In the 1930s, scientists examined the relationship between ...

  16. Calcium fluoride window mounting

    NASA Astrophysics Data System (ADS)

    Berger, D. Douglas

    1982-10-01

    A technique has been developed for joining a large calcium fluoride crystal to a stainless-steel flange by means of a silver transition ring. The process involves both vacuum brazing using a copper-silver alloy and air brazing using silver chloride. This paper describes the procedure used in fabricating a high-vacuum leak-tight calcium fluoride window assembly.

  17. Integrated RF photonic devices based on crystal ion sliced lithium niobate

    NASA Astrophysics Data System (ADS)

    Stenger, Vincent; Toney, James; Pollick, Andrea; Busch, James; Scholl, Jon; Pontius, Peter; Sriram, Sri

    2013-03-01

    This paper reports on the development of thin film lithium niobate (TFLN™) electro-optic devices at SRICO. TFLN™ is formed on various substrates using a layer transfer process called crystal ion slicing. In the ion slicing process, light ions such as helium and hydrogen are implanted at a depth in a bulk seed wafer as determined by the implant energy. After wafer bonding to a suitable handle substrate, the implanted seed wafer is separated (sliced) at the implant depth using a wet etching or thermal splitting step. After annealing and polishing of the slice surface, the transferred film is bulk quality, retaining all the favorable properties of the bulk seed crystal. Ion slicing technology opens up a vast design space to produce lithium niobate electro-optic devices that were not possible using bulk substrates or physically deposited films. For broadband electro-optic modulation, TFLN™ is formed on RF friendly substrates to achieve impedance matched operation at up to 100 GHz or more. For narrowband RF filtering functions, a quasi-phase matched modulator is presented that incorporates domain engineering to implement periodic inversion of electro-optic phase. The thinness of the ferroelectric films makes it possible to in situ program the domains, and thus the filter response, using only few tens of applied volts. A planar poled prism optical beam steering device is also presented that is suitable for optically switched true time delay architectures. Commercial applications of the TFLN™ device technologies include high bandwidth fiber optic links, cellular antenna remoting, photonic microwave signal processing, optical switching and phased arrayed radar.

  18. Conversion of broadband IR radiation and structural disorder in lithium niobate single crystals with low photorefractive effect

    NASA Astrophysics Data System (ADS)

    Litvinova, Man Nen; Syuy, Alexander V.; Krishtop, Victor V.; Pogodina, Veronika A.; Ponomarchuk, Yulia V.; Sidorov, Nikolay V.; Gabain, Aleksei A.; Palatnikov, Mikhail N.; Litvinov, Vladimir A.

    2016-11-01

    The conversion of broadband IR radiation when the noncritical phase matching condition is fulfilled in lithium niobate (LiNbO3) single crystals with stoichiometric (R = Li/Nb = 1) and congruent (R = 0.946) compositions, as well as in congruent single crystals doped with zinc has been investigated. It is shown that the spectrum parameters of converted radiation, such as the conversion efficiency, spectral width and position of maximum, depend on the ordering degree of structural units of the cation sublattice along the polar axis of crystal.

  19. Crystal chemistry, chemical stability, and electrochemical properties of layered oxide cathodes of lithium ion batteries

    NASA Astrophysics Data System (ADS)

    Choi, Jeh Won

    capability is found to bear a clear relationship to the chemical lithium extraction rate, which decreases with decreasing Co content due to an increasing cation disorder. Additionally, the lithium extraction rate is found to influence the structure of the chemically delithiated end members HxNi 0.5-yMn0.5-yCo2yO2; the structure changes from P3 to O1 to O3 with decreasing Co content 2y. A comparison of the chemical stability of the Na0.75-xCoO 2 system shows that it maintains the theoretical value of the oxidation state of cobalt during chemical sodium extraction to low sodium contents of (0.75-x) ≈ 0.3, while Li1-xCoO2 incorporates protons for (1-x) < 0.5. The differences between two systems are discussed based on the crystal structure and the position of Co3+/4+:3d band relative to the top of the O2-:2p band.

  20. Charge carrier accumulation in lithium fluoride thin films due to Li-ion absorption by titania (100) subsurface.

    PubMed

    Li, Chilin; Gu, Lin; Guo, Xiangxin; Samuelis, Dominik; Tang, Kun; Maier, Joachim

    2012-03-14

    The thermodynamically required redistribution of ions at given interfaces is being paid increased attention. The present investigation of the contact LiF/TiO(2) offers a highly worthwhile example, as the redistribution processes can be predicted and verified. It consists in Li ion transfer from LiF into the space charge zones of TiO(2). We not only can measure the resulting increase of lithium vacancy conductivity in LiF, we also observe a transition from n- to p-type conductivity in TiO(2) in consistency with the generalized space charge model.

  1. Isomeric ionic lithium isonicotinate three-dimensional networks and single-crystal-to-single-crystal rearrangements generating microporous materials.

    PubMed

    Abrahams, Brendan F; Dharma, A David; Grannas, Martin J; Hudson, Timothy A; Maynard-Casely, Helen E; Oliver, Graham R; Robson, Richard; White, Keith F

    2014-05-19

    Reaction between LiOH and isonicotinic acid (inicH) in the appropriate solvent or mixture of solvents affords a family of variously solvated forms of a simple ionic lithium salt, viz., Li(+)inic(-)·S (where S = 0.5 morpholine, 0.5 dioxane, 0.25 n-hexanol, 0.5 N-methylpyrrolidinone, 0.5 N,N-dimethylformamide, 0.5 n-propanol, 0.5 cyclohexanol, 0.5 pyridine, 0.5 t-butanol, 0.5 ethanol, and 0.5 methanol). Three-dimensional Li(+)inic(-) frameworks containing solvent-filled channels are present in all of these except for the MeOH and EtOH solvates. The nondirectional character of the electrostatic interactions between the Li(+) and inic(-) ions bestows an element of "plasticity" upon the framework, manifested in the observation of no less than five different framework structures within the family. Unusual single-crystal-to-single-crystal transformations accompany desolvation of Li(+)inic(-)·S in which the Li(+)inic(-) framework undergoes a major rearrangement (from a structure containing "8484 chains" to one with "6666 chains"). The "before and after" structures are strongly suggestive of the mechanism and the driving force for these solid state framework rearrangements: processes which further demonstrate the "plasticity" of the ionic Li(inic) framework. A solid-state mechanism for these desolvation processes that accounts very satisfactorily for the formation of the channels and for the diverse geometrical/topological aspects of the transformation is proposed. The reverse process allows the regeneration of the solvated 8484 form. When the 6666 Li(+)inic(-) form is immersed in carbon disulfide, a single-crystal-to-single-crystal transformation occurs to generate Li(+)inic(-)·0.25CS2. The hydrate, Li(+)inic(-)·2H2O which consists of discrete Li(inic)·H2O chains obtained by recrystallizing the salt from water, can also be obtained by hydration of the 6666 form. A dense 3D network with the formula, Li(inic) can be obtained in a reversible process by the removal of the

  2. Microwave Crystallization of Lithium Aluminum Germanium Phosphate Solid-State Electrolyte

    PubMed Central

    Mahmoud, Morsi M.; Cui, Yuantao; Rohde, Magnus; Ziebert, Carlos; Link, Guido; Seifert, Hans Juergen

    2016-01-01

    Lithium aluminum germanium phosphate (LAGP) glass-ceramics are considered as promising solid-state electrolytes for Li-ion batteries. LAGP glass was prepared via the regular conventional melt-quenching method. Thermal, chemical analyses and X-ray diffraction (XRD) were performed to characterize the prepared glass. The crystallization of the prepared LAGP glass was done using conventional heating and high frequency microwave (MW) processing. Thirty GHz microwave (MW) processing setup were used to convert the prepared LAGP glass into glass-ceramics and compared with the conventionally crystallized LAGP glass-ceramics that were heat-treated in an electric conventional furnace. The ionic conductivities of the LAGP samples obtained from the two different routes were measured using impedance spectroscopy. These samples were also characterized using XRD and scanning electron microscopy (SEM). Microwave processing was successfully used to crystallize LAGP glass into glass-ceramic without the aid of susceptors. The MW treated sample showed higher total, grains and grain boundary ionic conductivities values, lower activation energy and relatively larger-grained microstructure with less porosity compared to the corresponding conventionally treated sample at the same optimized heat-treatment conditions. The enhanced total, grains and grain boundary ionic conductivities values along with the reduced activation energy that were observed in the MW treated sample was considered as an experimental evidence for the existence of the microwave effect in LAGP crystallization process. MW processing is a promising candidate technology for the production of solid-state electrolytes for Li-ion battery. PMID:28773627

  3. Some Lower Valence Vanadium Fluorides: Their Crystal Distortions, Domain Structures, Modulated Structures, Ferrimagnetism, and Composition Dependence.

    ERIC Educational Resources Information Center

    Hong, Y. S.; And Others

    1980-01-01

    Describes some contemporary concepts unique to the structure of advanced solids, i.e., their crystal distortions, domain structures, modulated structures, ferrimagnetism, and composition dependence. (Author/CS)

  4. Some Lower Valence Vanadium Fluorides: Their Crystal Distortions, Domain Structures, Modulated Structures, Ferrimagnetism, and Composition Dependence.

    ERIC Educational Resources Information Center

    Hong, Y. S.; And Others

    1980-01-01

    Describes some contemporary concepts unique to the structure of advanced solids, i.e., their crystal distortions, domain structures, modulated structures, ferrimagnetism, and composition dependence. (Author/CS)

  5. Classification of fluorides and oxyfluorides of niobium(V) and tantalum(V) with alkali metals

    SciTech Connect

    Kuznetsov, V.Ya.; Rogachev, D.L.; Agulyanskii, A.I.; Kalinnikov, V.T.

    1986-01-01

    On the basis of an analysis of the structures and chemical compositions of fluorides and oxyfluorides of niobium(V) and tantalum(V) the authors suggest a classification based on the dependence of the character of the crystal structure on the ratio of the number of nonmetal (O, F) ions to the number of Nb or Ta ions. If lithium ions are present in the structure, they are summed with Nb or Ta in view of their steric similarity.

  6. Application of electrochemical quartz crystal microbalance to lithium-ion batteries

    NASA Astrophysics Data System (ADS)

    Kwon, Kyungjung

    An electrochemical quartz crystal microbalance (EQCM) was used in an investigation of the corrosion of aluminum and of the formation of the solid electrolyte interphase (SEI) on carbon in electrolytes appropriate for lithium-ion batteries. Aluminum corrosion in some electrolytes such as LiN(CF3SO 2)2/propylene carbonate was examined and a corrosion mechanism was suggested. The behavior of the carbon electrode in LiClO4 or LiPF 6/EC+DMC was examined by combining electrochemical methods with EQCM. A difficulty encountered in this use of the EQCM was a monotonic decrease in crystal resonant frequency with time. It was determined that this was due to a change in the viscosity of the electrolyte. Viscosities of some electrolytes that contained ethylene carbonate (EC) and dimethyl carbonate (DMC) were measured and they increased when in contact with carbon, nickel, and aluminum electrodes but did not change with time when stored in glass vials. The SO density in LiClO4/EC+DMC was estimated to be about 1.3 g/cm3 by combining the EQCM and ellipsometry.

  7. Terahertz Conductivity and Hindered Molecular Reorientation of Lithium Salt Doped Succinonitrile in its Plastic Crystal Phase

    NASA Astrophysics Data System (ADS)

    Nickel, Daniel V.; Bian, Hongtao; Zheng, Junrong; Mittleman, Daniel M.

    2014-09-01

    The terahertz complex permittivity of the molecular plastic crystal succinonitrile (SN) or 1,2 dicyanoethane (N≡C-CH2-CH2-C≡N), doped with the lithium salts LiBF4, LiPF6, LiTFSI, and LiClO4 to form solid-state plastic crystal electrolytes, is measured and compared using temperature-dependent terahertz time-domain spectroscopy (THz-TDS). In contrast to the trends at low frequency, SN's terahertz conductivity decreases slightly when doped with Li-salts. This indicates that at high frequencies the dielectric response is not dominated by ionic charge transport, but instead by relaxational processes which are hindered by the presence of the ionic dopants. Assuming a single Cole-Cole distribution of Debye-like processes dominates the measured spectra, the average relaxation times τ and Arrhenius activation energies E a are extracted for each electrolyte and are shown to increase significantly relative to undoped SN's τ and E a, indicating the relaxational processes are hindered by the presence of the ionic dopants.

  8. EPR and optical absorption study of Cu 2+-doped lithium potassium sulphate single crystals

    NASA Astrophysics Data System (ADS)

    Kripal, Ram; Bajpai, Manisha; Maurya, Manju; Govind, Har

    2008-10-01

    EPR spectra of Cu 2+ ion doped in lithium potassium sulphate single crystal at room temperature are reported. The observed spectra are fitted to a spin Hamiltonian of orthorhombic symmetry with Cu 2+ (site I) g x=2.0930, g y=2.1421, g z=2.2900 (±0.0002) and A x=85, A y=89, A z=184 (±2×10 -4 cm -1); Cu 2+ (site II) g x=2.0795, g y=2.1580, g z=2.2876 (±0.0002) and A x=93, A y=95, A z=189 (±2×10 -4 cm -1); respective errors given in brackets. Copper enters the lattice substitutionally and is trapped at two magnetically inequivalent sites. The ground state wave function of the Cu 2+ ion in this lattice is determined as predominantly | x2- y2>. The g-factor anisotropy is calculated and compared with the experimental value. The optical absorption of the crystal at room temperature is also recorded. Further, with the help of the optical absorption and EPR data, the nature of bonding in the complex is discussed.

  9. [Study on the vacuum ultraviolet transmittance of barium fluoride crystals at different temperature].

    PubMed

    Peng, Ru-Yi; Fu, Li-Ping; Tao, Ye

    2014-03-01

    Two VUV-grade BaF2 windows with 0.5 mm-thick and 1 mm-thick respectively were selected to study the transmittance variety with the temperature. The results show that the cutoff wavelength of BaF2 crystals will shift towards the long wave with the increase in temperature. In a certain temperature range, BaF2 crystals can depress 130.4 nm radiation well, and also has a high transmittance at 135.6 nm. Compared with the reported method in which SrF2 crystals can be applied to suppress 130.4 nm stray light by heating, BaF2 crystal can inhibit the 130. 4 nm emission line completely, and thus reduce the power consumption of the device at the same time. This indicates that BaF2 crystals can play an important role in the ionosphere optical remote sensing detection.

  10. Crystal form and phase structure of poly(vinylidene fluoride)/polyamide 11/clay nanocomposites by high-shear processing.

    PubMed

    Li, Yongjin; Iwakura, Yuko; Shimizu, Hiroshi

    2008-04-01

    Polyamide 11 (PA11)/clay, Poly(vinylidene fluoride) (PVDF)/clay and PVDF/PA11/clay nanocomposites were prepared by melt processing using a high shear extruder. Two types of organoclay with different modified alkyl tails and different polarities were used for PA11 and PVDF nanocomposites. PA11 nanocomposites derived from an organoclay having one alkyl tail show a well-exfoliated morphology but no crystal form transformation, whereas those derived from an organoclay having two alkyl tails give a little worse clay dispersion with the clear alpha to gamma crystal form transition with the addition of the clay. In contrast, the PVDF composites derived from the two organoclays result in a poor dispersion. In addition, PVDF/PA11 blend nanocomposites with a novel morphology have been fabricated using the high-shear extruder. It was found that the clay platelets were selectively dispersed in the PA11 phase with the size of larger than 200 nm, while no clay platelets were located in the PVDF phase and in the PA11 nanodomains with the size of smaller than 200 nm. Moreover, the addition of organoclay shows significant effects on the phase structure of PVDF/PA11 blends.

  11. Li K-Edge XANES Spectra of Lithium Niobate and Lithium Tantalite

    SciTech Connect

    Mizota, H.; Ito, Y.; Tochio, T.; Handa, K.; Takekawa, S.; Kitamura, K.

    2007-02-02

    The x-ray emission with the single crystal of lithium niobate (LiNbO3) or lithium tantalite (LiTaO3) by thermal changes in a vacuum system is closely concerned with the electronic state of each crystal. Therefore, lithium K-edge x-ray absorption near edge structures (XANES) spectra of these materials were measured in the region from 50 eV to 90 eV by means of total electron yield method (T.E.Y.), using the extremely soft x-ray. Samples were powder of lithium carbonate (Li2CO3) and single crystal of lithium fluoride (LiF), LiNbO3 and LiTaO3 in order to compare the shapes of these XANES spectra. Various peak structures appear in these spectra in the range from 55 eV to 80 eV and each spectrum has different shapes as a result of the difference of bond length and bond angles for the atoms which are in less than 60 nm from the absorbing atom. The relationship between these spectra and the electronic states was discussed by FEFF 8.

  12. Crystal growth and characterization of europium doped lithium strontium iodide scintillator as an ionizing radiation detector

    NASA Astrophysics Data System (ADS)

    Uba, Samuel

    High performance detectors used in the detection of ionizing radiation is critical to nuclear nonproliferation applications and other radiation detectors applications. In this research we grew and tested Europium doped Lithium Strontium Iodide compound. A mixture of lithium iodide, strontium iodide and europium iodide was used as the starting materials for this research. Congruent melting and freezing temperature of the synthesized compound was determined by differential scanning calorimetry (DSC) using a Setaram Labsys Evo DSC-DTA instrument. The melting temperatures were recorded at 390.35°C, 407.59°C and freezing temperature was recorded at 322.84°C from a graph of heat flow plotted against temperature. The synthesized material was used as the charge for the vertical Bridgeman growth, and a 6.5 cm and 7.7cm length boule were grown in a multi-zone transparent Mullen furnace. A scintillating detector of thickness 2.53mm was fabricated by mechanical lapping in mineral oil, and scintillating response and timing were obtained to a cesium source using CS-137 isotope. An energy resolution (FWHM over peak position) of 12.1% was observed for the 662keV full absorption peak. Optical absorption in the UV-Vis wavelength range was recorded for the grown crystal using a U-2900 UV/VIS Spectrophotometer. Absorption peaks were recorded at 194nm, 273nm, and 344nm from the absorbance spectrum, various optical parameters such as absorption coefficient, extinction coefficient, refractive index, and optical loss were derived. The optical band gap energy was calculated using Tauc relation expression at 1.79eV.

  13. Crystal structure of lithium molybdenum purple bronze Li 0.9Mo 6O 17

    NASA Astrophysics Data System (ADS)

    Onoda, M.; Toriumi, K.; Matsuda, Y.; Sato, M.

    1987-01-01

    The crystal structure of the molybdenum ternary oxide Li 0.9Mo 6O 17 is determined by single-crystal X-ray diffraction. The crystal is monoclinic with space group {P2 1}/{m} and the lattice constants are a = 12.762(2) Å, b = 5.523(1) Å, c = 9.499(1) Å, β = 90.61(1)°, Z = 2. Full-matrix least-squares refinement gives the final values of R( F) = 0.033 and Rw( F) = 0.066 for 3019 independent reflections. The unit cell contains six crystallographically independent molybdenum sites. One-third of the molybdenum atoms are located in oxygen tetrahedra, while the others are within oxygen octahedra. The structure is built up of slabs of the MoO 6 octahedra. Each slab consists of three layers of distorted ReO 3-type MoO 6 octahedra sharing corners. The structure is rather different from that of K 0.9Mo 6O 17, although the layered feature is still preserved. The lithium ions are located in the large vacant sites between the slabs. By the application of Zachariasen's bond length-bond strength relation to the observed MoO bonds, most of the conduction electrons are found to be located in the Mo(1) and Mo(4) octahedral sites which are associated in pairs to form the Mo(1)O(11)Mo(4)O(11) double zigzag chains extending along the b-axis. Therefore the structural properties are considered to lead to the highly anisotropic electronic transport.

  14. The impact of MgO-doped near-stoichiometric lithium niobate crystals on the THz wave output characteristics

    NASA Astrophysics Data System (ADS)

    Xianbin, Zhang; Yunfeng, Li; lijuan, Ma; ke, Yuan; Wei, Shi

    2011-02-01

    The control experimental study on the THz wave parametric oscillator (TPO) output characteristics based on the congruent LiNbO3 crystal (CLN) and stoichiometric MgO-doped lithium niobate (SLN) crystal is performed. As a nonlinear medium in the aspect of the THz wave output experiments show that the congruent LiNbO3 crystal is more stable than the SLN crystal. Compared with the CLN crystal SLN showed significant photorefractive effect which adversely the stability of the THz wave output. Experiments indicated that different molar concentration of MgO doped can significantly change the photorefractive properties of SLN crystal. The results showed that with the increase of MgO doping concentration the photorefractive of SLN gradually become weaker and THz wave output stability has the significantly increase. The output stability of mol 5.0% MgO droped SLN crystal has not significantly different with the CLN. In the contrast experiment of TPO with the 160mm cavity length and 65mm crystal length the pump laser threshold of the 5% mol MgO: SLN crystal decreased by 23% than the CLN crystal while the peak THz energy output increased 28%.

  15. Multicore-shell nanofiber architecture of polyimide/polyvinylidene fluoride blend for thermal and long-term stability of lithium ion battery separator

    PubMed Central

    Park, Sejoon; Son, Chung Woo; Lee, Sungho; Kim, Dong Young; Park, Cheolmin; Eom, Kwang Sup; Fuller, Thomas F.; Joh, Han-Ik; Jo, Seong Mu

    2016-01-01

    Li-ion battery, separator, multicoreshell structure, thermal stability, long-term stability. A nanofibrous membrane with multiple cores of polyimide (PI) in the shell of polyvinylidene fluoride (PVdF) was prepared using a facile one-pot electrospinning technique with a single nozzle. Unique multicore-shell (MCS) structure of the electrospun composite fibers was obtained, which resulted from electrospinning a phase-separated polymer composite solution. Multiple PI core fibrils with high molecular orientation were well-embedded across the cross-section and contributed remarkable thermal stabilities to the MCS membrane. Thus, no outbreaks were found in its dimension and ionic resistance up to 200 and 250 °C, respectively. Moreover, the MCS membrane (at ~200 °C), as a lithium ion battery (LIB) separator, showed superior thermal and electrochemical stabilities compared with a widely used commercial separator (~120 °C). The average capacity decay rate of LIB for 500 cycles was calculated to be approximately 0.030 mAh/g/cycle. This value demonstrated exceptional long-term stability compared with commercial LIBs and with two other types (single core-shell and co-electrospun separators incorporating with functionalized TiO2) of PI/PVdF composite separators. The proper architecture and synergy effects of multiple PI nanofibrils as a thermally stable polymer in the PVdF shell as electrolyte compatible polymers are responsible for the superior thermal performance and long-term stability of the LIB. PMID:27833132

  16. Optically induced three-dimensional Penrose-type photonic quasicrystal lattices in iron-doped lithium niobate crystal

    NASA Astrophysics Data System (ADS)

    Jin, Wentao; Xue, Yan Ling

    2014-07-01

    Three-dimensional Penrose-type photonic quasicrystal lattices are optically induced inside an iron-doped lithium niobate photorefractive crystal for the first time using a single multi-pinhole plate. The setup of this method is simple and compact dispense with complex optical adjustment system. Induced Penrose-type photonic quasicrystal lattices are analyzed and verified by plane wave guiding and far field diffraction pattern imaging. The quasicrystal microstructures can be maintained for a long time inside the crystal in a dark room. Other more complex three-dimensional photonic quasicrystal structures can be fabricated with this method by designing the multi-pinhole plate flexibly.

  17. The mechanism of deceleration of nucleation and crystal growth by the small addition of transition metals to lithium disilicate glasses.

    PubMed

    Thieme, Katrin; Avramov, Isak; Rüssel, Christian

    2016-05-06

    The addition of small amounts of niobium or tantalum oxide to lithium disilicate glass provokes a drastic decrease of the steady-state nucleation rates and the crystal growth velocities. The viscosity of the residual glassy matrix is considered as a function of the crystallization degree in the course of a non-isothermal crystallization. For simplification, a homogeneous distribution of the added oxides in the glass matrix is assumed. While the viscosity initially decreases, it significantly increases again for higher crystallization degrees hindering crystal growth. However, it was shown that the additives are enriched at the crystal interface. Several possible reasons for the inhibition of nucleation and growth kinetics such as viscosity, interfacial energy crystal/glassy phase, thermodynamic driving force or impingement rate are discussed. Since the crystallization front is blocked by the additives the impingement rate is decreased with increasing additive concentration. Since small concentrations of Nb2O5 and Ta2O5 have a drastic effect on the nucleation, these components should be enriched at the interface crystal/glass. This will only take place, if it leads to a decrease in the interfacial energy. Since this effect alone should result in an increase of the nucleation rate, it must be overcompensated by kinetic effects.

  18. The mechanism of deceleration of nucleation and crystal growth by the small addition of transition metals to lithium disilicate glasses

    PubMed Central

    Thieme, Katrin; Avramov, Isak; Rüssel, Christian

    2016-01-01

    The addition of small amounts of niobium or tantalum oxide to lithium disilicate glass provokes a drastic decrease of the steady-state nucleation rates and the crystal growth velocities. The viscosity of the residual glassy matrix is considered as a function of the crystallization degree in the course of a non-isothermal crystallization. For simplification, a homogeneous distribution of the added oxides in the glass matrix is assumed. While the viscosity initially decreases, it significantly increases again for higher crystallization degrees hindering crystal growth. However, it was shown that the additives are enriched at the crystal interface. Several possible reasons for the inhibition of nucleation and growth kinetics such as viscosity, interfacial energy crystal/glassy phase, thermodynamic driving force or impingement rate are discussed. Since the crystallization front is blocked by the additives the impingement rate is decreased with increasing additive concentration. Since small concentrations of Nb2O5 and Ta2O5 have a drastic effect on the nucleation, these components should be enriched at the interface crystal/glass. This will only take place, if it leads to a decrease in the interfacial energy. Since this effect alone should result in an increase of the nucleation rate, it must be overcompensated by kinetic effects. PMID:27150844

  19. Dynamics recording of holographic gratings in a photochromic crystal of calcium fluoride

    NASA Astrophysics Data System (ADS)

    Borisov, Vladimir N.; Barausova, Ekaterina V.; Veniaminov, Andrey V.; Andervaks, Alexandr E.; Shcheulin, Alexandr S.; Ryskin, Alexandr I.

    2016-08-01

    Dynamics of diffraction efficiency was monitored during recording a holographic grating in additively coloured CaF2 photochromic crystal at 180-200°C. Reciprocity failure revealed in the study was attributed to diffusion playing the crucial role in grating formation: recording at larger laser power goes faster but requires more energy. The efficiency of a recorded hologram is found to depend on the temperature; maximum diffraction is measured at the temperature far below that of recording, supposedly because of dramatic distortions suffered by the crystal along with exposure.

  20. Investigation of High-Energetic Transitions in Some Pr3+-Doped Fluoride and Oxide Crystals

    DTIC Science & Technology

    2001-01-01

    3 ÷ (YAP) and LiYF4:Pr 3÷ ( YLF ) crystals investigated in this work were grown by the Czochralski method and contained 0.75at% and 3at% Pr...DISCUSSION The optical properties of Pr3÷ ions in the investigated YAP, YLF and KPLF crystals were previously investigated in spectral ranges of typical...the lower-lying multiplets is observed in the blue, green and red spectral ranges. The lifetimes of the luminescent 3p0 multiplet for YAP, YLF and KPLF

  1. Optically induced reversible wettability transition on single crystal lithium niobate surfaces

    NASA Astrophysics Data System (ADS)

    Yan, Weishan; Zhao, Dongfang; Zhang, Ling; Jia, Ran; Gao, Naikun; Zhang, Dongdong; Luo, Wenyao; Li, Yanlu; Liu, Duo

    2017-08-01

    Solid surfaces with controllable and reversible wettability are scientifically and technologically important. Here, we report on the reversible wettability transitions of single crystal (0001) lithium niobate (LiNbO3) surfaces by alternate ultraviolet (UV) and infrared (IR) light irradiation. The UV irradiation (170 mW/cm2) could markedly reduce the contact angle of LiNbO3 over 30 min from 55.3° to 10.7°. IR irradiation (200 mW/cm2) recovered the water contact angle from 10.7° to 55.1° over 1 h. First-principles calculations showed that under both O-poor and O-rich conditions, oxygen vacancies preferred to form at the Li-terminal (0001) surface rather than at the Nb-terminal surface and the O-terminal surface or in the bulk. We further show that this light induced wettability transition has a dependence on the light wavelength. The influences of relative humidity and oxygen concentration were also investigated.

  2. Raman spectra of lithium niobate crystals heavily doped with zinc and magnesium

    NASA Astrophysics Data System (ADS)

    Sidorov, N. V.; Palatnikov, M. N.

    2016-12-01

    We have examined the Raman spectra of heavily doped lithium niobate single crystals (at close-to-threshold concentrations of doping cations): LiNbO3:Zn (4.5 mol % ZnO), LiNbO3:Mg (5.01 mol %):Fe (0.005 mol %), LiNbO3:Mg (5.1 mol %), and LiNbO3:Mg (5.3 mol % MgO). Low-intensity lines with frequencies at 209, 230, 298, 694, and 880 cm-1 have been revealed for the first time. Analysis of the data from the literature on lattice dynamics calculations from first principles (ab initio) does not make it possible to unambiguously state that these lines correspond to fundamental vibrations of the A2 symmetry species, which are forbidden for the C3 V 6 ( R3c) space group. At the same time, ab initio calculations unambiguously indicate that the experimentally observed low-intensity "superfluous" lines with the frequencies at 104 and 119 cm-1 cannot correspond to vibrations of the A2 symmetry species. It is most likely that they correspond to two-particle states of acoustic phonons with a total wave vector equal to zero.

  3. Preparation and Crystal Structure of Lithium Nitride Chloride Li 4NCl

    NASA Astrophysics Data System (ADS)

    Marx, Rupert

    1997-02-01

    Li4NCl was prepared from Li3N and dry OH-free LiCl at 450°C. It is found to be the more nitrogen-rich of two compounds in the quasi-binary system Li3-2xN1-xClx. Following unit cell indexing using laboratory X-ray powder data, the previously unknown structure of the title compound was solved from neutron powder diffraction data recorded using the flat-cone and powder diffractometer E2 at the Berlin BERII reactor. Li4NCl crystallizes in the hexagonal rhombohedral space groupRoverline3=m(No. 166),a=366.225(4),c=1977.18(4) pm with three formula units per unit cell. Its structure comprises a 1:1-ordering variant of a cubic close anion packing, N3-and Cl-forming layers perpendicular to [001]. Li atoms occupy all the triangular voids of the N layers and all the NCl3-tetrahedral holes. Nitrogen is in lithium nitride-like hexagonal bipyramidal coordination by Li, the equatorial six-membered ring being slightly puckered, while Cl is in distorted octahedral coordination. Calculation of the Madelung part of the lattice energy shows that the nitrogen hexagonal bipyramidal coordination polyhedron, peculiar for Li4NCl and the Li3N parent structure, is in agreement with a simple ionic picture and does not imply any covalent bonding.

  4. The crystal structure and microtwinning of ferro-pedrizite, a new lithium amphibole

    NASA Astrophysics Data System (ADS)

    Aksenov, S. M.; Rastsvetaeva, R. K.; Konovalenko, S. I.; Ananyev, S. A.; Chukanov, N. V.; Miroshkina, A. E.

    2015-07-01

    The structure of ferro-pedrizite—a new lithium mineral of the amphibole supergroup—has been studied by single-crystal X-ray diffraction. Fe2+ ions dominate over Mg in the chemical composition of this mineral. The parameters of the monoclinic unit cell are a = 9.3716(4) Å, b = 17.649(1) Å, c = 5.2800(6) Å, and β = 102.22(1)°. The experimental set of intensities contains a large number of significant reflections (~10%), which violate the Clattice. Consideration of pseudomerohedral twinning (matrix [1 0 0/00/-3/4 0]) allowed us to solve and refine the structure within the sp. gr. C2/ m to the final value R = 3.9% in the anisotropic approximation of atomic displacements using 4843 I > 2σ( I). The twin components are found to be 0.681(3)/0.319(3). Twinning has been revealed for the first time in amphiboles of the pedrizite family. The idealized formula of ferro-pedrizite ( Z = 2) is determined as NaLi2(Al2Li)[Si8O22](OH)2.

  5. Development of fluorides for high power laser optics

    SciTech Connect

    Ready, J.F.; Vora, H.

    1980-07-01

    The laser-assisted thermonuclear fusion program has significant needs for improved optical materials with high transmission in the ultraviolet, and with low values of nonlinear index of refraction. Lithium fluoride (LiF) possesses a combination of optical properties which are of potential use. Single-crystalline LiF is limited by low mechanical strength. In this program, we investigated the technique of press-forging to increase the mechanical strength. LiF single crystals were press-forged over the temperature range 300 to 600/sup 0/C to produce fine-grained polycrystalline material.

  6. Optimal Fluoridation

    PubMed Central

    Lee, John R.

    1975-01-01

    Optimal fluoridation has been defined as that fluoride exposure which confers maximal cariostasis with minimal toxicity and its values have been previously determined to be 0.5 to 1 mg per day for infants and 1 to 1.5 mg per day for an average child. Total fluoride ingestion and urine excretion were studied in Marin County, California, children in 1973 before municipal water fluoridation. Results showed fluoride exposure to be higher than anticipated and fulfilled previously accepted criteria for optimal fluoridation. Present and future water fluoridation plans need to be reevaluated in light of total environmental fluoride exposure. PMID:1130041

  7. Thermodynamic and kinetic characteristics of variations in shapes of ridges formed on l brace 100 r brace lithium fluoride surfaces

    SciTech Connect

    Bullard, J.W.; Glaeser, A.M.; Searcy, A.W.

    1991-12-01

    channels with widths in the range form 5 {mu}m were formed in {l brace}100{r brace} surfaces of LiF single crystals by a photolithographic technique. Specimens annealed at or above 0.90 T{mu}m, where T{mu} is the melting point, and then quenched showed the channels and the ridges between them develop rounded profiles. Evolution of these profiles was evaluated for the various channel widths and for interchannel ridge spacings of 5 to 100 {mu}m in terms of: (a) an accepted theoretical model for a surface diffusion controlled process, and (b) a model which assumes that shape changes depend only on the relative energies of attachment of atoms in surface sites with various surface curvatures. Either model is consistent with the experimental observations to within the reproducibility in measurements.

  8. Hydrothermal synthesis and crystal structure of a new lithium copper bismuth oxide, LiCuBiO4

    NASA Astrophysics Data System (ADS)

    Kumada, Nobuhiro; Nakamura, Ayumi; Miura, Akira; Takei, Takahiro; Azuma, Masaki; Yamamoto, Hajime; Magome, Eisuke; Moriyoshi, Chikako; Kuroiwa, Yoshihiro

    2017-01-01

    A new lithium copper bismuth oxide, LiCuBiO4 was prepared by hydrothermal reaction using NaBiO30.1*4H2O. The crystal structural model of this compound was refined by using synchrotron X-ray powder diffraction data. This bismuthate has the LiCuSbO4 related structure with the orthorhombic cell (Space group: Pnma) of a=10.9096(9), b=5.8113(5) and c=5.0073(4) Å, and the final R-factors were Rwp=4.84 and Rp=3.58%. This compound is the first example of a lithium copper bismuthate containing Bi5+. An antiferromagnetic ordering of Cu2+ moment was observed at 6 K.

  9. Prediction of different crystal structure phases in metal borides: A lithium monoboride analog to MgB2

    NASA Astrophysics Data System (ADS)

    Kolmogorov, Aleksey N.; Curtarolo, Stefano

    2006-05-01

    Modern compound prediction methods can efficiently screen large numbers of crystal structure phases and direct the experimental search for new materials. One of the most challenging problems in alloy theory is the identification of stable phases with a never seen prototype; such predictions do not always follow rational strategies. While performing ab initio data mining of intermetallic compounds we made an unexpected discovery: even in such a well-studied class of systems as metal borides there are previously unknown layered phases comparable in energy to the existing ones. With ab initio calculations we show that the new metal-sandwich (MS) lithium monoboride phases are marginally stable under ambient conditions but become favored over the known stoichiometric compounds under moderate pressures. The MS lithium monoboride exhibits electronic features similar to those in magnesium diboride and is expected to be a good superconductor.

  10. Growth and photorefractive properties of Mg, Fe co-doped near-stoichiometric lithium tantalate single crystals

    NASA Astrophysics Data System (ADS)

    Hsu, W. T.; Chen, Z. B.; You, C. A.; Huang, S. W.; Liu, J. P.; Lan, C. W.

    2010-07-01

    Mg, Fe co-doped near-stoichiometric lithium tantalate (SLT) crystals were successfully grown by the zone-leveling Czochralski (ZLCz) technique and the holographic properties were measured by the two-beam coupling method. The fundamental optical properties of crystals were measured by employing the UV-vis-NIR spectrometer and Fourier transformation infrared spectrophotometer as well. By the chemical analysis, the Li/Ta, Mg/Ta and Fe/Ta ratios of the crystals were obtained and the Li/Ta ratios of the crystals were all close to the theoretical limitation of 0.98. In the holographic properties, the recording time constant, erasing time constant, dynamic range, and sensitivity decreased with light intensity; but the maximum diffraction efficiency showed an opposite trend. Furthermore, the diffraction efficiency, dynamic range and sensitivity of the crystals were improved with a relatively higher Fe/Ta ratio. In comparison with Mn-LT crystals, the Mg, Fe co-doped SLT crystal showed the superior photorefractive properties indicating that it could be a promising new material for lifetime holographic data storage.

  11. Characterization of in-situ terahertz detection by optical interaction in a periodically poled stoichiometric lithium tantalate nonlinear crystal

    NASA Astrophysics Data System (ADS)

    Lee, Kyu-Sup; Ko, Do-Kyeong; Takekawa, Shunji; Kitamura, Kenji; Yu, Nan Ei

    2014-10-01

    Terahertz waves are generated using a femtosecond laser pulse in a periodically poled stoichiometric lithium tantalate crystal and simultaneously detected via a non-collinear optical parametric interaction inside the same crystal. Real time up-conversion signal between the generated THz and an optic probe pulses is measured depending on the beam overlapped conditions using a general silicon-photodiode for the THz detection. The non-collinear geometry is to facilitate manipulated property of the position-dependent bandwidth at narrow and broad bandwidths of 45 GHz and 3.3 THz, respectively at the one crystal. Furthermore, an aperture effect at the detection part is characterized as the function of size and position owing to the spatial distribution of the frequency conversion signal and it is applied in optimization of the in-situ detection scheme.

  12. Lithium diffusion in congruent LiNbO3 single crystals at low temperatures probed by neutron reflectometry.

    PubMed

    Hüger, E; Rahn, J; Stahn, J; Geue, T; Heitjans, P; Schmidt, H

    2014-02-28

    The self-diffusion of lithium in congruent LiNbO3 single crystals was investigated at low temperatures between 379 and 523 K by neutron reflectometry. From measurements on (6)LiNbO3 (amorphous film)/(nat)LiNbO3 (single crystal) samples, Li self-diffusivities were determined in single crystals down to extremely low values of 1 × 10(-25) m(2) s(-1) on small length scales of 1-10 nm. The measured diffusivities are in excellent agreement with (extrapolated) literature data obtained by experiments based on Secondary Ion Mass Spectrometry and Impedance Spectroscopy. The tracer diffusivities can be described by a single Arrhenius line over ten orders of magnitude with an activation enthalpy of 1.33 eV, which corresponds to the migration energy of a single Li vacancy. A deviation from the Arrhenius behaviour at low temperatures, e.g., due to defect cluster formation is not observed.

  13. Two-dimensional correlation infrared spectroscopic study on the crystallization and gelation of poly(vinylidene fluoride) in cyclohexanone.

    PubMed

    Peng, Yun; Sun, Bingjie; Wu, Peiyi

    2008-03-01

    Poly(vinylidene fluoride) (PVDF) converts easily into a thermo-reversible gel through crystallization by standing at room temperature in cyclohexanone. In this study, the Fourier transform infrared (FT-IR) spectra were measured continuously at room temperature during the conversion of the solution into a gel. The IR difference spectra derived from these spectra by absorbance subtraction clearly indicate the presence of PVDF alpha-crystallites in the gel due to the presence of absorption bands corresponding to the TG+TG- conformation of the alpha-phase. In the time interval from 25 to 45 min after the beginning of the experiment, the IR bands of PVDF increased dramatically, indicating the conversion of polymer chains from random statistical coils to the ordered TG+TG- conformation (alpha-form). In the time interval from 45 to 90 min, the IR bands of PVDF increased slowly, reflecting no further crystallization. Using two-dimensional (2D) IR analysis, it could be shown that the nu(C=O) absorption band of cyclohexanone changed during the gelation process. During the conformational ordering process (25-45 min), the nu(C=O) absorption band of the cyclohexanone dimer (1707 cm(-1)) decreased while the corresponding band of the monomer at 1718 cm(-1) increased. Furthermore, a new band at 1695 cm(-1) increased, which could be assigned to C=O groups of the solvent interacting with the CF2 groups in the polymer chain. The bands of the crystalline PVDF share positive cross-peaks with the bands of cyclohexanone, which indicates that the chain of PVDF changed prior to the cyclohexanone molecules during the conformational ordering process. However, these positive cross-peaks disappeared during the crystallization process, which means that the chain of PVDF changed synchronously with the solvent molecules. As for the bands of PVDF chains, the band at 762 cm(-1) varied prior to the bands at 873 cm(-1) and 796 cm(-1) during the conformational ordering process. The 762 cm(-1

  14. Spectroscopic properties of heavily Ho3+-doped barium yttrium fluoride crystals

    NASA Astrophysics Data System (ADS)

    Ji, En-Cai; Liu, Qiang; Nie, Ming-Ming; Luo, Hui; Hu, Yu-Xi; Guan, Zhou-Guo; Gong, Ma-Li

    2015-09-01

    The 30 at.% Ho: BaY2F8 crystals were grown by the Czochralski method, and their spectroscopic properties are analyzed systematically by standard Judd-Ofelt theory. The Judd-Ofelt intensity parameters are estimated to be Ω2 = 6.74 × 10-20 cm2, Ω4 = 1.20 × 10-20 cm2, and Ω6 = 0.66 × 10-20 cm2, and the fluorescence branching ratios and radiative lifetimes for a series of excited state manifolds are also determined. The emission cross sections with our measured infrared luminescence spectra, especially important for 4.1 μm, are calculated to be about 4.37 × 10-21 cm2. The crystal quality is preliminarily tested through a mid-infrared laser emission experiment. Project supported by the National Natural Science Foundation of China (Grant No. 61275146), the Research Fund for the Doctoral Program of Higher Education of China (Grant No. 20120002110066), and the Special Program of the Co-construction with Beijing Municipal Government of China (Grant No. 20121000302).

  15. Microstructure and defects probed by Raman spectroscopy in lithium niobate crystals and devices

    SciTech Connect

    Fontana, Marc D.; Bourson, Patrice

    2015-12-15

    Raman microprobe applied on LiNbO{sub 3} (LN) crystals and derived materials or devices is shown to be a tool to detect either local variations or changes of the whole structure. Position, width, or intensity of one Raman line can be used as markers of a structural change. Indeed, each Raman line can be assigned to a peculiar ionic motion and is differently sensitive to application of strain, temperature change, and electric field. Some vibrational modes are especially associated to the site of Li ion, or Nb ion, or still oxygen octahedron, so that they can be affected by the introduction of dopant ion on one or another site. Therefore, Raman Spectroscopy (RS) can be used as a site spectroscopy to describe the mechanism of doping incorporation in the LN lattice, allowing the optimization of some linear and non-linear optical properties according to the dopant concentration and substitution site. The composition or the content of non-stoichiometry related defects could be derived from the width of some lines. Any damage or local disorder can be detected by a line broadening. The quality or preservation of the structure after chemical treatment, or laser pulses, can be thus checked. The structure of ion-implanted or proton-exchanged wave-guides and periodically poled lithium niobate as well can be imaged from frequency shift or intensity change of some lines. RS is thus a useful way to control the structure of LN and/or to optimize the preparation parameters and its properties.

  16. Optical properties of Eu{sup 2+} doped antipervoskite fluoride single crystals

    SciTech Connect

    Daniel, D. Joseph; Ramasamy, P.; Nithya, R.; Madhusoodanan, U.

    2013-02-05

    Single crystals of pure and Eu{sup 2+} doped LiBaF{sub 3} have been grown from melt by using a vertical Bridgman-Stockbarger method. Absorption and luminescence spectra for pure and rare-earth-doped LiBaF{sub 3} were studied. At ambient conditions the photoluminescence spectra consisted of sharp lines peaked at {approx}359 nm attributed to the {sup 6}P7/2{yields}{sup 8}S7/2 transitions in the 4f{sub 7} electronic configuration of Eu{sup 2+} and a broad band extending between 370 and 450 nm attributed to Eu{sup 2+} trapped exciton recombination. The effect of {sup 60}Co gamma irradiation has also been investigated.

  17. Visible laser operation of Pr3+-doped fluoride crystals pumped by a 469 nm blue laser.

    PubMed

    Xu, Bin; Camy, Patrice; Doualan, Jean-Louis; Cai, Zhiping; Moncorgé, Richard

    2011-01-17

    We report continuous-wave (CW) laser operation of Pr3+-doped LiLuY4, LiYF4 and KY3F10 single crystals in the Red, Orange and Green spectral regions by using a new pumping scheme. The pump source is an especially developed compact, slightly tunable and intracavity frequency-doubled diode-pumped Nd:YAG laser delivering a CW output power of 0.9W at 469.12 nm. At this pump wavelength, efficient room temperature laser emissions corresponding to the 3P0→3F2, 3P0→3H6 and 3P1→3H5 Pr3+ transitions are observed. While a maximum slope efficiency of 45% is obtained in the red with Pr:LiYF4, the demonstration is made for the first time of the orange laser operation of Pr:KY3F10 at about 610 nm.

  18. Changes in the reflectivity of a lithium niobate crystal decorated with a graphene layer

    NASA Astrophysics Data System (ADS)

    Salas, O.; Garcés, E.; Castillo, F. L.; Magaña, L. F.

    2017-01-01

    Density functional theory and molecular dynamics were used to study the interaction of a graphene layer with the surface of lithium niobate. The simulations were performed at atmospheric pressure and 300K. We found that the graphene layer is physisorbed with an adsorption energy of -0.8205 eV/C-atom. Subsequently, the optical absorption of the graphene-(lithium niobate) system was calculated and compared with that of graphene solo and lithium niobate alone, respectively. The calculations were performed using the Quantum Espresso code with the GGA approximation and Vdw-DF2 (which includes long-range correlation effects as Van der Waals interactions).

  19. EPR and optical absorption study of Cu{sup 2+} doped lithium sulphate monohydrate (LSMH) single crystals

    SciTech Connect

    Sheela, K. Juliet; Subramanian, P.; Krishnan, S. Radha; Shanmugam, V. M.

    2016-05-23

    EPR study of Cu{sup 2+} doped NLO active Lithium Sulphate monohydrate (Li{sub 2}SO{sub 4.}H{sub 2}O) single crystals were grown successfully by slow evaporation method at room temperature. The principal values of g and A tensors indicate existence of orthorhombic symmetry around the Cu{sup 2+} ion. From the direction cosines of g and A tensors, the locations of Cu{sup 2+} in the lattice have been identified as interstitial site. Optical absorption confirms the rhombic symmetry and ground state wave function of the Cu{sup 2+} ion in a lattice as d{sub x2-y2}.

  20. Systemic fluoride.

    PubMed

    Sampaio, Fábio Correia; Levy, Steven Marc

    2011-01-01

    There is substantial evidence that fluoride, through different applications and formulas, works to control caries development. The first observations of fluoride's effects on dental caries were linked to fluoride naturally present in the drinking water, and then from controlled water fluoridation programs. Other systemic methods to deliver fluoride were later suggested, including dietary fluoride supplements such as salt and milk. These systemic methods are now being questioned due to the fact that many studies have indicated that fluoride's action relies mainly on its post-eruptive effect from topical contact with the tooth structure. It is known that even the methods of delivering fluoride known as 'systemic' act mainly through a topical effect when they are in contact with the teeth. The effectiveness of water fluoridation in many geographic areas is lower than in previous eras due to the widespread use of other fluoride modalities. Nevertheless, this evidence should not be interpreted as an indication that systemic methods are no longer relevant ways to deliver fluoride on an individual basis or for collective health programs. Caution must be taken to avoid excess ingestion of fluoride when prescribing dietary fluoride supplements for children in order to minimize the risk of dental fluorosis, particularly if there are other relevant sources of fluoride intake - such as drinking water, salt or milk and/or dentifrice. Safe and effective doses of fluoride can be achieved when combining topical and systemic methods.

  1. Study of beryllium and beryllium-lithium complexes in single-crystal silicon.

    NASA Technical Reports Server (NTRS)

    Crouch, R. K.; Robertson, J. B.; Gilmer, T. E., Jr.

    1972-01-01

    When beryllium is thermally diffused into silicon, it gives rise to acceptor levels 191 and 145 meV above the valence band. Quenching and annealing studies indicate that the 145-meV level is due to a more complex beryllium configuration than the 191-meV level. When lithium is thermally diffused into a beryllium-doped silicon sample, it produces two new acceptor levels at 106 and 81 meV. Quenching and annealing studies indicate that these new levels are due to lithium forming a complex with the defects responsible for the 191- and 145-meV beryllium levels, respectively. Electrical measurements imply that the lithium impurity ions are physically close to the beryllium impurity atoms. The ground state of the 106-meV beryllium-lithium level is split into two levels, presumably by internal strains. Tentative models are proposed to explain these results.

  2. Fluoride evaporation and crystallization behavior of CaF2-CaO-Al2O3-(TiO2) slag for electroslag remelting of Ti-containing steels

    NASA Astrophysics Data System (ADS)

    Shi, Cheng-bin; Cho, Jung-wook; Zheng, Ding-li; Li, Jing

    2016-06-01

    To elucidate the behavior of slag films in an electroslag remelting process, the fluoride evaporation and crystallization of CaF2-CaO-Al2O3-(TiO2) slags were studied using the single hot thermocouple technique. The crystallization mechanism of TiO2-bearing slag was identified based on kinetic analysis. The fluoride evaporation and incubation time of crystallization in TiO2-free slag are found to considerably decrease with decreasing isothermal temperature down to 1503 K. Fish-bone and flower-like CaO crystals precipitate in TiO2-free slag melt, which is accompanied by CaF2 evaporation from slag melt above 1503 K. Below 1503 K, only near-spherical CaF2 crystals form with an incubation time of less than 1 s, and the crystallization is completed within 1 s. The addition of 8.1wt% TiO2 largely prevents the fluoride evaporation from slag melt and promotes the slag crystallization. TiO2 addition leads to the precipitation of needle-like perovskite (CaTiO3) crystals instead of CaO crystals in the slag. The crystallization of perovskite (CaTiO3) occurs by bulk nucleation and diffusion-controlled one-dimensional growth.

  3. An insight into crystal, electronic, and local structures of lithium iron silicate (Li2FeSiO4) materials upon lithium extraction

    NASA Astrophysics Data System (ADS)

    Kamon-in, O.; Klysubun, W.; Limphirat, W.; Srilomsak, S.; Meethong, N.

    2013-05-01

    Recently, orthosilicate, Li2MSiO4 (where M=transition metal) materials have been attracting considerable attention for potential use as a new generation cathode for Li-ion batteries due to their safety, low toxicity, and low cost characteristics. In addition, the presence of two Li+ ions in the molecule offers a multiple electron-charge transfer (M2+/M3+ and M3+/M4+ redox couples), thus allowing a high achievable capacity of more than 320 mA h/g per M unit. Good electrochemical properties of Li2FeSiO4 have been reported through several approaches such as downsizing of the particles, carbon-coating, etc. However, in addition to electrochemical performance, fundamental understanding regarding crystal, electronic and local structure changes during charge/discharge processes is also important and needs more rigorous investigation. In this work, lithium iron silicates (Li2FeSiO4/C) in space group of Pnma: a=10.6671(3) Å, b=6.2689(2) Å, and c=5.0042(2) Å have been prepared by solid-state reaction. The synthesized as well as chemical delithiated samples have been characterized by XRD, HRTEM, AAS and XAS techniques. We will show the results focusing on Fe K-edge XANES, EXAFS, HRTEM and XRD of the Li2-xFeSiO4 samples and discuss how the crystal, electronic, and local structure changes upon Li+ de-intercalation.

  4. Test beam results with a sampling calorimeter of cerium fluoride scintillating crystals and tungsten absorber plates for calorimetry at the HL-LHC

    NASA Astrophysics Data System (ADS)

    Becker, R.; Dissertori, G.; Djambazov, L.; Donegà, M.; Dröge, M.; Haller, C.; Horisberger, U.; Lustermann, W.; Nessi-Tedaldi, F.; Quittnat, M.; Pandolfi, F.; Peruzzi, M.; Schönenberger, M.; Cavallari, F.; Dafinei, I.; Diemoz, M.; D`Imperio, G.; del Re, D.; Gelli, S.; Jorda Lope, C.; Meridiani, P.; Micheli, F.; Nuccetelli, M.; Organtini, G.; Paramatti, R.; Pellegrino, F.; Rahatlou, S.; Rovelli, C.; Santanastasio, F.; Soffi, L.; Tabarelli de Fatis, T.; Martelli, A.; Monti, V.; Pastrone, N.; Trapani, P. P.; Candelise, V.; Della Ricca, G.

    2016-07-01

    A sampling calorimeter using cerium fluoride scintillating crystals as active material, interleaved with absorber plates made of tungsten, and read out by wavelength-shifting fibres has been tested with high-energy electron beams at the CERN SPS H4 beam line, as well as with lower-energy beams at the INFN Frascati Beam Test Facility in Italy. Energy resolution studies revealed a low stochastic term (< 10 % /√{ E }). This result, combined with high radiation hardness of the material used, marks this sampling calorimeter as a good candidate for the detectors' forward regions during the high luminosity phase of LHC.

  5. Frequency doubling of incoherent light from a superluminescent diode in a periodically poled lithium niobate waveguide crystal

    NASA Astrophysics Data System (ADS)

    Kurzke, Henning; Kiethe, Jan; Heuer, Axel; Jechow, Andreas

    2017-05-01

    The amplified spontaneous emission from a superluminescent diode was frequency doubled in a periodically poled lithium niobate waveguide crystal. The temporally incoherent radiation of such a superluminescent diode is characterized by a relatively broad spectral bandwidth and thermal-like photon statistics, as the measured degree of second order coherence, {{g}(2)}(0)=1.9+/- 0.1 , indicates. Despite the non-optimized scenario in the spectral domain, we achieve six orders of magnitude higher conversion efficiency than previously reported with truly incoherent light. This is possible by using single spatial mode radiation and quasi phase matched material with a waveguide architecture. This work is a principle step towards efficient frequency conversion of temporally incoherent radiation in one spatial mode to access wavelengths where no radiation from superluminescent diodes is available, especially with tailored quasi phase matched crystals. The frequency doubled light might find application in imaging, metrology and quantum optics experiments.

  6. Bulk crystal growth, optical, mechanical and ferroelectric properties of new semiorganic nonlinear optical and piezoelectric Lithium nitrate monohydrate oxalate single crystal

    NASA Astrophysics Data System (ADS)

    Dalal, Jyoti; Kumar, Binay

    2016-01-01

    New semiorganic nonlinear optical single crystals of Lithium nitrate oxalate monohydrate (LNO) were grown by slow evaporation solution technique. Single crystal X-ray diffraction study indicated that LNO crystal belongs to the triclinic system with space group P1. Various functional groups present in the material were identified by FTIR and Raman analysis. UV-vis study showed the high transparency of crystals with a wide band gap 5.01 eV. Various Optical constants i.e. Urbach energy (Eu), extinction coefficient (K), refractive index, optical conductivity, electric susceptibility with real and imaginary parts of dielectric constant were calculated using the transmittance data which have applications in optoelectronic devices. A sharp emission peak was found at 438 nm in photoluminescence measurement, which revealed suitability of crystal for fabricating violet lasers. In dielectric studies, a peak has been observed at 33 °C which is due to ferroelectric to paraelectric phase transition. Piezoelectric charge coefficients (d33 = 9.2 pC/N and g33) have been calculated, which make it a suitable for piezoelectric devices applications. In ferroelectric studies, a saturated loop was found in which the values of coercive field and remnant polarization were found to be 2.18 kV/cm and 0.39 μC/cm2, respectively. Thermal behavior was studied by TGA and DSC studies. The relative SHG efficiency of LNO was found to be 1.2 times that of KDP crystal. In microhardness study, Meyer's index value was found to be 1.78 which revealed its soft nature. These optical, dielectric, piezoelectric, ferroelectric, mechanical and non-linear optical properties of grown crystal establish the usefulness of this material for optoelectronics, non-volatile memory and piezoelectric devices applications.

  7. A study of beryllium and beryllium-lithium complexes in single crystal silicon

    NASA Technical Reports Server (NTRS)

    Crouch, R. K.; Robertson, J. B.; Gilmer, T. E., Jr.

    1972-01-01

    When beryllium is thermally diffused into silicon, it gives rise to acceptor levels 191 MeV and 145 meV above the valence band. Quenching and annealing studies indicate that the 145-MeV level is due to a more complex beryllium configuration than the 191-MeV level. When lithium is thermally diffused into a beryllium-doped silicon sample, it produces two acceptor levels at 106 MeV and 81 MeV. Quenching and annealing studies indicate that these levels are due to lithium forming a complex with the defects responsible for the 191-MeV and 145-MeV beryllium levels, respectively. Electrical measurements imply that the lithium impurity ions are physically close to the beryllium impurity atoms. The ground state of the 106-MeV beryllium level is split into two levels, presumably by internal strains. Tentative models are proposed.

  8. Variation and fractionation of lithium isotope ratios within single tourmaline crystals in the pegmatites of the Black Hills, SD

    NASA Astrophysics Data System (ADS)

    Gross, M.; Nabelek, P. I.

    2012-12-01

    Lithium isotopes are quickly becoming a valuable geochemical tool, providing insight into a broad range of studies. Li isotopes have been utilized in studies with subjects ranging from mantle processes to planetary accretion on stars. Yet, as an emerging technique, a number of uncertainties remain to be resolved. Two basic questions must be answered in order to apply isotope studies in a meaningful way: How do isotopes fractionate from each other and what do the isotope ratios mean? Previous studies on intra-crystal Li isotope signatures in tourmaline are extremely limited. One study showed roughly homogenous isotope profile using secondary ion mass spectroscopy (SIMS) analysis (Ludwig et al. 2011). If Li isotopes are in fact variable within individual crystals, however, it has implications for previous models of pegmatite formation reached using Li isotopes, as well as the root cause of Li isotope fractionation in tourmaline. For this study, tourmaline samples were collected from several texturally different pegmatite localities in the Black Hills, SD. Lithium concentrations and isotope ratios were measured along numerous points in a tourmaline crystal to discern how they change within a single crystal. The tourmaline was dissolved by an alkali fusion technique. Concentrations were determined at the University of Missouri using a Perkin-Elmer Optima 3300 Inductively Coupled Plasma Optical Emission Spectrometer (ICP-OES). Isotope measurements were performed at University of Maryland-College Park by a Nu Plasma Multi-collector ICP-MS. The procedure followed the three-column cation exchange chromatography method. Additionally, elemental mapping was performed on one sample using the JEOL JXA-8200 Superprobe at Washington University in St. Louis. Results of this research reveal that extreme fractionation of Li is possible within single tourmaline crystals. The δ7Li values measured are among the highest measured in rocks, though the average for each crystal falls

  9. Fluoride mouthrinses and fluoride varnishes.

    PubMed

    Petersson, L G

    1993-01-01

    The cariostatic efficacy of rinsing with a 0.05-0.2% neutral sodium fluoride solution has been clearly demonstrated, especially in supervised school-based programmes in moderate and high caries risk children. The cost-benefit effect, however, is questionable in populations with low caries prevalence, and fluoride rinsing programmes are gradually being replaced by more individual fluoride therapy comprising combinations of fluoride toothpastes, tablets, or varnishes. Fluoride varnishes were developed as individual alternatives to conventional topical fluoride application and are today gaining acceptance for clinical application. Two varnishes, Duraphat containing 5% wt NaF and Fluor Protector with 0.9% wt fluor silane, are available commercially. The clinical effects seem to depend mainly on application frequency, especially in high caries risk groups. The cost-benefit effect is high, but can be increased by delegating application to auxiliary personnel in conjunction with regular dental visits. Toxicologically both fluoride mouthrinses and fluoride varnishes are safe if used as directed.

  10. Lithium ions in the van der Waals gap of Bi{sub 2}Se{sub 3} single crystals

    SciTech Connect

    Bludska, J.; Jakubec, I.; Karamazov, S.; Horak, J.; Uher, C.

    2010-12-15

    Insertion/extraction of lithium ions into/from Bi{sub 2}Se{sub 3} crystals was investigated by means of cyclic voltammetry. The process of insertion is reflected in the appearance of two bands on voltammograms at {approx}1.7 and {approx}1.5 V, corresponding to the insertion of Li{sup +} ions into octahedral and tetrahedral sites of the van der Waals gap of these layered crystals. The process of extraction of Li{sup +} ions from the gap results in the appearance of four bands on the voltammograms. The bands 1 and 2 at {approx}2.1 and {approx}2.3 V correspond to the extraction of a part of Li{sup +} guest ions from the octahedral and tetrahedrals sites and this extraction has a character of a reversible intercalation/deintercalation process. A part of Li{sup +} ions is bound firmly in the crystal due to the formation of negatively charged clusters of the (LiBiSe{sub 2}.Bi{sub 3}Se{sub 4}{sup -}) type. A further extraction of Li{sup +} ions from the van der Waals gap is associated with the presence of bands 3 and 4 placed at {approx}2.5 and {approx}2.7 V on the voltammograms as their extraction needs higher voltage due to the influence of negative charges localized on these clusters. -- Graphical abstract: Insertion/extraction of lithium ions into/from Bi{sub 2}Se{sub 3} layered crystals was investigated by cyclic voltammetry. The extraction of Li{sup +} results in the appearance of four bands on the voltammograms. The first two bands have a character of a reversible process. A part of Li{sup +} ions is bound firmly in the crystal due to the formation of negatively charged clusters of the (LiBiSe{sub 2}.Bi{sub 3}Se{sub 4}{sup -}) type. Their extraction needs higher voltage due to the negative charge. Display Omitted

  11. Crystal and mol­ecular structures of two silver(I) amidinates, including an unexpected co-crystal with a lithium amidinate

    PubMed Central

    Wang, Sida; Harmgarth, Nicole; Liebing, Phil; Edelmann, Frank T.

    2016-01-01

    The silver(I) amidinates bis­[μ-N 1,N 2-bis­(propan-2-yl)benzamidinato-κ2 N 1:N 2]disilver(I), [Ag2(C13H19N2)2] or [Ag{PhC(NiPr)2}]2 (1), and bis­(μ-N 1,N 2-di­cyclohexyl-3-cyclo­propyl­propynamidinato-κ2 N 1:N 2)disilver(I), [Ag2(C18H27N2)2] or [Ag{cyclo-C3H5–C≡C–C(NCy)2}]2 (2a), exist as centrosymmetric dimers with a planar Ag2N4C2 ring and a common linear coordination of the metal atoms in the crystalline state. Moiety 2a forms a co-crystal with the related lithium amidinate, namely bis­(μ-N 1,N 2-di­cyclo­hexyl-3-cyclo­propyl­propynamidinato-κ2 N 1:N 2)disilver(I) bis­(μ-N 1,N 2-di­cyclo­hexyl-3-cyclo­propyl­propynamidinato-κ3 N 1,N 2:N 1)bis­(tetra­hydro­furan-κO)lithium(I) toluene monosolvate, [Ag2(C18H27N2)2][Li2(C18H27N2)2(C4H8O)2]·C7H8 or [Ag{cyclo-C3H5–C≡C–C(NCy)2}]2[Li{cyclo-C3H5–C≡C–C(NCy)2}(THF)]2·C7H8, composed as 2a × 2b × toluene. The lithium moiety 2b features a typical ladder-type dimeric structure with a distorted tetra­hedral coordination of the metal atoms. In the silver(I) derivatives 1 and 2a, the amidinate ligand adopts a μ-κN:κN′ coordination, while it is a μ-κN:κN:κN′-coordination in the case of lithium derivative 2b. PMID:27980831

  12. Crystal and mol-ecular structures of two silver(I) amidinates, including an unexpected co-crystal with a lithium amidinate.

    PubMed

    Wang, Sida; Harmgarth, Nicole; Liebing, Phil; Edelmann, Frank T

    2016-12-01

    The silver(I) amidinates bis-[μ-N(1),N(2)-bis-(propan-2-yl)benzamidinato-κ(2)N(1):N(2)]disilver(I), [Ag2(C13H19N2)2] or [Ag{PhC(N (i) Pr)2}]2 (1), and bis-(μ-N(1),N(2)-di-cyclohexyl-3-cyclo-propyl-propynamidinato-κ(2)N(1):N(2))disilver(I), [Ag2(C18H27N2)2] or [Ag{cyclo-C3H5-C≡C-C(NCy)2}]2 (2a), exist as centrosymmetric dimers with a planar Ag2N4C2 ring and a common linear coordination of the metal atoms in the crystalline state. Moiety 2a forms a co-crystal with the related lithium amidinate, namely bis-(μ-N(1),N(2)-di-cyclo-hexyl-3-cyclo-propyl-propynamidinato-κ(2)N(1):N(2))disilver(I) bis-(μ-N(1),N(2)-di-cyclo-hexyl-3-cyclo-propyl-propynamidinato-κ(3)N(1),N(2):N(1))bis-(tetra-hydro-furan-κO)lithium(I) toluene monosolvate, [Ag2(C18H27N2)2][Li2(C18H27N2)2(C4H8O)2]·C7H8 or [Ag{cyclo-C3H5-C≡C-C(NCy)2}]2[Li{cyclo-C3H5-C≡C-C(NCy)2}(THF)]2·C7H8, composed as 2a × 2b × toluene. The lithium moiety 2b features a typical ladder-type dimeric structure with a distorted tetra-hedral coordination of the metal atoms. In the silver(I) derivatives 1 and 2a, the amidinate ligand adopts a μ-κN:κN' coordination, while it is a μ-κN:κN:κN'-coordination in the case of lithium derivative 2b.

  13. Role of surface ligands in the nanoparticle assemblies: a case study of regularly shaped colloidal crystals composed of sodium rare earth fluoride.

    PubMed

    Feng, Wei; Sun, Ling-Dong; Yan, Chun-Hua

    2011-04-05

    Assembly of nanoparticles is a promising route to fabricate devices from nanomaterials. Colloidal crystals are well-defined three-dimensional assemblies of nanoparticles with long-range ordered structures and crystalline symmetries. Here, we use a solvent evaporation induced assembly method to obtain colloidal crystals composed of polyhedral sodium rare earth fluoride nanoparticles. The building blocks exhibit the same crystalline orientation in each colloidal crystal as indicated in electron diffraction patterns. The driving force of the oriented assembly is ascribed to the facet-selected capping of oleic acid molecules on {110} facets of the nanoparticles, and the favorable coordination behavior of OA molecules is explained by the steric hindrance determined adsorption based on the studies of the surface atomic structure of nanocrystals and molecular mechanics simulation of OA molecules. The capping ligands also provide hydrophobic interactions between nanoparticles and further direct the oriented assembly process to construct a face-centered cubic structure. These results not only provide a new type of building block for colloidal crystals, but also clarify the important role of surface ligands, which determine the packed structure and orientations of nanoparticles in the assemblies.

  14. Lithium ion diffusion in Li β-alumina single crystals measured by pulsed field gradient NMR spectroscopy

    SciTech Connect

    Chowdhury, Mohammed Tareque Takekawa, Reiji; Iwai, Yoshiki; Kuwata, Naoaki; Kawamura, Junichi

    2014-03-28

    The lithium ion diffusion coefficient of a 93% Li β-alumina single crystal was measured for the first time using pulsed field gradient (PFG) NMR spectroscopy with two different crystal orientations. The diffusion coefficient was found to be 1.2 × 10{sup −11} m{sup 2}/s in the direction perpendicular to the c axis at room temperature. The Li ion diffusion coefficient along the c axis direction was found to be very small (6.4 × 10{sup −13} m{sup 2}/s at 333 K), which suggests that the macroscopic diffusion of the Li ion in the β-alumina crystal is mainly two-dimensional. The diffusion coefficient for the same sample was also estimated using NMR line narrowing data and impedance measurements. The impedance data show reasonable agreement with PFG-NMR data, while the line narrowing measurements provided a lower value for the diffusion coefficient. Line narrowing measurements also provided a relatively low value for the activation energy and pre-exponential factor. The temperature dependent diffusion coefficient was obtained in the temperature range 297–333 K by PFG-NMR, from which the activation energy for diffusion of the Li ion was estimated. The activation energy obtained by PFG-NMR was smaller than that obtained by impedance measurements, which suggests that thermally activated defect formation energy exists for 93% Li β-alumina single crystals. The diffusion time dependence of the diffusion coefficient was observed for the Li ion in the 93% Li β-alumina single crystal by means of PFG-NMR experiments. Motion of Li ion in fractal dimension might be a possible explanation for the observed diffusion time dependence of the diffusion coefficient in the 93% Li β–alumina system.

  15. Optimization of the idler wavelength tunable cascaded optical parametric oscillator based on chirp-assisted aperiodically poled lithium niobate crystal

    NASA Astrophysics Data System (ADS)

    Tao, Chen; Rong, Shu; Ye, Ge; Zhuo, Chen

    2016-01-01

    We present the numerical results for the optimization of the pump-to-idler conversion efficiencies of nanosecond idler wavelength tunable cascaded optical parametric oscillators (OPO) in different wavelength tuning ranges, where the primary signals from the OPO process are recycled to enhance the pump-to-idler conversion efficiencies via the simultaneous difference frequency generation (DFG) process by monolithic aperiodically poled, magnesium oxide doped lithium niobate (APMgLN) crystals. The APMgLN crystals are designed with different chirp parameters for the DFG process to broaden their thermal acceptance bandwidths to different extents. The idler wavelength tuning of the cascaded OPO is realized by changing the temperature of the designed APMgLN crystal and the cascaded oscillation is achieved in a single pump pass singly resonant linear cavity. The pump-to-idler conversion efficiencies with respect to the pump pulse duration and ratio of OPO coefficient to DFG coefficient are calculated by numerically solving the coupled wave equations. The optimal working conditions of the tunable cascaded OPOs pumped by pulses with energies of 350 μJ and 700 μJ are compared to obtain the general rules of optimization. It is concluded that the optimization becomes the interplay between the ratio of OPO coefficient to DFG coefficient and the pump pulse duration when the idler wavelength tuning range and the pump pulse energy are fixed. Besides, higher pump pulse energy is beneficial for reaching higher optimal pump-to-idler conversion efficiency as long as the APMgLN crystal is optimized according to this pump condition. To the best of our knowledge, this is the first numerical analysis of idler wavelength tunable cascaded OPOs based on chirp-assisted APMgLN crystals. Project supported by the National Natural Science Foundation of China (Grant No. 61505236), the Innovation Program of Shanghai Institute of Technical Physics, China (Grant No. CX-2), and the Program of Shanghai

  16. Lithium ion diffusion in Li β-alumina single crystals measured by pulsed field gradient NMR spectroscopy.

    PubMed

    Chowdhury, Mohammed Tareque; Takekawa, Reiji; Iwai, Yoshiki; Kuwata, Naoaki; Kawamura, Junichi

    2014-03-28

    The lithium ion diffusion coefficient of a 93% Li β-alumina single crystal was measured for the first time using pulsed field gradient (PFG) NMR spectroscopy with two different crystal orientations. The diffusion coefficient was found to be 1.2 × 10(-11) m(2)/s in the direction perpendicular to the c axis at room temperature. The Li ion diffusion coefficient along the c axis direction was found to be very small (6.4 × 10(-13) m(2)/s at 333 K), which suggests that the macroscopic diffusion of the Li ion in the β-alumina crystal is mainly two-dimensional. The diffusion coefficient for the same sample was also estimated using NMR line narrowing data and impedance measurements. The impedance data show reasonable agreement with PFG-NMR data, while the line narrowing measurements provided a lower value for the diffusion coefficient. Line narrowing measurements also provided a relatively low value for the activation energy and pre-exponential factor. The temperature dependent diffusion coefficient was obtained in the temperature range 297-333 K by PFG-NMR, from which the activation energy for diffusion of the Li ion was estimated. The activation energy obtained by PFG-NMR was smaller than that obtained by impedance measurements, which suggests that thermally activated defect formation energy exists for 93% Li β-alumina single crystals. The diffusion time dependence of the diffusion coefficient was observed for the Li ion in the 93% Li β-alumina single crystal by means of PFG-NMR experiments. Motion of Li ion in fractal dimension might be a possible explanation for the observed diffusion time dependence of the diffusion coefficient in the 93% Li β-alumina system.

  17. Enhanced Cherenkov phase matching terahertz wave generation via a magnesium oxide doped lithium niobate ridged waveguide crystal

    NASA Astrophysics Data System (ADS)

    Takeya, K.; Minami, T.; Okano, H.; Tripathi, S. R.; Kawase, K.

    2017-01-01

    When combined with a nonlinear waveguide crystal, Cherenkov phase matching allows for highly effective generation of high power and broadband terahertz (THz) waves. Using a ridged Lithium Niobate (LiNbO3) waveguide coupled with a specially designed silicon lens, we successfully generated THz waves with intensity of approximately three orders of magnitude stronger than those from conventional photoconductive antenna. The broadband spectrum was from 0.1 THz to 7 THz with a maximum dynamic range of 80 dB. The temporal shape of time domain pulse is a regular single cycle which could be used for high depth resolution time of flight tomography. The generated THz wave can also be easily monitored by compact room-temperature THz camera, enabling us to determine the spatial characteristics of the THz propagation.

  18. Fabrication of polarization-independent waveguides deeply buried in lithium niobate crystal using aberration-corrected femtosecond laser direct writing

    PubMed Central

    Wang, Peng; Qi, Jia; Liu, Zhengming; Liao, Yang; Chu, Wei; Cheng, Ya

    2017-01-01

    Writing optical waveguides with femtosecond laser pulses provides the capability of forming three-dimensional photonic circuits for manipulating light fields in both linear and nonlinear manners. To fully explore this potential, large depths of the buried waveguides in transparent substrates are often desirable to facilitate achieving vertical integration of waveguides in a multi-layer configuration, which, however, is hampered by rapidly degraded axial resolution caused by optical aberration. Here, we show that with the correction of the spherical aberration, polarization-independent waveguides can be inscribed in a nonlinear optical crystal lithium niobate (LN) at depths up to 1400 μm, which is more than one order of magnitude deeper than the waveguides written with aberration uncorrected femtosecond laser pulses. Our technique is beneficial for applications ranging from miniaturized nonlinear light sources to quantum information processing. PMID:28112246

  19. Fabrication of polarization-independent waveguides deeply buried in lithium niobate crystal using aberration-corrected femtosecond laser direct writing.

    PubMed

    Wang, Peng; Qi, Jia; Liu, Zhengming; Liao, Yang; Chu, Wei; Cheng, Ya

    2017-01-23

    Writing optical waveguides with femtosecond laser pulses provides the capability of forming three-dimensional photonic circuits for manipulating light fields in both linear and nonlinear manners. To fully explore this potential, large depths of the buried waveguides in transparent substrates are often desirable to facilitate achieving vertical integration of waveguides in a multi-layer configuration, which, however, is hampered by rapidly degraded axial resolution caused by optical aberration. Here, we show that with the correction of the spherical aberration, polarization-independent waveguides can be inscribed in a nonlinear optical crystal lithium niobate (LN) at depths up to 1400 μm, which is more than one order of magnitude deeper than the waveguides written with aberration uncorrected femtosecond laser pulses. Our technique is beneficial for applications ranging from miniaturized nonlinear light sources to quantum information processing.

  20. Fabrication of polarization-independent waveguides deeply buried in lithium niobate crystal using aberration-corrected femtosecond laser direct writing

    NASA Astrophysics Data System (ADS)

    Wang, Peng; Qi, Jia; Liu, Zhengming; Liao, Yang; Chu, Wei; Cheng, Ya

    2017-01-01

    Writing optical waveguides with femtosecond laser pulses provides the capability of forming three-dimensional photonic circuits for manipulating light fields in both linear and nonlinear manners. To fully explore this potential, large depths of the buried waveguides in transparent substrates are often desirable to facilitate achieving vertical integration of waveguides in a multi-layer configuration, which, however, is hampered by rapidly degraded axial resolution caused by optical aberration. Here, we show that with the correction of the spherical aberration, polarization-independent waveguides can be inscribed in a nonlinear optical crystal lithium niobate (LN) at depths up to 1400 μm, which is more than one order of magnitude deeper than the waveguides written with aberration uncorrected femtosecond laser pulses. Our technique is beneficial for applications ranging from miniaturized nonlinear light sources to quantum information processing.

  1. NONLINEAR OPTICAL PHENOMENA: Manifestation of a photorefractive effect in Raman spectra of lithium niobate crystals of different compositions

    NASA Astrophysics Data System (ADS)

    Sidorov, N. V.; Chufyrev, P. G.; Palatnikov, M. N.; Mel'nik, N. N.; Zheleznov, Yu A.; Khomich, V. Yu

    2004-12-01

    The ordering of structural units in a cation sublattice and the photorefractive properties of lithium niobate single crystals of different compositions: nominally pure with different [Li]/[Nb] ratios and doped with non-photorefractive cations Mg2+, Gd3+, and Y3+, are studied by their Raman spectra. It is shown that at low concentrations of Mg2+, Gd3+, and Y3+, the magnitude of the photorefractive effect is determined by the ordering of the structural units of the cation sublattice. It is found for the first time that the intensity of a Raman line corresponding to the bridge valence vibrations of oxygen atoms in the NbO6 octahedra is sensitive to the dipole ordering of the cation sublattice.

  2. PARAMAGNETIC RELAXATION IN CRYSTALS.

    DTIC Science & Technology

    CRYSTALS, PARAMAGNETIC RESONANCE, RELAXATION TIME , CRYSTAL DEFECTS, QUARTZ, GLASS, STRAIN(MECHANICS), TEMPERATURE, NUCLEAR SPINS, HYDROGEN, CALCIUM COMPOUNDS, FLUORIDES, COLOR CENTERS, PHONONS, OXYGEN.

  3. Effect of polypyrrole embedment on non-isothermal crystallization kinetics of poly (vinylidene fluoride-co-hexafluoropropylene)

    NASA Astrophysics Data System (ADS)

    Biswas, Swarup; Bhattacharya, S.

    2017-05-01

    Polypyrrole (PPy)/Poly (vinylidene fluoride-co-hexafluoropropylene) (PVDF-HFP) blend is synthesized by in situ polymerization of pyrrole. FTIR confirms the formation of Polypyrrole (PPy) within PVDF-HFP matrices. Weight percentages of different components within composites are estimated by TGA. Detailed study of nucleation and kinetics at its melt condition under non-isothermal environment is done by the DSC measurement. The presence of PPy within the PVDF-HFP matrices accelerated the nucleation rate of the polymer.

  4. Dentifrice Fluoride

    NASA Astrophysics Data System (ADS)

    Rakita, Philip E.

    2004-05-01

    The effectiveness of the fluoride ion in lowering the incidence of dental caries is a major factor in the field of dental health. Observations and research studies in the first half of the 20th century have lead to the widespread adoption of fluoridated water and the use of inorganic fluoride compounds in oral care products, such as toothpaste and dental rinses. This article provides a brief review of the types of compounds used and the chemistry involved.

  5. Bottled Water and Fluoride

    MedlinePlus

    ... Fluoridation Journal Articles for Community Water Fluoridation Bottled Water Recommend on Facebook Tweet Share Compartir Consumers drink ... questions about bottled water and fluoride. Does bottled water contain fluoride? Bottled water products may contain fluoride, ...

  6. Water fluoridation.

    PubMed

    Parnell, C; Whelton, H; O'Mullane, D

    2009-09-01

    This was to present a summary of the evidence from systematic reviews of the effectiveness and safety of water fluoridation. A search for relevant systematic reviews was conducted using the terms Fluoridation [Mesh] OR "water fluoridation" OR fluoridation OR (water AND fluoride) and was run from 01/01/2000 to 17/10/2008 in Pubmed, Embase, the Cochrane Database of Systematic Reviews and the Database of Abstracts of Reviews of Effects in the Cochrane Library. The quality of the systematic reviews was assessed using Scottish Intercollegiate Guideline Network (SIGN) methodology checklists for systematic reviews. Websites of guideline organisations were also searched for relevant evidence-based guidelines, which were appraised using the AGREE instrument. Of the 59 publications identified, 3 systematic reviews and 3 guidelines were included in this review. While the reviews themselves were of good methodological quality, the studies included in the reviews were generally of moderate to low quality. The results of the three reviews showed that water fluoridation is effective at reducing caries in children and adults. With the exception of dental fluorosis, no association between adverse effects and water fluoridation has been established. Water fluoridation reduces caries for all social classes, and there is some evidence that it may reduce the oral health gap between social classes. Water fluoridation, where technically feasible and culturally acceptable, remains a relevant and valid choice as a population measure for the prevention of dental caries.

  7. Lithium batteries. Citations from the NTIS data base

    NASA Astrophysics Data System (ADS)

    Cavagnaro, D. M.

    1980-07-01

    Federally funded research on design, development, components, testing corrosion, electrolytes, sealing, hazards of lithium cells are presented. Batteries studied include lithium organic cells, lithium sulfur cells, lithium water air cells, and lithium nickel fluoride cells. Applications cover use in spacecraft, electric vehicles, off peak energy storage, and forklift trucks. This updated bibliography contains 151 citations, 57 of which are new entries to the previous edition.

  8. Enhanced electroactive and mechanical properties of poly(vinylidene fluoride) by controlling crystallization and interfacial interactions with low loading polydopamine coated BaTiO₃.

    PubMed

    Jia, Nan; Xing, Qian; Liu, Xu; Sun, Jing; Xia, Guangmei; Huang, Wei; Song, Rui

    2015-09-01

    Poly(vinylidene fluoride) (PVDF) is a semi-crystalline polymer and the polar β-phase of PVDF shows superb electroactive properties. In order to enhance the β-phase of PVDF, extreme low content of BaTiO3 nanoparticles (BT-NPs) coated with polydopamine (Pdop) were incorporated into PVDF matrix by solution casting. The β-phase of the resulting PVDF nanocomposites film was dramatically increased and the d33 value reached 34.3±0.4 pCN(-1). It is found that the Pdop layer could improve the dispersibility and stability of the BT NPs in solution and endow the BT NPs good dispersity in the PVDF matrix. Moreover, the interfacial interaction between PVDF chains and the surface of BT-Pdop nanoparticles (BT-Pdop NPs) were revealed, in which the CF2 groups on PVDF could interact with the electron-rich plane of aromatic ring of Pdop moiety. This interaction, led to the increase of the crystallization activation energy as derived from the DSC nonisothermal crystallization measurement. The α-β crystal transformation, organization of interfacial interactions as well as the prevention of agglomeration of BT-NPs confer the improvement of mechanical and thermal properties of PVDF, such as toughness, tensile strength, elongation at break, and thermal conductivity.

  9. Tip-induced domain growth on the non-polar cuts of lithium niobate single-crystals

    SciTech Connect

    Alikin, D. O.; Turygin, A. P.; Lobov, A. I.; Shur, V. Ya.; Ievlev, A. V.; Kalinin, S. V.

    2015-05-04

    Currently, ferroelectric materials with designed domain structures are considered as a perspective material for new generation of photonic, data storage, and data processing devices. Application of external electric field is the most convenient way of the domain structure formation. Lots of papers are devoted to the investigation of domain kinetics on polar surface of crystals while the forward growth remains one of the most mysterious stages due to lack of experimental methods allowing to study it. Here, we performed tip-induced polarization reversal on X- and Y-non-polar cuts in single-crystal of congruent lithium niobate which allows us to study the forward growth with high spatial resolution. The revealed difference in the shape and length of domains induced on X- and Y-cuts is beyond previously developed theoretical approaches used for the theoretical consideration of the domains growth at non-polar ferroelectric surfaces. To explain experimental results, we used kinetic approach with anisotropy of screening efficiency along different crystallographic directions.

  10. Tip-induced domain growth on the non-polar cuts of lithium niobate single-crystals

    SciTech Connect

    Alikin, Denis O.; Ievlev, Anton; Turigin, Anton P.; Lobov, Alexei; Kalinin, Sergei V; Shur, Vladimir Ya.

    2015-05-05

    Currently ferroelectric materials with designed domain structures are considered as a perspective material for new generation of photonic, data storage and data processing devices. Application of external electric field is the most convenient way of the domain structure formation. Lots of papers are devoted to investigation of the domain kinetics on polar surface of crystals while the forward growth remains one of the most mysterious stages due to lack of experimental methods allowing to study it. Here we performed tip-induced polarization reversal on X- and Y-non-polar cuts in single-crystal of congruent lithium niobate allows us to study the forward growth with high spatial resolution. The revealed difference in the shape and length of domains induced on X- and Y-cuts is beyond previously developed theoretical approaches used for the theoretical consideration of the domains growth at non-polar ferroelectric surfaces. Lastly, to explain experimental results we used kinetic approach with anisotropy of screening efficiency along different crystallographic directions.

  11. Tip-induced domain growth on the non-polar cuts of lithium niobate single-crystals

    DOE PAGES

    Alikin, Denis O.; Ievlev, Anton; Turigin, Anton P.; ...

    2015-05-05

    Currently ferroelectric materials with designed domain structures are considered as a perspective material for new generation of photonic, data storage and data processing devices. Application of external electric field is the most convenient way of the domain structure formation. Lots of papers are devoted to investigation of the domain kinetics on polar surface of crystals while the forward growth remains one of the most mysterious stages due to lack of experimental methods allowing to study it. Here we performed tip-induced polarization reversal on X- and Y-non-polar cuts in single-crystal of congruent lithium niobate allows us to study the forward growthmore » with high spatial resolution. The revealed difference in the shape and length of domains induced on X- and Y-cuts is beyond previously developed theoretical approaches used for the theoretical consideration of the domains growth at non-polar ferroelectric surfaces. Lastly, to explain experimental results we used kinetic approach with anisotropy of screening efficiency along different crystallographic directions.« less

  12. Inhibition of Maize Root H+-ATPase by Fluoride and Fluoroaluminate Complexes.

    PubMed Central

    Facanha, A. R.; De Meis, L.

    1995-01-01

    Vesicles derived from maize roots retain a membrane-bound H+-ATPase that is able to pump H+ at the expense of ATP hydrolysis. The H+ pumping and the ATPase activity of these vesicles are inhibited by lithium fluoride and by the complex formed between fluoride and aluminum. The inhibition promoted by lithium fluoride increases as the MgCl2 concentration in the medium is increased from 2 to 20 mM. The inhibitory activity of both lithium fluoride and aluminum fluoride increases as the temperature of the medium is increased from 20 to 35[deg]C. Inorganic phosphate (10-40 mM) inhibits the H+ -ATPase at pH 6.5 but not at pH 7.0, and at both pH values, it antagonizes the inhibition promoted by lithium fluoride and fluoroaluminate complexes. PMID:12228469

  13. 127I NQR and spectroscopic investigation of impurity-doped and mixed lithium iodate Li 1- xH xIO 3 crystals

    NASA Astrophysics Data System (ADS)

    Barabash, A.; Gavrilko, T.; Eshimov, K.; Baran, J.; Ratajczak, H.

    2004-12-01

    The 127I NQR, IR absorption and Raman spectra of impurity-doped and mixed lithium iodate Li 1- xH xIO 3 crystals grown from water solutions with different LiIO 3/HIO 3 ratios were investigated depending on the content of the impurity hydrogen x. The NQR results suggested that, at small concentration of doping iodic acid x<0.22, the lattice dynamics of the crystal grown from water solution changes significantly though the crystal retains hexagonal symmetry. Spectroscopic studies are compatible with average hexagonal symmetry of the grown doped crystals. From the results of Raman studies at room temperature and 100 K, the concentration range of hydrogen dopant 0.22< x<0.36 was found where disordered solid solution crystals Li 1- xH xIO 3 are formed.

  14. Periodic domain inversion in x-cut single-crystal lithium niobate thin film

    NASA Astrophysics Data System (ADS)

    Mackwitz, P.; Rüsing, M.; Berth, G.; Widhalm, A.; Müller, K.; Zrenner, A.

    2016-04-01

    We report the fabrication of periodically poled domain patterns in x-cut lithium niobate thin-film. Here, thin films on insulator have drawn particular attention due to their intrinsic waveguiding properties offering high mode confinement and smaller devices compared to in-diffused waveguides in bulk material. In contrast to z-cut thin film lithium niobate, the x-cut geometry does not require back electrodes for poling. Further, the x-cut geometry grants direct access to the largest nonlinear and electro-optical tensor element, which overall promises smaller devices. The domain inversion was realized via electric field poling utilizing deposited aluminum top electrodes on a stack of LN thin film/SiO2 layer/Bulk LN, which were patterned by optical lithography. The periodic domain inversion was verified by non-invasive confocal second harmonic microscopy. Our results show domain patterns in accordance to the electrode mask layout. The second harmonic signatures can be interpreted in terms of spatially, overlapping domain filaments which start their growth on the +z side.

  15. Periodic domain inversion in x-cut single-crystal lithium niobate thin film

    SciTech Connect

    Mackwitz, P. Rüsing, M.; Berth, G.; Zrenner, A.; Widhalm, A.; Müller, K.

    2016-04-11

    We report the fabrication of periodically poled domain patterns in x-cut lithium niobate thin-film. Here, thin films on insulator have drawn particular attention due to their intrinsic waveguiding properties offering high mode confinement and smaller devices compared to in-diffused waveguides in bulk material. In contrast to z-cut thin film lithium niobate, the x-cut geometry does not require back electrodes for poling. Further, the x-cut geometry grants direct access to the largest nonlinear and electro-optical tensor element, which overall promises smaller devices. The domain inversion was realized via electric field poling utilizing deposited aluminum top electrodes on a stack of LN thin film/SiO{sub 2} layer/Bulk LN, which were patterned by optical lithography. The periodic domain inversion was verified by non-invasive confocal second harmonic microscopy. Our results show domain patterns in accordance to the electrode mask layout. The second harmonic signatures can be interpreted in terms of spatially, overlapping domain filaments which start their growth on the +z side.

  16. Molecular packing and magnetic properties of lithium naphthalocyanine crystals: hollow channels enabling permeability and paramagnetic sensitivity to molecular oxygen

    PubMed Central

    Pandian, Ramasamy P.; Dolgos, Michelle; Marginean, Camelia; Woodward, Patrick M.; Hammel, P. Chris; Manoharan, Periakaruppan T.; Kuppusamy, Periannan

    2009-01-01

    The synthesis, structural framework, magnetic and oxygen-sensing properties of a lithium naphthalocyanine (LiNc) radical probe are presented. LiNc was synthesized in the form of a microcrystalline powder using a chemical method and characterized by electron paramagnetic resonance (EPR) spectroscopy, magnetic susceptibility, powder X-ray diffraction analysis, and mass spectrometry. X-Ray powder diffraction studies revealed a structural framework that possesses long, hollow channels running parallel to the packing direction. The channels measured approximately 5.0 × 5.4 Å2 in the two-dimensional plane perpendicular to the length of the channel, enabling diffusion of oxygen molecules (2.9 × 3.9 Å2) through the channel. The powdered LiNc exhibited a single, sharp EPR line under anoxic conditions, with a peak-to-peak linewidth of 630 mG at room temperature. The linewidth was sensitive to surrounding molecular oxygen, showing a linear increase in pO2 with an oxygen sensitivity of 31.2 mG per mmHg. The LiNc microcrystals can be further prepared as nano-sized crystals without the loss of its high oxygen-sensing properties. The thermal variation of the magnetic properties of LiNc, such as the EPR linewidth, EPR intensity and magnetic susceptibility revealed the existence of two different temperature regimes of magnetic coupling and hence differing columnar packing, both being one-dimensional antiferromagnetic chains but with differing magnitudes of exchange coupling constants. At a temperature of ∼50 K, LiNc crystals undergo a reversible phase transition. The high degree of oxygen-sensitivity of micro- and nano-sized crystals of LiNc, combined with excellent stability, should enable precise and accurate measurements of oxygen concentration in biological systems using EPR spectroscopy. PMID:19809598

  17. The Effect of Chain Structures on the Crystallization Behavior and Membrane Formation of Poly(Vinylidene Fluoride) Copolymers

    PubMed Central

    Ma, Wenzhong; Yuan, Haoge; Wang, Xiaolin

    2014-01-01

    The crystallization behaviors of two copolymers of PVDF were studied, and the effect of copolymerized chains on the crystallization behavior was investigated. The results indicated that both copolymers had a lowered crystallization temperature and crystallinity. The crystallization rate was improved by the copolymer with symmetrical units in PVDF chains, but hindered by asymmetrical units, compared with the neat PVDF. The symmetrical units in PVDF chains favored the β-crystals with fiber-like structures. According to the solubility parameter rule, methyl salicylate (MS) can be chosen as a diluent for PVDF copolymers. Both diluted systems had liquid-liquid (L-L) regions in the phase diagrams, which was due to the lowered crystallization temperature. PMID:24957175

  18. Electrical conductivity of MgO crystals implanted with lithium ions

    NASA Astrophysics Data System (ADS)

    Tardío, M.; Ramírez, R.; González, R.; Chen, Y.; Alves, E.

    2002-05-01

    MgO single crystals were implanted with a fluence of 1×10 17 Li +/cm 2 with 175 keV. Using ac and dc techniques, the electrical conductivity of these crystals was investigated in the temperature range 296-440 K. The electrical conductivity of the implanted region was 14 orders of magnitude higher than the unimplanted area. Measurements at different temperatures suggest a thermally activated process with an activation energy of about 0.33 eV. In the implanted area, electrical contacts are found to be ohmic whereas contacts are blocking in unimplanted crystals. Removal of thin layers of the implanted region by immersing the crystal in hot phosphoric acid suggests that the enhancement in conductivity in the implanted region is associated with the intrinsic defects created by the implantation, rather than with the Li ions.

  19. A study of the piezoelectric resonance in metal organic NLO single crystals: Sodium D-isoascorbate monohydrate and Lithium L-ascorbate dihydrate

    NASA Astrophysics Data System (ADS)

    Saripalli, Ravi Kiran; Raghavendra Rao, K.; Sanath Kumar, R.; Bhat, H. L.; Elizabeth, Suja

    2016-05-01

    Large single crystals of Sodium D-isoacsorbate monohydrate and Lithium L-ascorbate dehydrate were grown using solution growth technique. Dielectric constant and dielectric loss were monitored as a function of frequency at different temperatures. These are typically characterized by strong resonance peaks. The piezoelectric coefficients d31, elastic coefficient (S11) and electromechanical coupling coefficient (k31) were estimated by resonance-antiresonance method. The temperature dependence of the resonance-peaks frequencies was studied.

  20. A study of the piezoelectric resonance in metal organic NLO single crystals: Sodium D-isoascorbate monohydrate and Lithium L-ascorbate dihydrate

    SciTech Connect

    Saripalli, Ravi Kiran Sanath Kumar, R.; Elizabeth, Suja; Raghavendra Rao, K.; Bhat, H. L.

    2016-05-06

    Large single crystals of Sodium D-isoacsorbate monohydrate and Lithium L-ascorbate dehydrate were grown using solution growth technique. Dielectric constant and dielectric loss were monitored as a function of frequency at different temperatures. These are typically characterized by strong resonance peaks. The piezoelectric coefficients d{sub 31}, elastic coefficient (S{sub 11}) and electromechanical coupling coefficient (k{sub 31}) were estimated by resonance-antiresonance method. The temperature dependence of the resonance-peaks frequencies was studied.

  1. Photorefractive effect in iron-doped lithium niobate crystals induced by femtosecond pulses of 1.5 {mu}m wavelength

    SciTech Connect

    Beyer, O.; Breunig, I.; Kalkum, F.; Buse, K.

    2006-01-30

    Illumination of iron-doped lithium crystals (LiNbO{sub 3}:Fe) with femtosecond pulses of 1.5 {mu}m wavelength results in large refractive index changes {delta}n in the order of 10{sup -3}. The sign of the refractive index changes depends on the polarization of the recording light. The results can be very useful for fabrication of tailored holographic components for telecommunication.

  2. HEATS OF FORMATION OF THE FLUOBORATES OF LITHIUM, SODIUM AND POTASSIUM.

    DTIC Science & Technology

    FLUOBORATES , *THERMOCHEMISTRY, * LITHIUM COMPOUNDS, *SODIUM COMPOUNDS, *POTASSIUM COMPOUNDS, THERMOCHEMISTRY, THERMOCHEMISTRY, THERMOCHEMISTRY, HEAT OF FORMATION, HEAT OF SOLUTION, FLUORIDES, CALORIMETRY, UNITED KINGDOM.

  3. Combining piracetam and lithium salts: ionic co-crystals and co-drugs?

    PubMed

    Braga, Dario; Grepioni, Fabrizia; Maini, Lucia; Capucci, Davide; Nanna, Saverio; Wouters, Johan; Aerts, Luc; Quéré, Luc

    2012-08-25

    Mechanochemical reaction of solid piracetam with the inorganic salts LiCl and LiBr yields ionic co-crystals which are also co-drugs, characterized by markedly different thermal properties with respect to pure components, also depending on the method for preparation and/or conditions of measurements; single crystal and powder X-ray diffraction at variable temperatures, DSC, TGA, hot stage microscopy (HSM) and intrinsic dissolution rate have been used to fully characterize the solid products.

  4. Deformation, Stress Relaxation, and Crystallization of Lithium Silicate Glass Fibers Below the Glass Transition Temperature

    NASA Technical Reports Server (NTRS)

    Ray, Chandra S.; Brow, Richard K.; Kim, Cheol W.; Reis, Signo T.

    2004-01-01

    The deformation and crystallization of Li(sub 2)O (center dot) 2SiO2 and Li(sub 2)O (center dot) 1.6SiO2 glass fibers subjected to a bending stress were measured as a function of time over the temperature range -50 to -150 C below the glass transition temperature (Tg). The glass fibers can be permanently deformed at temperatures about 100 C below T (sub)g, and they crystallize significantly at temperatures close to, but below T,, about 150 C lower than the onset temperature for crystallization for these glasses in the no-stress condition. The crystallization was found to occur only on the surface of the glass fibers with no detectable difference in the extent of crystallization in tensile and compressive stress regions. The relaxation mechanism for fiber deformation can be best described by a stretched exponential (Kohlrausch-Williams-Watt (KWW) approximation), rather than a single exponential model.The activation energy for stress relaxation, Es, for the glass fibers ranges between 175 and 195 kJ/mol, which is considerably smaller than the activation energy for viscous flow, E, (about 400 kJ/mol) near T, for these glasses at normal, stress-free condition. It is suspected that a viscosity relaxation mechanism could be responsible for permanent deformation and crystallization of the glass fibers below T,

  5. Deformation, Stress Relaxation, and Crystallization of Lithium Silicate Glass Fibers Below the Glass Transition Temperature

    NASA Technical Reports Server (NTRS)

    Ray, Chandra S.; Brow, Richard K.; Kim, Cheol W.; Reis, Signo T.

    2004-01-01

    The deformation and crystallization of Li(sub 2)O (center dot) 2SiO2 and Li(sub 2)O (center dot) 1.6SiO2 glass fibers subjected to a bending stress were measured as a function of time over the temperature range -50 to -150 C below the glass transition temperature (Tg). The glass fibers can be permanently deformed at temperatures about 100 C below T (sub)g, and they crystallize significantly at temperatures close to, but below T,, about 150 C lower than the onset temperature for crystallization for these glasses in the no-stress condition. The crystallization was found to occur only on the surface of the glass fibers with no detectable difference in the extent of crystallization in tensile and compressive stress regions. The relaxation mechanism for fiber deformation can be best described by a stretched exponential (Kohlrausch-Williams-Watt (KWW) approximation), rather than a single exponential model.The activation energy for stress relaxation, Es, for the glass fibers ranges between 175 and 195 kJ/mol, which is considerably smaller than the activation energy for viscous flow, E, (about 400 kJ/mol) near T, for these glasses at normal, stress-free condition. It is suspected that a viscosity relaxation mechanism could be responsible for permanent deformation and crystallization of the glass fibers below T,

  6. Crystal Engineering of Naphthalenediimide-Based Metal-Organic Frameworks: Structure-Dependent Lithium Storage.

    PubMed

    Tian, Bingbing; Ning, Guo-Hong; Gao, Qiang; Tan, Li-Min; Tang, Wei; Chen, Zhongxin; Su, Chenliang; Loh, Kian Ping

    2016-11-16

    Metal-organic frameworks (MOFs) possess great structural diversity because of the flexible design of linker groups and metal nodes. The structure-property correlation has been extensively investigated in areas like chiral catalysis, gas storage and absorption, water purification, energy storage, etc. However, the use of MOFs in lithium storage is hampered by stability issues, and how its porosity helps with battery performance is not well understood. Herein, through anion and thermodynamic control, we design a series of naphthalenediimide-based MOFs 1-4 that can be used for cathode materials in lithium-ion batteries (LIBs). Complexation of the N,N'-di(4-pyridyl)-1,4,5,8-naphthalenediimide (DPNDI) ligand and CdX2 (X = NO3(-) or ClO4(-)) produces complexes MOFs 1 and 2 with a one-dimensional (1D) nonporous network and a porous, noninterpenetrated two-dimensional (2D) square-grid structure, respectively. With the DPNDI ligand and Co(NCS)2, a porous 1D MOF 3 as a kinetic product is obtained, while a nonporous, noninterpenetrated 2D square-grid structure MOF 4 as a thermodynamic product is formed. The performance of LIBs is largely affected by the stability and porosity of these MOFs. For instance, the initial charge-discharge curves of MOFs 1 and 2 show a specific capacity of ∼47 mA h g(-1) with a capacity retention ratio of >70% during 50 cycles at 100 mA g(-1), which is much better than that of MOFs 3 and 4. The better performances are assigned to the higher stability of Cd(II) MOFs compared to that of Co(II) MOFs during the electrochemical process, according to X-ray diffraction analysis. In addition, despite having the same Cd(II) node in the framework, MOF 2 exhibits a lithium-ion diffusion coefficient (DLi) larger than that of MOF 1 because of its higher porosity. X-ray photoelectron spectroscopy and Fourier transform infrared analysis indicate that metal nodes in these MOFs remain intact and only the DPNDI ligand undergoes the revisible redox reaction during

  7. Photoreduction of metal nanostructures on periodically proton exchanged MgO-doped lithium niobate crystals

    SciTech Connect

    Balobaid, Laila; Craig Carville, N.; Collins, Liam; Rodriguez, Brian J.; Manzo, Michele; Gallo, Katia

    2013-10-28

    Local reactivity on periodically proton exchanged lithium niobate (PPE:LN) surfaces is a promising route for the fabrication of regularly spaced nanostructures. Here, using MgO-doped PPE:LN templates, we investigate the influence of the doping on the nanostructure formation as a function of the proton exchange (PE) depth. The deposition is found to occur preferentially along the boundary between MgO-doped LN and the PE region when the PE depth is at least 1.73 μm, however, for shallower depths, deposition occurs across the entire PE region. The results are found to be consistent with an increased photoconductivity of the MgO-doped LN.

  8. High-rate lithium storage capability of cupric-cobaltous oxalate induced by unavoidable crystal water and functionalized graphene oxide

    NASA Astrophysics Data System (ADS)

    Feng, Fan; Kang, Wenpei; Yu, Faqi; Zhang, He; Shen, Qiang

    2015-05-01

    The combination of co-precipitation and dehydration is used to prepare hydrated and dehydrated cupric-cobaltous oxalates (Cu1/3Co2/3C2O4·xH2O, x = 1.4; Cu1/3Co2/3C2O4). Then, the hydrothermal treatment of these binary oxalates with freshly prepared graphene oxide (GO) and then dehydration are subsequently adopted to combine the hydrated or dehydrated oxalate with functionalized graphene oxide (FGO), resulting in another two targets of Cu1/3Co2/3C2O4·xH2O/FGO and Cu1/3Co2/3C2O4/FGO composites. These facilitate the comparative studies on the lithium storage capability of cupric oxalate-containing anode materials enhanced by unavoidable crystal water. As a lithium-ion battery anode, Cu1/3Co2/3C2O4·xH2O possesses a reversible capacity of 565.0 mAh g-1 at 1000 mA g-1 over 200 discharge-charge cycles, higher than that of the dehydrated counterpart (246.1 mAh g-1) but lower than those of FGO-based composites (Cu1/3Co2/3C2O4/FGO ∼ 951.2 mAh g-1; Cu1/3Co2/3C2O4·xH2O/FGO ∼ 1134.9 mAh g-1) continuously cycled at the exactly same conditions. At an ultra-high current density of 2000 or 5000 mA g-1, anode Cu1/3Co2/3C2O4·xH2O/FGO delivers a constant discharge capacity of 935.6 mAh g-1 in the 100th cycle or 388.9 mAh g-1 in the 1000th cycle, indicating a jointly positive effect of crystal water and FGO on the high-rate electrochemical performance of cupric-cobaltous oxalate for the first time.

  9. Theoretical exploration of various lithium peroxide crystal structures in a Li-air battery

    DOE PAGES

    Lau, Kah; Qiu, Dantong; Luo, Xiangyi; ...

    2015-01-14

    We describe a series of metastable Li₂O₂ crystal structures involving different orientations and displacements of the O₂²⁻ peroxy ions based on the known Li₂O₂ crystal structure. Within the vicinity of the chemical potential ΔG ~ 0.20 eV/Li from the thermodynamic ground state of the Li₂O₂ crystal structure (i.e., Föppl structure), all of these newly found metastable Li₂O₂ crystal structures are found to be insulating and high-k materials, and they have a common unique signature of an O₂²⁻ O-O vibration mode (ω ~ 799–865 cm⁻¹), which is in the range of that commonly observed in Li-air battery experiments, regardless of themore » random O₂²⁻ orientations and the symmetry in the crystal lattice. From XRD patterns analysis, the commercially available Li₂O₂ powder is confirmed to be the thermodynamic ground state Föppl-like structure. However, for Li₂O₂ compounds that are grown electrochemically under the environment of Li-O₂ cells, we found that the XRD patterns alone are not sufficient for structural identification of these metastable Li₂O₂ crystalline phases due to the poor crystallinity of the sample. In addition, the commonly known Raman signal of O₂²⁻ vibration mode is also found to be insufficient to validate the possible existence of these newly predicted Li₂O₂ crystal structures, as all of them similarly share the similar O₂²⁻ vibration mode. However considering that the discharge voltage in most Li-O₂ cells are typically several tenths of an eV below the thermodynamic equilibrium for the formation of ground state Föppl structure, the formation of these metastable Li₂O₂ crystal structures appears to be thermodynamically feasible.« less

  10. Theoretical exploration of various lithium peroxide crystal structures in a Li-air battery

    SciTech Connect

    Lau, Kah; Qiu, Dantong; Luo, Xiangyi; Greeley, Jeffrey; Curtiss, Larry; Lu, Jun; Amine, Khalil

    2015-01-14

    We describe a series of metastable Li₂O₂ crystal structures involving different orientations and displacements of the O₂²⁻ peroxy ions based on the known Li₂O₂ crystal structure. Within the vicinity of the chemical potential ΔG ~ 0.20 eV/Li from the thermodynamic ground state of the Li₂O₂ crystal structure (i.e., Föppl structure), all of these newly found metastable Li₂O₂ crystal structures are found to be insulating and high-k materials, and they have a common unique signature of an O₂²⁻ O-O vibration mode (ω ~ 799–865 cm⁻¹), which is in the range of that commonly observed in Li-air battery experiments, regardless of the random O₂²⁻ orientations and the symmetry in the crystal lattice. From XRD patterns analysis, the commercially available Li₂O₂ powder is confirmed to be the thermodynamic ground state Föppl-like structure. However, for Li₂O₂ compounds that are grown electrochemically under the environment of Li-O₂ cells, we found that the XRD patterns alone are not sufficient for structural identification of these metastable Li₂O₂ crystalline phases due to the poor crystallinity of the sample. In addition, the commonly known Raman signal of O₂²⁻ vibration mode is also found to be insufficient to validate the possible existence of these newly predicted Li₂O₂ crystal structures, as all of them similarly share the similar O₂²⁻ vibration mode. However considering that the discharge voltage in most Li-O₂ cells are typically several tenths of an eV below the thermodynamic equilibrium for the formation of ground state Föppl structure, the formation of these metastable Li₂O₂ crystal structures appears to be thermodynamically feasible.

  11. Structure, ion transport, and relaxation dynamics of polyethylene oxide/poly (vinylidene fluoride co-hexafluoropropylene)—lithium bis(trifluoromethane sulfonyl) imide blend polymer electrolyte embedded with ionic liquid

    NASA Astrophysics Data System (ADS)

    Das, S.; Ghosh, A.

    2016-03-01

    We have studied structure, ion transport, and relaxation dynamics in polyethylene oxide/poly (vinylidene fluoride-hexafluoropropylene)-lithium bis(trifluoromethane)sulfonimide blend polymer electrolytes embedded with 1-propyl-3-methyleimidazoliuum bis(trifluromethyle-sulfonyl)imide ionic liquid. Structural property and ion-polymer interaction of polymer electrolytes have been studied using X-ray diffraction and Raman spectroscopy. The addition of ionic liquid decreases glass transition temperature and reduces crystalline phase in the polymer matrix. It is also observed that surface becomes smooth with increase of ionic liquid content. The temperature dependence of the Li ion conductivity follows Vogel-Tammann-Fulcher type behaviour when a sufficient amount of ionic liquid is added to polymer matrix. The electric modulus has been studied using Havriliak-Negami function for the understanding of ion dynamics. The modulus data have been analyzed using non-exponential Kohlrausch-Williams-Watts function. It is observed that the non-exponential parameter β is quite lower than unity, suggesting existence of a non-exponential relaxation. The temperature dependence of the relaxation time also follows Vogel-Tammann-Fulcher relation for compositions with higher ionic liquid content.

  12. Alkaline-alkaline earth fluoride carbonate crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as nonlinear optical materials.

    PubMed

    Zou, Guohong; Ye, Ning; Huang, Ling; Lin, Xinsong

    2011-12-14

    A new series of alkaline-alkaline earth fluoride carbonates (KSrCO(3)F, RbSrCO(3)F, KCaCO(3)F, RbCaCO(3)F, CsCaCO(3)F, and Cs(3)Ba(4)(CO(3))(3)F(5)) were synthesized by spontaneous crystallization with molten fluxes. Their crystal structures, except for Cs(3)Ba(4)(CO(3))(3)F(5), exhibit the stacking of [AF](∞) (A = K, Rb, Cs) and [B(CO(3))](∞) (B = Ca, Sr) layers, and the coplanar alignment of [CO(3)] triangles. The results from the UV-vis diffuse reflectance spectroscopy study of the powder samples indicated that the short-wavelength absorption edges were all below 200 nm, except for Cs(3)Ba(4)(CO(3))(3)F(5), which is about 210 nm. Second-harmonic generation (SHG) on polycrystalline samples was measured using the Kurtz and Perry technique, which indicated that these carbonates are all phase-matchable materials in both visible and the UV region, and their measured SHG coefficients were about 3.33, 3.33, 3.61, 1.11, 1.11, and 1.20 times as large as that of d(36) (KDP), respectively. © 2011 American Chemical Society

  13. Crystallization kinetics and optical properties of titanium-lithium tetraborate glass containing europium oxide

    NASA Astrophysics Data System (ADS)

    Mohamed, E. A.; Ratep, A.; Abdel-Khalek, E. K.; Kashif, I.

    2017-07-01

    The crystallization kinetics and optical properties of [60 Li2B4O7-30 TiO2-10 Eu2O3] (mol%) glass sample have been investigated. The present glass sample exhibits three crystallization exothermic peaks ( T p1, T p2, and T p3) corresponding to the formation of LiBO2, Li2B4O7, and EuTiO3 phases, respectively. The presence of phase separation in the glass sample has been confirmed by scanning electron microscopic (SEM). The mean values of Avrami exponent ( n = 3.1 and 4) around T p1 and T p2, indicate that the bulk crystallization with a constant number of nuclei and with an increasing number of nuclei, respectively. The values of the local activation energy as a function of the fraction of crystallization (0.1 ≤ χ ≤ 0.9) decrease for the crystallization of LiBO2 and EuTiO3 and increase for the crystallization of Li2B4O7. The values of n( χ) for T p3 and T p2 in the range (0.1 ≤ χ ≤ 0.9) and (0.1 ≤ χ ≤ 0.4), respectively, are larger than 4 indicate that the presence of anomalous in Avrami exponent. The trend of Judd-Ofelt intensity parameters (Ω2 > Ω4 > Ω6) and the bonding parameter ( δ) indicate that the lower symmetry and the highest covalent nature of the bonding around Eu3+ ions.

  14. Water fluoridation and osteoporotic fracture.

    PubMed

    Hillier, S; Inskip, H; Coggon, D; Cooper, C

    1996-09-01

    Osteoporotic fractures constitute a major public health problem. These fractures typically occur at the hip, spine and distal forearm. Their pathogenesis is heterogeneous, with contributions from both bone strength and trauma. Water fluoridation has been widely proposed for its dental health benefits, but concerns have been raised about the balance of skeletal risks and benefits of this measure. Fluoride has potent effects on bone cell function, bone structure and bone strength. These effects are mediated by the incorporation of fluoride ions in bone crystals to form fluoroapatite, and through an increase in osteoblast activity. It is believed that a minimum serum fluoride level of 100 ng/ml must be achieved before osteoblasts will be stimulated. Serum levels associated with drinking water fluoridated to 1 ppm are usually several times lower than this value, but may reach this threshold at concentrations of 4 ppm in the drinking water. Animal studies suggest no effect of low-level (0-3 ppm) fluoride intake on bone strength, but a possible decrease at higher levels. Sodium fluoride has been used to treat established osteoporosis for nearly 30 years. Recent trials of this agent, prescribed at high doses, have suggested that despite a marked increase in bone mineral density, there is no concomitant reduction in vertebral fracture incidence. Furthermore, the increase in bone density at the lumbar spine may be achieved at the expense of bone mineral in the peripheral cortical skeleton. As a consequence, high dose sodium fluoride (80 mg daily) is not currently used to treat osteoporosis. At lower doses, recent trials have suggested a beneficial effect on both bone density and fracture. The majority of epidemiological evidence regarding the effect of fluoridated drinking water on hip fracture incidence is based on ecological comparisons. Although one Finnish study suggested that hip fracture rates in a town with fluoridated water were lower than those in a matching town

  15. Rock-salt-type crystal of thermally contracted C60 with encapsulated lithium cation.

    PubMed

    Aoyagi, Shinobu; Sado, Yuki; Nishibori, Eiji; Sawa, Hiroshi; Okada, Hiroshi; Tobita, Hiromi; Kasama, Yasuhiko; Kitaura, Ryo; Shinohara, Hisanori

    2012-04-02

    Rock solid: fullerene-encapsulated Li(+) (Li(+)@C(60)) is an alkaline cation owing to the spherical shape and positive charge. Li(+)@C(60) crystallizes as a rock-salt-type crystal in the presence of PF(6)(-). The orientations of C(60) and PF(6)(-) (orange) are perfectly ordered below 370 K, and Li(+) (purple) hops within the cage. At temperatures below 100 K two Li(+) units are localized at two polar positions within each C(60) . Copyright © 2012 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  16. Crystal field disorder effects in the optical spectra of Nd{sup 3+} and Yb{sup 3+}-doped calcium lithium niobium gallium garnets laser crystals and ceramics

    SciTech Connect

    Lupei, V.; Lupei, A.; Gheorghe, C.; Gheorghe, L.; Achim, A.; Ikesue, A.

    2012-09-15

    The optical spectroscopic properties of RE{sup 3+} (Nd, 1 at. % or Yb, 1 to 10 at. %)-doped calcium-lithium-niobium-gallium garnet (CLNGG) single crystals and ceramics in the 10 K-300 K range are analyzed. In these compositionally disordered materials, RE{sup 3+} substitute Ca{sup 2+} in dodecahedral sites and the charge compensation is accomplished by adjusting the proportion of Li{sup +}, Nb{sup 5+}, and Ga{sup 3+} to the doping concentration. The crystals and ceramics show similar optical spectra, with broad and structured (especially at low temperatures) bands whose shape depends on temperature and doping concentration. At 10 K, the Nd{sup 3+4}I{sub 9/2}{yields}{sup 4}F{sub 3/2,5/2} and Yb{sup 3+2}F{sub 7/2}{yields}{sup 2}F{sub 5/2} absorption bands, which show prospect for diode laser pumping, can be decomposed in several lines that can be attributed to centers with large differences in the crystal field. The positions of these components are the same, but the relative intensity depends on the doping concentration and two main centers dominate the spectra. Non-selective excitation evidences broad emission bands, of prospect for short-pulse laser emission, whereas the selective excitation reveals the particular emission spectra of the various centers. The modeling reveals that the nonequivalent centers correspond to RE{sup 3+} ions with different cationic combinations in the nearest octahedral and tetrahedral coordination spheres, and the most abundant two centers have 4Nb and, respectively, 3Nb1Li in the nearest octahedral sphere. At 300 K, the spectral resolution is lost. It is then inferred that the observed optical bands are envelopes of the spectra of various structural centers, whose resolution is determined by the relative contribution of the temperature-dependent homogeneous broadening and the effects of crystal field disordering (multicenter structure, inhomogeneous broadening). The relevance of spectroscopic properties for selection of pumping

  17. Functionalization of borate networks by the incorporation of fluoride: Syntheses, crystal structures; and nonlinear optical properties of novel actinide fluoroborates

    SciTech Connect

    Wang, Shuao; Alekseev, Evgeny V.; Diwu, Juan; Miller, Hannah M.; Oliver, Allen G.; Liu, Guokui; Depmeier, Wulf; Albrecht-Schmitt, Thomas E.

    2011-06-14

    The boric acid flux reactions of uranyl nitrate with sodium, potassium, rubidium, or thallium fluoride result in the formation of a novel family of uranyl(VI) fluoroborate materials. These compounds are Na[(UO₂)B₅O₈(OH)F]·H₂O (NaUBOF-1), K[(UO₂)B₅O₈(OH)F] (KUBOF-1), K₁₁[(UO₂)₆B₂₄O₃₆F₂₂)](H₂BO₃) (KUBOF-2), Rb[(UO₂)B₅O₈(OH)F] (RbUBOF-1), and Tl[(UO₂)B₅O₈(OH)F] (TlUBOF-1). A new neptunium(VI) fluoroborate that is isotypic with NaUBOF-1, Na[(NpO₂)B₅O₈(OH)F]·H₂O (NaNpBOF-1), was synthesized via the boric acid flux reaction of neptunium(VI) nitrate with sodium fluoride. These new actinide fluoroborates share a common structural motif consisting of a linear actinyl (U(Np)O₂2+) cation surrounded by BO₃ triangles and BO₄ tetrahedra to create an U(Np)O₈ hexagonal bipyramidal environment around uranium or neptunium. The borate anions bridge between actinyl units to create layers. B–F bonds were formed during the reactions to yield BO₃F tetrahedral units. The BO3F tetrahedra and additional BO₃ triangles extend from the actinyl polyborate layers and are directed approximately perpendicular to the layers. A novel actinyl borate layered topology was found in K₁₁[(UO₂)₆B₂₄O₃₆F₂₂)](H₂BO₃) (KUBOF-2). Except for K[(UO₂)B₅O₈(OH)F] (KUBOF-1) and K₁₁[(UO₂)₆B₂₄O₃₆F₂₂)](H₂BO₃) (KUBOF-2), all of the other actinide fluoroborate phases adopt noncentrosymmetric space groups. Tl[(UO₂)B₅O₈(OH)F] (TlUBOF-1), which can be obtained as a pure phase, displays second-harmonic generation of 532-nm light from 1064-nm light.

  18. Piezoelectric and ferroelectric properties of lead-free niobium-rich potassium lithium tantalate niobate single crystals

    SciTech Connect

    Li, Jun; Li, Yang; Zhou, Zhongxiang; Guo, Ruyan; Bhalla, Amar S.

    2014-01-01

    Graphical abstract: - Highlights: • Lead-free K{sub 0.95}Li{sub 0.05}Ta{sub 1−x}Nb{sub x}O{sub 3} single crystals were grown using the top-seeded melt growth method. • The piezoelectric and ferroelectric properties of as-grown crystals were systematically investigated. • The piezoelectric properties are very attractive, e.g. for x = 0.60 composition, k{sub t} ≈ 70%, k{sub 31} ≈ 70%, k{sub 33} ≈ 77%, d{sub 31} ≈ 230 pC/N, d{sub 33} ≈ 600 pC/N. • The coercive fields of P–E hysteresis loops are quite small, about or less than 1 kV/mm. - Abstract: Lead-free potassium lithium tantalate niobate single crystals with the composition of K{sub 0.95}Li{sub 0.05}Ta{sub 1−x}Nb{sub x}O{sub 3} (abbreviated as KLTN, x = 0.51, 0.60, 0.69, 0.78) were grown using the top-seeded melt growth method. Their piezoelectric and ferroelectric properties in as-grown crystals have been systematically investigated. The phase transitions and Curie temperatures were determined from dielectric and pyroelectric measurements. Piezoelectric coefficients and electromechanical coupling factors in thickness mode, length-extensional mode and longitudinal mode were obtained. The piezoelectric properties are very attractive, e.g. for x = 0.60 composition, k{sub t} ≈ 70%, k{sub 31} ≈ 70%, k{sub 33} ≈ 77%, d{sub 31} ≈ 230 pC/N, d{sub 33} ≈ 600 pC/N are comparable to the lead-based PZT composition. The polarization versus electric field hysteresis loops show saturated shapes. In short, lead-free niobium-rich KLTN system possesses comparable properties to those in important lead-based piezoelectric material nowadays.

  19. MAS-NMR investigations of the crystallization behaviour of lithium aluminum silicate (LAS) glasses containing P 2O 5 and TiO 2 nucleants

    NASA Astrophysics Data System (ADS)

    Ananthanarayanan, A.; Kothiyal, G. P.; Montagne, L.; Revel, B.

    2010-06-01

    Lithium aluminum silicate (LAS) glass of composition (mol%) 20.4Li 2O-4.0Al 2O 3-68.6SiO 2-3.0K 2O-2.6B 2O 3-0.5P 2O 5-0.9TiO 2 was prepared by melt quenching. The glass was then nucleated and crystallized based on differential thermal analysis (DTA) data and was characterized by 29Si, 31P, 11B and 27Al MAS-NMR. XRD and 29Si NMR showed that lithium metasilicate (Li 2SiO 3) is the first phase to c form followed by cristobalite (SiO 2) and lithium disilicate (Li 2Si 2O 5). 29Si MAS-NMR revealed a change in the network structure already for the glasses nucleated at 550 °C. Since crystalline Li 3PO 4, as observed by 31P MAS-NMR, forms concurrently with the silicate phases, we conclude that crystalline Li 3PO 4 does not act as a nucleating agent for lithium silicate phases. Moreover, 31P NMR indicates the formation of M-PO 4 ( M=B, Al or Ti) complexes. The presence of BO 3 and BO 4 structural units in all the glass/glass-ceramic samples is revealed through 11B MAS-NMR. B remains in the residual glass and the crystallization of silicate phases causes a reduction in the number of alkali ions available for charge compensation. As a result, the number of trigonally coordinated B (BO 3) increases at the expense of tetrahedrally coordinated B (BO 4). The 27Al MAS-NMR spectra indicate the presence of tetrahedrally coordinated Al species, which are only slightly perturbed by the crystallization.

  20. Characterization of Point Defects in Lithium Aluminate (LiAlO2) Single Crystals

    DTIC Science & Technology

    2015-09-17

    in this document are for identification purposes only. All trademarks are property of their respective owners. Use of these trademarks does not imply...are imperfections in a crystal lattice localized over a few atomic lengths that can alter the electrical, mechanical, or optical properties of materials...5 1.2 Research Objectives . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 7 1.3 Properties of LiAlO2

  1. Lithium-bearing fluor-arfvedsonite from Hurricane Mountain, New Hampshire: A crystal-chemical study

    USGS Publications Warehouse

    Hawthorne, F.C.; Oberti, R.; Ottolini, L.; Foord, E.E.

    1996-01-01

    The structures of two crystals of Li-bearing fluor-arfvedsonite (1) (K0.32Na0.68)Na2(Li0.48Fe 2+2.83Mn2+0.10Zn 0.06Fe3+1.46Ti0.07) (Si7.88Al0.12)O22[Fu1.15(OH) 0.85] and (2) (K0.25Na0.75)Na2(Li0.48Fe 2+2.84Mn2+0.11Zn 0.05Fe3+1.45Ti0.07)(Si 7.89Al0.11)O22[F1.35(OH) 0.65] from a granitic pegmatite, Hurricane Mountain, New Hampshire, have been refined to R indices of 1.5(1.6)% based on 1380(1387) reflections measured with MoK?? X-radiation. The unit cell parameters are (1) a 9.838(4), b 17.991(6), c 5.315(2) A??, 103.78(3)??, V 913.7 A??3 and (2) a 9.832(3), b 17.990(7), c 5.316(3) A??, ?? 103.79(3)??, V 913.2 A??3. Site-scattering refinement shows Li to be completely ordered at the M(3) site in these crystals. The amphibole composition is intermediate between fluor-arfvedsonite and fluor-ferro-leakeite with a small component (???10%) of fluor-ferro-ferri-nybo??ite. These amphibole crystals project into miarolitic cavities in a pegmatitic phase of a riebeckite granite. The early-crystallizing amphibole is close to fluor-ferro-leakeite in composition, but becomes progressively depleted in Li and F as crystals project out into miarolitic cavities; the final amphibole to crystallize is a fibrous Li-poor riebeckite. Li plays a significant role in late-stage fractionation involving the crystallization of alkali amphibole in peralkaline granitic environments.

  2. Hot-Chemistry Structural Phase Transformation in Single-Crystal Chalcogenides for Long-Life Lithium Ion Batteries.

    PubMed

    Hassan, Fathy M; Hu, Qianqian; Fu, Jing; Batmaz, Rasim; Li, Jingde; Yu, Aiping; Xiao, Xingcheng; Chen, Zhongwei

    2017-06-21

    Tuned chalcogenide single crystals rooted in sulfur-doped graphene were prepared by high-temperature solution chemistry. We present a facile route to synthesize a rod-on-sheet-like nanohybrid as an active anode material and demonstrate its superior performance in lithium ion batteries (LIBs). This nanohybrid contains a nanoassembly of one-dimensional (1D) single-crystalline, orthorhombic SnS onto two-dimensional (2D) sulfur-doped graphene. The 1D nanoscaled SnS with the rodlike single-crystalline structure possesses improved transport properties compared to its 2D hexagonal platelike SnS2. Furthermore, we blend this hybrid chalcogenide with biodegradable polymer composite using water as a solvent. Upon drying, the electrodes were subjected to heating in vacuum at 150 °C to induce polymer condensation via formation of carboxylate groups to produce a mechanically robust anode. The LIB using the as-developed anode material can deliver a high volumetric capacity of ∼2350 mA h cm(-3) and exhibit superior cycle stability over 1500 cycles as well as a high capacity retention of 85% at a 1 C rate. The excellent battery performance combined with the simplistic, scalable, and green chemistry approach renders this anode material as a very promising candidate for LIB applications.

  3. The electronic stopping powers and angular energy-loss dependence of helium and lithium ions in the silicon crystal

    NASA Astrophysics Data System (ADS)

    Mikšová, R.; Macková, A.; Malinský, P.

    2017-09-01

    We have measured the electronic stopping powers of helium and lithium ions in the channelling direction of the Si〈1 0 0〉 crystal. The energy range used (2.0-8.0 MeV) was changed by 200 and 400-keV steps. The ratio α between the channelling and random stopping powers was determined as a function of the angle for 2, 3 and 4 MeV 4He+ ions and for 3 and 6 MeV 7Li+,2+ ions. The measurements were carried out using the Rutherford backscattering spectrometry in the channelling mode (RBS-C) in a silicon-on-insulator material. The experimental channelling stopping-power values measured in the channelling direction were then discussed in the frame of the random energy stopping predictions calculated using SRIM-2013 code and the theoretical unitary convolution approximation (UCA) model. The experimental channelling stopping-power values decrease with increasing ion energy. The stopping-power difference between channelled and randomly moving ions increases with the enhanced initial ion energy. The ratio between the channelling and random ion stopping powers α as a function of the ion beam incoming angle for 2, 3 and 4 MeV He+ ions and for 3 and 6 MeV Li+,2+ ions was observed in the range 0.5-1.

  4. Photoselective Vaporesection of the Prostate with an End-firing Lithium Triborate Crystal Laser

    PubMed Central

    Wang, Xin; Liu, Ming; Zhang, Yao-Guang; Zhu, Sheng-Cai; Wan, Ben; Wang, Jian-Ye

    2017-01-01

    Background: Photoselective vaporization of the prostate is a technique that is widely used for the treatment of benign prostatic hyperplasia (BPH) and has pronounced advantages compared to the traditional transurethral resection of the prostate. Following the recent introduction of end-firing lithium triborate lasers, we have created a new technique called photoselective vaporesection of the prostate (PVRP). This study described our initial experience using the PVRP technique for the treatment of BPH. Methods: This prospective study included a total of 35 patients with BPH who underwent PVRP from August 2013 to July 2014. The chief clinical parameters were obtained and evaluated during the perioperative period and follow-up, including the International Prostate Symptom Score (IPSS), quality of life (QoL) score, maximum urinary flow rate, and prostate volume. All variables were evaluated for statistically significant differences compared to baseline values using the analysis of variance. Results: The mean subgroup IPSS and QoL scores significantly improved during follow-up; the respective decreases in IPSS storage score, IPSS voiding score, IPSS nocturia score, and QoL score were 75.3%, 83.6%, 51.4%, and 71.7%, respectively (all P < 0.001 compared with baseline). Three patients were diagnosed with prostate cancer based on postoperative pathological examinations. There were no serious perioperative complications. Conclusion: The PVRP technique demonstrates satisfactory short-term clinical outcomes and perioperative safety in the treatment of BPH. PMID:28303843

  5. Controlled parallel crystallization of lithium disilicate and diopside using a combination of internal and surface nucleation

    NASA Astrophysics Data System (ADS)

    Rampf, Markus; Dittmer, Marc; Ritzberger, Christian; Höland, Wolfram

    2016-10-01

    In the mid-19th century, Dr. Donald Stookey identified the importance and usability of nucleating agents and mechanisms for the development of glass-ceramic materials. Today, a number of various internal and surface mechanisms as well as combinations thereof have been established in the production of glass-ceramic materials. In order to create new innovative material properties the present study focuses on the precipitation of CaMgSiO6 as a minor phase in Li2Si2O5 based glass-ceramics. In the base glass of the SiO2-Li2O-P2O5-Al2O3-K2O-MgO-CaO system P2O5 serves as nucleating agent for the internal precipitation of Li2Si2O5 crystals while a mechanical activation of the glass surface by means of ball milling is necessary to nucleate the minor CaMgSi2O6 crystal phase. For a successful precipitation of CaMgSi2O6 a minimum ratio of MgO and CaO in the range between 1.4 mol% and 2.9 mol% in the base glasses was determined. The nucleation and crystallization of both crystal phases takes place during sintering a powder compact. Dependent on the quality of the sintering process the dense Li2Si2O5-CaMgSi2O6 glass-ceramics show a mean biaxial strength of up to 392 ± 98 MPa. The microstructure of the glass-ceramics is formed by large (5-10 µm) bar like CaMgSi2O6 crystals randomly embedded in a matrix of small (≤ 0.5 µm) plate like Li2Si2O5 crystals arranged in an interlocking manner. While there is no significant influence of the minor CaMgSi2O6 phase on the strength of the material, the translucency of the material decreases upon precipitation of the minor phase.

  6. Optical investigation of femtosecond laser induced microstress in neodymium doped lithium niobate crystals

    SciTech Connect

    Rodenas, A.; Sanz Garcia, J. A.; Jaque, D.; Torchia, G. A.; Mendez, C.; Arias, I.; Roso, L.; Agullo-Rueda, F.

    2006-08-01

    The depth-resolved micromodification of single-crystalline femtosecond laser irradiated Nd{sup 3+} doped MgO:LiNbO{sub 3} crystals is investigated by means of micro-Raman and microluminescence experiments. We have found that a permanent tensile stress of the order of 2 GPa is induced in the vicinity of ablated volume as a consequence of the pressure-wave propagation due to the thermoelastic relaxation of the laser irradiated material. Microluminescence experiments have revealed that, as a consequence of the permanent laser induced microstress, a localized redshift of the {sup 4}F{sub 3/2}{yields}{sup 4}I{sub 9/2} luminescence band of Nd{sup 3+} ions also takes place due to a crystal field modification. The analysis of Raman and fluorescence bandwidths indicates that a slight lattice disorder and densification is induced by femtosecond laser irradiation.

  7. Nucleation and Crystallization as Induced by Bending Stress in Lithium Silicate Glass Fibers

    NASA Technical Reports Server (NTRS)

    Reis, Signo T.; Kim, Cheol W.; Brow, Richard K.; Ray, Chandra S.

    2003-01-01

    Glass Fibers of Li2O.2SiO2 (LS2) and Li2O.1.6SiO2 (LS1.6) compositions were heated near, but below, the glass transition temperature for different times while subjected to a constant bending stress of about 1.2 GPa. The nucleation density and the crystallization tendency estimated by differential thermal analysis (DTA) of a glass sample in the vicinity of the maximum of the bending stress increased relative to that of stress-free glass fibers. LS2 glass fibers were found more resistant to nucleation and crystallization than the Ls1.6 glass fibers. These results are discussed in regards to shear thinning effects on glass stability.

  8. Nucleation and Crystallization as Induced by Bending Stress in Lithium Silicate Glass Fibers

    NASA Technical Reports Server (NTRS)

    Reis, Signo T.; Kim, Cheol W.; Brow, Richard K.; Ray, Chandra S.

    2003-01-01

    Glass Fibers of Li2O.2SiO2 (LS2) and Li2O.1.6SiO2 (LS1.6) compositions were heated near, but below, the glass transition temperature for different times while subjected to a constant bending stress of about 1.2 GPa. The nucleation density and the crystallization tendency estimated by differential thermal analysis (DTA) of a glass sample in the vicinity of the maximum of the bending stress increased relative to that of stress-free glass fibers. LS2 glass fibers were found more resistant to nucleation and crystallization than the Ls1.6 glass fibers. These results are discussed in regards to shear thinning effects on glass stability.

  9. Other Fluoride Products

    MedlinePlus

    ... What's this? Submit What's this? Submit Button Other Fluoride Products Recommend on Facebook Tweet Share Compartir On ... August 17, 2001;50(RR-14):1–42. Fluoride Products Fluoride Toothpaste Form Concentrations of fluoride in ...

  10. Growth of hollow nickel fluoride whiskers

    SciTech Connect

    Petrov, S. V.; Orekhov, Yu. F.; Fedorov, P. P.

    2009-07-15

    Hollow nickel fluoride whiskers have been obtained by condensation from the vapor phase onto a platinum substrate in a flow of hydrogen fluoride. Crystals up to 5 mm in length have a square cross section with a 300 {+-} 30-{mu}m side. The wall thickness is 85 {+-} 20 {mu}m.

  11. EPR and ENDOR Studies of Point Defects in Lithium Tetraborate Crystals

    DTIC Science & Technology

    2012-12-14

    absorption. This principle is the basis of solid state detectors . Second, many scintillators emit photons when the crystal is excited by energy...applied to dosimetry and scintillation detectors [6-7] and also has potential uses in the fields of acousto-electronics, and optics [6, 8-10]. LTB... detector diode. The detector diode is a semiconductor junction that 21 creates current proportional to the incident microwave power and

  12. Electro-optic properties of indium/erbium-codoped lithium niobate crystal for integrated optics

    NASA Astrophysics Data System (ADS)

    Du, Wan-Ying; Zhang, Zi-Bo; Ren, Shuai; Wong, Wing-Han; Yu, Dao-Yin; Pun, Edwin Yue-Bun; Zhang, De-Long

    2017-02-01

    Clamped and unclamped electro-optic coefficients γ13 and γ33 of In3+/Er3+-codoped LiNbO3 crystals, which were grown by Czochralski method from the melts containing 0.5 mol% Er2O3 while varied In2O3 contents of 0.0, 0.5, 1.0 and 1.5 mol%, were measured by Mach-Zehnder interferometry. The results show that In3+/Er3+ codoping does not cause change of γ13 and γ33, and both γ13 and γ33 can be regarded as unchanged in the studied In3+ concentration range of 0-2.6 mol% (in crystal) within the experimental error of 3%. The small doping effect is desired in light of the electro-optic application of the crystal. A qualitative, comprehensible explanation for the small effect is given on the basis of the EO coefficient model of LiNbO3 and doping effect on the defect structure of LiNbO3.

  13. Study of structural and ferromagnetic resonance properties of spinel lithium ferrite (LiFe{sub 5}O{sub 8}) single crystals

    SciTech Connect

    Pachauri, Neha; Khodadadi, Behrouz; Mewes, Tim; Althammer, Matthias; Singh, Amit V.; Gupta, Arunava; Loukya, B.; Datta, Ranjan; Iliev, Milko; Bezmaternykh, Leonard; Gudim, Irina

    2015-06-21

    The effect of B-site cation ordering on the room temperature structural and ferromagnetic resonance (FMR) properties of single crystal spinel lithium ferrite (LiFe{sub 5}O{sub 8}, LFO) have been investigated. A detailed microstructural analysis is done through X-ray diffraction, polarized Raman spectroscopy, and transmission electron microscopy (TEM) to examine the effect of post-annealing on the B-site cation ordering. The X-ray diffraction pattern of the as-grown crystal indicates a disordered state of the crystal. However, the annealed sample shows additional superlattice reflections corresponding to the ordered phase. This ordering is further confirmed by Raman spectra and TEM images, which reveal ordering of Li and Fe ions at the octahedral sites contrasting with the relatively high degree of octahedral site disorder in the as-grown crystal. To study the effect of B-site ordering on the magnetic properties and FMR linewidth, vibrating sample magnetometry and broadband FMR measurements have been performed for both the ordered and disordered phases of lithium ferrite. The value of saturation magnetization for both phases is ∼290 emu/cm{sup 3}. A single mode FMR profile is observed for both phases with little distortion. The linewidth characteristics of the ordered and disordered phases of lithium ferrite phases are compared, and it is observed that the linewidth is independent of the cation ordering. Both the phases exhibit a low linewidth (∼26 Oe at 30 GHz) and the effective damping parameter for the as-grown and annealed samples is determined to be 0.0021 ± 0.0001.

  14. Preparation and stress evolution of sol–gel SiO{sub 2} antireflective coatings for small-size anisotropic lithium triborate crystals

    SciTech Connect

    Tian, Bingtao; Wang, Xiaodong Niu, Yanyan; Zhang, Zhihua; Wu, Guangming; Zhou, Bin; Shen, Jun; Zhang, Jinlong; Zhang, Qinghua

    2016-04-15

    Lithium triborate (LiB{sub 3}O{sub 5}, LBO) crystal is now one of the most useful nonlinear optical materials for frequency conversion of high power lasers. The use of the crystal, however, has been hampered by the unavailability of antireflective (AR) coatings with high laser damage resistance. In this work, a “point contact” dip-coating method is developed to prepare sol–gel SiO{sub 2} AR coatings on small-size LBO crystals. Using this approach, we obtain a homogenous coating surface on an 8 mm×8 mm×3 mm LBO crystal. The stress measurements show that the stresses in sol–gel SiO{sub 2} coatings vary with the time of natural drying, which is beyond our expectation. The anisotropic Young’s modulus of the LBO crystal and the different evolution tendency of the stress in the different SiO{sub 2} coating layers are found to be responsible for the crack of the double-layer AR coatings on anisotropic LBO crystal. Meanwhile, the resulting coatings on LBO crystal achieve a LIDT of over 15 J/cm{sup 2} (532 nm, 3ns) and the coated LBO is expected to have a transmittance of over 99% at 800 nm.

  15. Effect of VO2+ ions on the EPR and optical absorption investigations of lithium sulphate monohydrate single crystals for non linear optical applications

    NASA Astrophysics Data System (ADS)

    Juliet sheela, K.; Radha Krishnan, S.; Shanmugam, V. M.; Subramanian, P.

    2017-09-01

    Electron paramagnetic resonance (EPR) and optical absorption studies of VO2+ ions in Lithium Sulphate Monohydrate (LSMH) single crystal are carried out at room temperature. Single crystal rotations in each of the three mutually orthogonal crystalline planes, ac, ab, cb indicate three different vanadyl complexes. Three VO2+ ions of EPR spectra indicate among them, that two of them have (the intense two) entered the lattice substitutionally and the third one occupies the interstitial position. From the angular variation, the spin Hamiltonian parameters are evaluated. From the optical absorption spectrum containing four selected bands and EPR data, various bonding parameters are determined and the nature of bonding in the crystal is discussed. Also Second Harmonic Generation (SHG) studies are carried out to confirm the Non Linear Optical (NLO) properties of the given material.

  16. On the strain-induced structural evolution upon uniaxial stretching of Poly(VinyliDene Fluoride): influence of secondary crystals and crystalline relaxation

    NASA Astrophysics Data System (ADS)

    Defebvin, Juliette; Barrau, Sophie; Stoclet, Grégory; Lefebvre, Jean-Marc; Polymer Engineering Science Team

    2015-03-01

    Development of more efficient piezoelectric devices tends to innovate and create materials able to combine flexibility and electro-mechanical conversion. Poly(vinylidene fluoride) (PVDF) is a semi-crystalline polymer that exhibits interesting piezoelectric properties. Besides PVDF is able to convert a mechanical solicitation into an electric energy and vice versa. However these physical properties are highly dependent on the polymer crystal structure. PVDF presents at least two main crystalline forms. The most common phase is the α-phase that is non-polar. On the other hand, the β phase is the most polar one and it can be obtained by a stretching of the α-phase. Knowing the influence of the drawing conditions on the strain-induced structural evolution is thus of prime interest. To assess this point the strain-induced structural evolution of PVDF, stretched under different conditions, has been followed in-situ by means of WAXS/SAXS experiments. As a main result, this study shows that drawing conditions strongly affect both the α to β phase conversion degree and the crystalline morphology. Moreover the key role played by the crystalline relaxation of PVDF on the strain-induced structural evolution is also highlighted for the first time.

  17. Face-centered-cubic lithium crystals formed in mesopores of carbon nanofiber electrodes.

    PubMed

    Lee, Byoung-Sun; Seo, Jong-Hyun; Son, Seoung-Bum; Kim, Seul Cham; Choi, In-Suk; Ahn, Jae-Pyoung; Oh, Kyu Hwan; Lee, Se-Hee; Yu, Woong-Ryeol

    2013-07-23

    In the foreseeable future, there will be a sharp increase in the demand for flexible Li-ion batteries. One of the most important components of such batteries will be a freestanding electrode, because the traditional electrodes are easily damaged by repeated deformations. The mechanical sustainability of carbon-based freestanding electrodes subjected to repeated electrochemical reactions with Li ions is investigated via nanotensile tests of individual hollow carbon nanofibers (HCNFs). Surprisingly, the mechanical properties of such electrodes are improved by repeated electrochemical reactions with Li ions, which is contrary to the conventional wisdom that the mechanical sustainability of carbon-based electrodes should be degraded by repeated electrochemical reactions. Microscopic studies reveal a reinforcing mechanism behind this improvement, namely, that inserted Li ions form irreversible face-centered-cubic (FCC) crystals within HCNF cavities, which can reinforce the carbonaceous matrix as strong second-phase particles. These FCC Li crystals formed within the carbon matrix create tremendous potential for HCNFs as freestanding electrodes for flexible batteries, but they also contribute to the irreversible (and thus low) capacity of HCNFs.

  18. Development of dye-sensitized solar cells composed of liquid crystal embedded, electrospun poly(vinylidene fluoride-co-hexafluoropropylene) nanofibers as polymer gel electrolytes.

    PubMed

    Ahn, Sung Kwang; Ban, Taewon; Sakthivel, P; Lee, Jae Wook; Gal, Yeong-Soon; Lee, Jin-Kook; Kim, Mi-Ra; Jin, Sung-Ho

    2012-04-01

    In order to overcome the problems associated with the use of liquid electrolytes in dye-sensitized solar cells (DSSCs), a new system composed of liquid crystal embedded, polymer electrolytes has been developed. For this purpose, three types of DSSCs have been fabricated. The cells contain electrospun poly(vinylidene fluoride-co-hexafluoropropylene) (e-PVdF-co-HFP) polymer gel electrolyte, with and without doping with the liquid crystal E7 and with a liquid electrolyte. The morphologies of the newly prepared DSSCs were explored using field emission scanning electron microscopy (FE-SEM). Analysis of the FE-SEM images indicate that the DSSC composed of E7 embedded on e-PVdF-co-HFP polymer gel electrolyte has a greatly regular morphology with an average diameter. The ionic conductivity of E7 embedded on e-PVdF-co-HFP polymer gel electrolyte was found to be 2.9 × 10(-3) S/cm at room temperature, a value that is 37% higher than that of e-PVdF-co-HFP polymer gel electrolyte. The DCCS containing the E7 embedded, e-PVdF-co-HFP polymer gel electrolyte was observed to possess a much higher power conversion efficiency (PCE = 6.82%) than that of an e-PVdF-co-HFP nanofiber (6.35%). In addition, DSSCs parameters of the E7 embedded, e-PVdF-co-HFP polymer gel electrolyte (V(oc) = 0.72 V, J(sc) = 14.62 mA/cm(2), FF = 64.8%, and PCE = 6.82% at 1 sun intensity) are comparable to those of a liquid electrolyte (V(oc) = 0.75 V, J(sc) = 14.71 mA/cm(2), FF = 64.9%, and PCE = 7.17%, both at a 1 sun intensity).

  19. Nonlinear Elastic Behavior of Piezoelectric Trigonal Crystals: Measurements on Quartz and Lithium-Niobate

    NASA Astrophysics Data System (ADS)

    Latimer, Paul Jerry

    The ultrasonic harmonic generation technique previously used to measure third-order elastic (TOE) constants of crystals of cubic symmetry has been extended to measurement of crystals of trigonal symmetry. The theory for nonpiezoelectric trigonal crystals of J. Philip {Technical Report No. 22, Office of Naval Research, Contract No. N00014 -81-K-0229 (to be published in 1983)} has been combined with the piezoelectric theory of McMahon {J. Acoust. Soc. Am. 44, 1007 (1968)} to determine the effective TOE constants in a piezoelectric solid, and correction has been made in McMahon's expression. Measurements in weakly piezoelectric quartz have produced values of C(,111) and C(,333) which agree within experimental uncertainty with values of R. N. Thurston, H. J. McSkimin and P. Andreatch, Jr. {J. Appl. Phys. 37, 267 (1966)} and R. Stern and R. T. Smith {J. Acoust. Soc. Am. 44, 640 (1968)} after corrections have been made for the effect of diffraction on the data. Measurements in strongly piezoelectric LiNbO(,3) have resulted in values which agree reasonably well with those of J. Philip and M. A. Breazeale {Proc. IEEE Ultrasonics Symposium, Vol. 2 (1982) } but disagree with those of C. Y. Nakagawa, K. Yamanouchi and K. Shibayama {J. Appl. Phys. 44, 3969 (1973) }. There is indication of some sample dependence of the values of both the second-order elastic constants as well as the third-order elastic constants of LiNbO(,3) samples currently available. In the course of measurement of the TOE constants a negative nonlinearity parameter was observed for the Piezoelectric {100} direction in quartz. This peculiarity is impossible for thermodynamic reasons in fluids, but has been observed once previously in fused silica {J. Bains and M. A. Breazeale, J. Acoust, Soc. Am. 57, 745 (1975)}. The nonlinearity parameter appears to be positive for the piezoelectric {001 } direction in LiNbO(,3). The data presented are for the "piezoelectrically stiffened" TOE constants; however, there are

  20. Theoretical study of Ti0 and Pb+ centers in alkali halide and alkaline earth fluoride type crystals

    NASA Astrophysics Data System (ADS)

    Andriessen, J.; Postma, H.

    1987-04-01

    A theoretical study has been carried out on the hfi of Pb+ defects in KCl, CaF2 and BaF2 using an earlier developed crystal field model. Experimental results can be explained in the same way as was done for Tl0 in KCl. However some parameters seem to have a less physical meaning than in the case of Tl0. A new method is in progress using the ASW band structure procedure in order to estimate genuine solid state effects. Preliminary results are encouraging.

  1. Substitution mechanisms and location of Co2+ ions in congruent and stoichiometric lithium niobate crystals derived from electron paramagnetic resonance data

    NASA Astrophysics Data System (ADS)

    Grachev, V. G.; Hansen, K.; Meyer, M.; Kokanyan, E. P.; Malovichko, G. I.

    2017-03-01

    Electron paramagnetic resonance (EPR) spectra and their angular dependencies were measured for Co2+ trace impurities in stoichiometric samples of lithium niobate doped with rhodium. It was found that Co2+ substitutes for Li+ in the dominant axial center (CoLi) and that the principal substitution mechanism in stoichiometric lithium niobate is 4Co2+ ↔ 3Li+  +  Nb5+. The four Co2+ ions can occupy the nearest possible cation sites by occupying a Nb site and its three nearest-neighbor Li sites, creating a trigonal pyramid with C3 symmetry, as well as non-neighboring sites (e.g. a CoNb-CoLi pair at the nearest sites on the C3 axis with two nearby isolated single Co2+ ions substituted for Li+). In congruent crystals and samples with Li content enriched by vapor transport equilibrium treatment the excess charge of the Co2+ centers is compensated by lithium vacancies located rather far from the Co2+ ions for the dominant axial center or in the nearest neighborhood for low-symmetry satellite centers (the Co2+ ↔ 2Li+ substitution mechanism). The use of exact numerical diagonalization of the spin-Hamiltonian matrices explains all the details of the EPR spectra and gives a value for hyperfine interaction A || that is several times smaller than that obtained using perturbation formulae. The refined values of A and g-tensor components can be used as reliable cornerstones for ab initio and cluster calculations.

  2. Desired crystal oriented LiFePO4 nanoplatelets in situ anchored on a graphene cross-linked conductive network for fast lithium storage.

    PubMed

    Wang, Bo; Liu, Anmin; Abdulla, Wael Al; Wang, Dianlong; Zhao, X S

    2015-05-21

    Electron transfer and lithium ion diffusion rates are the key factors limiting the lithium ion storage in anisotropic LiFePO4 electrodes. In this work, we employed a facile solvothermal method to synthesize a "platelet-on-sheet" LiFePO4/graphene composite (LFP@GNs), which is LiFePO4 nanoplatelets in situ grown on graphene sheets with highly oriented (010) facets of LiFePO4 crystals. Such a two-phase contact mode with graphene sheets cross-linked to form a three-dimensional porous network is favourable for both fast lithium ion and electron transports. As a result, the designed LFP@GNs displayed a high rate capability (∼56 mA h g(-1) at 60 C) and long life cycling stability (∼87% capacity retention over 1000 cycles at 10 C). For comparison purposes, samples ex situ modified with graphene (LFP/GNs) as well as pure LiFePO4 platelets (LFP) were also prepared and investigated. More importantly, the obtained LFP@GNs can be used as a basic unit for constructing more complex structures to further improve electrochemical performance, such as coating the exposed LFP surface with a thin layer of carbon to build a C@LFP@GN composite to further enhance its cycling stability (∼98% capacity retention over 1000 cycles at 10 C).

  3. Fluoridated Water

    MedlinePlus

    ... based on a review of more than 50 human epidemiological (population) studies produced over the past 40 years, concluded that optimal fluoridation of drinking water “does not pose a detectable cancer risk to humans” as evidenced by extensive human epidemiological data reported ...

  4. The missing hydrate AlF3·6H2Odbnd [Al(H2O)6]F3: Ionothermal synthesis, crystal structure and characterization of aluminum fluoride hexahydrate

    NASA Astrophysics Data System (ADS)

    Wang, Guangmei; Mudring, Anja-Verena

    2016-11-01

    AlF3 is a strong Lewis acid and several hydrates of it are known, namely the monohydrate, the trihydrate (of which two polymorphs have been described) and the nonohydrate, which forms in the abundance of water, as well as a more complex fluoride of composition Al0.82□0.18F2.46(H2O)0.54 whose structure has been related to the ReO3 type. The monohydrate features edge connected [AlF6] octahedra, in the tri- and nonahydrate mixed F/O coordination of aluminum is observed. Here we report on a new aluminium fluoride hydrate, AlF3·6H2O, which could be obtained via ionothermal synthesis in the ionic liquid n-hexyl-pyridinium tetrafluoroborate. The ionic liquid serves in the synthesis of AlF3·6H2O as the reaction partner (fluoride source) and solvent. Overmore it controls the water activity allowing access to the missing AlF3·6H2O. Single-crystal X-ray diffraction analysis of AlF3·6H2O shows that it crystallizes in the anti-Li3Bi-type of structure according to F3[Al(H2O)6] (Fm-3m, a = 893.1(2) pm, Z = 4) featuring hexaaqua aluminium(III) cations and isolated fluoride anions. The compound was further characterized by powder X-ray diffraction, TG/DTA, IR analyses.

  5. Frequency non-degenerate sequential excitation of the impurity trapped exciton in strontium fluoride crystals doped with ytterbium

    SciTech Connect

    Senanayake, Pubudu S.; Hughes-Currie, Rosa B.; Wells, Jon-Paul R.; Reid, Michael F.; Berden, Giel; Reeves, Roger J.; Meijerink, Andries

    2015-04-07

    We model the dynamic behaviour observed for impurity-trapped excitons in SrF{sub 2}:Yb{sup 2+} using transient photoluminescence enhancement induced via a two-frequency, sequential excitation process employing an UV optical parametric amplifier synchronized to an IR free electron laser (FEL). We observe sharp transitions interpreted as a change of state of the localized hole and broad bands interpreted as a change of state of the delocalized electron. Our modeling indicates that the 4f crystal-field interaction is 25% smaller than in CaF{sub 2}. The photoluminescence enhancement transients are analyzed across a range of excitation frequencies using a system of rate equations. The temporal behavior is explained in terms of intra-excitonic relaxation, local lattice heating by the FEL, and liberation of electrons from trap states.

  6. Frequency non-degenerate sequential excitation of the impurity trapped exciton in strontium fluoride crystals doped with ytterbium

    NASA Astrophysics Data System (ADS)

    Senanayake, Pubudu S.; Wells, Jon-Paul R.; Reid, Michael F.; Hughes-Currie, Rosa B.; Berden, Giel; Reeves, Roger J.; Meijerink, Andries

    2015-04-01

    We model the dynamic behaviour observed for impurity-trapped excitons in SrF2:Yb2+ using transient photoluminescence enhancement induced via a two-frequency, sequential excitation process employing an UV optical parametric amplifier synchronized to an IR free electron laser (FEL). We observe sharp transitions interpreted as a change of state of the localized hole and broad bands interpreted as a change of state of the delocalized electron. Our modeling indicates that the 4f crystal-field interaction is 25% smaller than in CaF2. The photoluminescence enhancement transients are analyzed across a range of excitation frequencies using a system of rate equations. The temporal behavior is explained in terms of intra-excitonic relaxation, local lattice heating by the FEL, and liberation of electrons from trap states.

  7. Investigation of Nd3+ ions spectroscopic and laser properties in SrF2 fluoride single crystal

    NASA Astrophysics Data System (ADS)

    Alimov, O. K.; Basiev, T. T.; Doroshenko, M. E.; Fedorov, P. P.; Konyushkin, V. A.; Nakladov, A. N.; Osiko, V. V.

    2012-03-01

    The laser properties of SrF2:Nd3+ crystal with neodymium ions concentration of 0.5 at.% were investigated under diode laser pumping. Using temperature tuning of laser diode pumping wavelength two different lines centered at about 1037 nm and 1044 nm attributed to oscillation of different optical centers were obtained. The maximum lasing slope efficiency of 37% was obtained. The absorption and fluorescence spectra of different individual and clustered Nd3+ ions optical centers were observed depending on Nd3+ concentration. The lifetimes of the high symmetry L-centers were measured and found to be two orders of magnitude longer than that for clustered M-centers at room temperature. The lifetimes of M-centers at different temperatures were measured and microparameter of ion-ion interaction in Nd-pairs was determined.

  8. Optical and EPR spectroscopy of Er3+ in lithium yttrium borate, Li6Y(BO3)3:Er single crystals

    NASA Astrophysics Data System (ADS)

    Kovács, L.; Arceiz Casas, S.; Corradi, G.; Tichy-Rács, É.; Kocsor, L.; Lengyel, K.; Ryba-Romanowski, W.; Strzep, A.; Scholle, A.; Greulich-Weber, S.

    2017-10-01

    The energy levels of Er3+ ions have been determined in lithium yttrium borate (Li6Y(BO3)3) single crystals in a wide spectral range between 6000 and 40000 cm-1 together with an analysis of the ground state, using optical and EPR spectroscopy. The crystal field splittings of the 4I15/2 ground state and those of nearly all excited states up to the 4D7/2 manifold have been obtained at low temperature from luminescence (T = 5 K) and absorption (T = 9 K) measurements, respectively. The numbers of experimentally observed Stark sublevels agree well with those expected theoretically for Er3+ ions occupying a single low symmetry (C1) site. A full set of g- and 167Er hyperfine tensor parameters are presented for the ground state characterized by EPR; the measured Orbach-type spin-relaxation rates viz. the involved activation energies correspond to the optically derived lowest excited sublevels.

  9. Investigation on crystalline perfection, optical transmittance, birefringence, temperature-dependent refractive index, laser damage threshold and pyroelectric characteristics of inversely soluble lithium sulfate monohydrate single crystals

    NASA Astrophysics Data System (ADS)

    Silambarasan, A.; Rajesh, P.; Bhatt, Rajeev; Bhaumik, Indranil; Karnal, A. K.; Ramasamy, P.; Gupta, P. K.

    2016-08-01

    Bulk prismatic lithium sulfate monohydrate (LSMH) single crystals were grown by seed rotation with slow heating method from aqueous solution. Small FWHM obtained from high-resolution X-ray diffraction spectrum shows that the crystals grown by this method have less defects and absence of low-angle grain boundaries. The high transmittance and low reflectance nature of the grown crystal was observed using UV-Vis-NIR spectrometer. The principal refractive indices of a LSMH crystal have been measured by a prism coupling method for the wavelengths of 0.407, 0.532, 0.828, 1.064 and 1.551 µm at room temperature, and Sellmeier equations are determined from the fitting of the data point. The refractive index data confirm that LSMH crystal is negative biaxial and the optic axis lies in YZ plane with an angle (2 V y ) of 51.74° with respect to y axis at 532 nm wavelength. The thermo-optic coefficients were determined from the temperature-dependent refractive indices measured in the range of 30-125 °C for the wavelengths of 532 and 1064 nm. The surface laser damage threshold studies reveal the higher optical radiation stability against 532-nm laser. The pyroelectric coefficients and pyroelectric figure of merit were determined from the pyroelectric current measurement by the Byer and Roundy method.

  10. Three-Dimensional (3D) Bicontinuous Hierarchically Porous Mn2O3 Single Crystals for High Performance Lithium-Ion Batteries.

    PubMed

    Huang, Shao-Zhuan; Jin, Jun; Cai, Yi; Li, Yu; Deng, Zhao; Zeng, Jun-Yang; Liu, Jing; Wang, Chao; Hasan, Tawfique; Su, Bao-Lian

    2015-10-06

    Bicontinuous hierarchically porous Mn2O3 single crystals (BHP-Mn2O3-SCs) with uniform parallelepiped geometry and tunable sizes have been synthesized and used as anode materials for lithium-ion batteries (LIBs). The monodispersed BHP-Mn2O3-SCs exhibit high specific surface area and three dimensional interconnected bimodal mesoporosity throughout the entire crystal. Such hierarchical interpenetrating porous framework can not only provide a large number of active sites for Li ion insertion, but also good conductivity and short diffusion length for Li ions, leading to a high lithium storage capacity and enhanced rate capability. Furthermore, owing to their specific porosity, these BHP-Mn2O3-SCs as anode materials can accommodate the volume expansion/contraction that occurs with lithium insertion/extraction during discharge/charge processes, resulting in their good cycling performance. Our synthesized BHP-Mn2O3-SCs with a size of ~700 nm display the best electrochemical performance, with a large reversible capacity (845 mA h g(-1) at 100 mA g(-1) after 50 cycles), high coulombic efficiency (>95%), excellent cycling stability and superior rate capability (410 mA h g(-1) at 1 Ag(-1)). These values are among the highest reported for Mn2O3-based bulk solids and nanostructures. Also, electrochemical impedance spectroscopy study demonstrates that the BHP-Mn2O3-SCs are suitable for charge transfer at the electrode/electrolyte interface.

  11. Three-Dimensional (3D) Bicontinuous Hierarchically Porous Mn2O3 Single Crystals for High Performance Lithium-Ion Batteries

    NASA Astrophysics Data System (ADS)

    Huang, Shao-Zhuan; Jin, Jun; Cai, Yi; Li, Yu; Deng, Zhao; Zeng, Jun-Yang; Liu, Jing; Wang, Chao; Hasan, Tawfique; Su, Bao-Lian

    2015-10-01

    Bicontinuous hierarchically porous Mn2O3 single crystals (BHP-Mn2O3-SCs) with uniform parallelepiped geometry and tunable sizes have been synthesized and used as anode materials for lithium-ion batteries (LIBs). The monodispersed BHP-Mn2O3-SCs exhibit high specific surface area and three dimensional interconnected bimodal mesoporosity throughout the entire crystal. Such hierarchical interpenetrating porous framework can not only provide a large number of active sites for Li ion insertion, but also good conductivity and short diffusion length for Li ions, leading to a high lithium storage capacity and enhanced rate capability. Furthermore, owing to their specific porosity, these BHP-Mn2O3-SCs as anode materials can accommodate the volume expansion/contraction that occurs with lithium insertion/extraction during discharge/charge processes, resulting in their good cycling performance. Our synthesized BHP-Mn2O3-SCs with a size of ~700 nm display the best electrochemical performance, with a large reversible capacity (845 mA h g-1 at 100 mA g-1 after 50 cycles), high coulombic efficiency (>95%), excellent cycling stability and superior rate capability (410 mA h g-1 at 1 Ag-1). These values are among the highest reported for Mn2O3-based bulk solids and nanostructures. Also, electrochemical impedance spectroscopy study demonstrates that the BHP-Mn2O3-SCs are suitable for charge transfer at the electrode/electrolyte interface.

  12. Three-Dimensional (3D) Bicontinuous Hierarchically Porous Mn2O3 Single Crystals for High Performance Lithium-Ion Batteries

    PubMed Central

    Huang, Shao-Zhuan; Jin, Jun; Cai, Yi; Li, Yu; Deng, Zhao; Zeng, Jun-Yang; Liu, Jing; Wang, Chao; Hasan, Tawfique; Su, Bao-Lian

    2015-01-01

    Bicontinuous hierarchically porous Mn2O3 single crystals (BHP-Mn2O3-SCs) with uniform parallelepiped geometry and tunable sizes have been synthesized and used as anode materials for lithium-ion batteries (LIBs). The monodispersed BHP-Mn2O3-SCs exhibit high specific surface area and three dimensional interconnected bimodal mesoporosity throughout the entire crystal. Such hierarchical interpenetrating porous framework can not only provide a large number of active sites for Li ion insertion, but also good conductivity and short diffusion length for Li ions, leading to a high lithium storage capacity and enhanced rate capability. Furthermore, owing to their specific porosity, these BHP-Mn2O3-SCs as anode materials can accommodate the volume expansion/contraction that occurs with lithium insertion/extraction during discharge/charge processes, resulting in their good cycling performance. Our synthesized BHP-Mn2O3-SCs with a size of ~700 nm display the best electrochemical performance, with a large reversible capacity (845 mA h g−1 at 100 mA g−1 after 50 cycles), high coulombic efficiency (>95%), excellent cycling stability and superior rate capability (410 mA h g−1 at 1 Ag−1). These values are among the highest reported for Mn2O3-based bulk solids and nanostructures. Also, electrochemical impedance spectroscopy study demonstrates that the BHP-Mn2O3-SCs are suitable for charge transfer at the electrode/electrolyte interface. PMID:26439102

  13. Evaluation of interactive forces between alkaline earth metal fluoride particles and single crystal substrate using atomic force microscopy

    NASA Astrophysics Data System (ADS)

    Tsai, Yi-Yang; Nalladega, Vijay; Sathish, Shamachary; Stanford, Malcolm K.

    2004-07-01

    Interactive forces between particles play an important role in diverse fields of science and technology. With the advent of Atomic Force Microscopy, investigation of interactive forces has been extended to micro and nano-scale particles with new applications. These forces are known to vary with the dimension of the particles and with the different levels of humidity. In the present paper we have investigated the interactive forces between a spherical particle probes of eutectic BaF2-CaF2 and a single crystal surface of CaF2 using an Atomic Force Microscope. The effect of humidity on the interactive forces has been examined by analyzing the force-displacement curves at controlled levels of humidity. Force distance curves obtained with two different probes, 5 μm and 17 μm in diameter, and have been examined to investigate the effect of probe dimensions. The results are discussed in view of the application of eutectic BaF2-CaF2 particles in self-lubricating coatings for aerospace applications.

  14. Graphite Fluoride Fiber Composites For Heat Sinking

    NASA Technical Reports Server (NTRS)

    Hung, Ching-Cheh; Long, Martin; Stahl, Mark

    1989-01-01

    Graphite fluoride fiber/polymer composite materials consist of graphite fluoride fibers in epoxy, polytetrafluoroethylene, or polyimide resin. Combines high electrical resistivity with high thermal conductivity and solves heat-transfer problems of many electrical systems. Commercially available in powder form, for use as dry lubricant or cathode material in lithium batteries. Produced by direct fluorination of graphite powder at temperature of 400 to 650 degree C. Applications include printed-circuit boards for high-density power electronics, insulators for magnetic-field cores like those found in alternators and transformers, substrates for thin-film resistors, and electrical-protection layers in aircraft de-icers.

  15. Fracture behavior of lithium single crystal in the framework of (semi-)empirical force field derived from first-principles

    NASA Astrophysics Data System (ADS)

    Groh, Sébastien; Alam, Masud

    2015-06-01

    An approach to derive, from first-principles data, accurate and reliable potentials in the modified embedded-atom method in view of modeling the mechanical behavior of metals is presented in this work and applied to the optimization of a potential representative of lithium (Li). Although the theoretical background of the modified embedded-atom method was considered in this work, the proposed method is general and it can be applied to any other functional form. The main feature of the method is to introduce several path transformations in the material database that are critical for plastic and failure behavior. As part of the potential validation, path transformations different from the ones used for the parameterization procedure are considered. Applied in the case of Li, the material database was enriched with the generalized stacking fault energy curve along the  <1 1 1>  -direction on the {1 1 0}-plane, and with the traction-separation behavior of a {1 0 0}-surface. The path transformations used to enrich the material database were initially derived from first-principles calculations. For validation, the generalized stacking fault energy curves along the  <1 1 1>  -direction on the {1 1 2}- and {1 2 3}-planes were considered for plasticity, while traction-separation behavior of {1 1 0} and {1 1 1}-planes were considered for failure behavior. As part of the validation procedure, the predictions made in the MEAM framework were validated by first-principles data. The final potential accurately reproduced basic equilibrium properties, elastic constants, surface energies in agreement with first-principles predictions, and transition energy between different crystal structures. Furthermore, generalized stacking fault energy curves along the  <1 1 1>  -direction on the {1 1 0}, {1 1 2}, and {1 2 3}-planes, and tensile cohesive stress, characteristic length of fracture, and work of separation of a

  16. Inheritance of Crystallographic Orientation during Lithiation/Delithiation Processes of Single-Crystal α-Fe2O3 Nanocubes in Lithium-Ion Batteries.

    PubMed

    Ma, Xiaowei; Zhang, Manyu; Liang, Chongyun; Li, Yuesheng; Wu, Jingjing; Che, Renchao

    2015-11-04

    Iron oxides are very promising anode materials based on conversion reactions for lithium-ion batteries (LIBs). During conversion processes, the crystal structure and composition of the electrode material are drastically changed. Surprisingly, in our study, inheritance of a crystallographic orientation was found during lithiation/delithiation processes of single-crystal α-Fe2O3 nanocubes by ex situ transmission electron microscopy. Single-crystal α-Fe2O3 was first transformed into numerous Fe nanograins embedded in a Li2O matrix, and then the conversion between Fe and FeO nanograins became the main reversible electrochemical reaction for energy storage. Interestingly, these Fe/FeO nanograins had almost the same crystallographic orientation, indicating that the lithiated/delithiated products can inherit the crystallographic orientation of single-crystal α-Fe2O3. This finding is important for understanding the detailed electrochemical conversion processes of iron oxides, and this feature may also exist during lithiation/delithiation processes of other transition-metal oxides.

  17. Fluoride absorption: independence from plasma fluoride levels

    SciTech Connect

    Whitford, G.M.; Williams, J.L.

    1986-04-01

    The concept that there are physiologic mechanisms to homeostatically regulate plasma fluoride concentrations has been supported by results in the literature suggesting an inverse relationship between plasma fluoride levels and the absorption of the ion from the gastrointestinal tract of the rat. The validity of the relationship was questioned because of possible problems in the experimental design. The present work used four different methods to evaluate the effect of plasma fluoride levels on the absorption of the ion in rats: (i) the percentage of the daily fluoride intake that was excreted in the urine; (ii) the concentration of fluoride in femur epiphyses; (iii) the net areas under the time-plasma fluoride concentration curves after intragastric fluoride doses; and (iv) the residual amounts or fluoride in the gastrointestinal tracts after the intragastric fluoride doses. None of these methods indicated that plasma fluoride levels influence the rate or the degree or fluoride absorption. It was concluded that, unless extremely high plasma fluoride levels are involved (pharmacologic or toxic doses), the absorption of the ion is independent of plasma levels. The results provide further evidence that plasma fluoride concentrations are not homeostatically regulated.

  18. Desired crystal oriented LiFePO4 nanoplatelets in situ anchored on a graphene cross-linked conductive network for fast lithium storage

    NASA Astrophysics Data System (ADS)

    Wang, Bo; Liu, Anmin; Abdulla, Wael Al; Wang, Dianlong; Zhao, X. S.

    2015-05-01

    Electron transfer and lithium ion diffusion rates are the key factors limiting the lithium ion storage in anisotropic LiFePO4 electrodes. In this work, we employed a facile solvothermal method to synthesize a ``platelet-on-sheet'' LiFePO4/graphene composite (LFP@GNs), which is LiFePO4 nanoplatelets in situ grown on graphene sheets with highly oriented (010) facets of LiFePO4 crystals. Such a two-phase contact mode with graphene sheets cross-linked to form a three-dimensional porous network is favourable for both fast lithium ion and electron transports. As a result, the designed LFP@GNs displayed a high rate capability (~56 mA h g-1 at 60 C) and long life cycling stability (~87% capacity retention over 1000 cycles at 10 C). For comparison purposes, samples ex situ modified with graphene (LFP/GNs) as well as pure LiFePO4 platelets (LFP) were also prepared and investigated. More importantly, the obtained LFP@GNs can be used as a basic unit for constructing more complex structures to further improve electrochemical performance, such as coating the exposed LFP surface with a thin layer of carbon to build a C@LFP@GN composite to further enhance its cycling stability (~98% capacity retention over 1000 cycles at 10 C).Electron transfer and lithium ion diffusion rates are the key factors limiting the lithium ion storage in anisotropic LiFePO4 electrodes. In this work, we employed a facile solvothermal method to synthesize a ``platelet-on-sheet'' LiFePO4/graphene composite (LFP@GNs), which is LiFePO4 nanoplatelets in situ grown on graphene sheets with highly oriented (010) facets of LiFePO4 crystals. Such a two-phase contact mode with graphene sheets cross-linked to form a three-dimensional porous network is favourable for both fast lithium ion and electron transports. As a result, the designed LFP@GNs displayed a high rate capability (~56 mA h g-1 at 60 C) and long life cycling stability (~87% capacity retention over 1000 cycles at 10 C). For comparison purposes, samples

  19. Lithium niobate explosion monitor

    DOEpatents

    Bundy, Charles H.; Graham, Robert A.; Kuehn, Stephen F.; Precit, Richard R.; Rogers, Michael S.

    1990-01-01

    Monitoring explosive devices is accomplished with a substantially z-cut lithium niobate crystal in abutment with the explosive device. Upon impact by a shock wave from detonation of the explosive device, the crystal emits a current pulse prior to destruction of the crystal. The current pulse is detected by a current viewing transformer and recorded as a function of time in nanoseconds. In order to self-check the crystal, the crystal has a chromium film resistor deposited thereon which may be heated by a current pulse prior to detonation. This generates a charge which is detected by a charge amplifier.

  20. Lithium niobate explosion monitor

    DOEpatents

    Bundy, C.H.; Graham, R.A.; Kuehn, S.F.; Precit, R.R.; Rogers, M.S.

    1990-01-09

    Monitoring explosive devices is accomplished with a substantially z-cut lithium niobate crystal in abutment with the explosive device. Upon impact by a shock wave from detonation of the explosive device, the crystal emits a current pulse prior to destruction of the crystal. The current pulse is detected by a current viewing transformer and recorded as a function of time in nanoseconds. In order to self-check the crystal, the crystal has a chromium film resistor deposited thereon which may be heated by a current pulse prior to detonation. This generates a charge which is detected by a charge amplifier. 8 figs.

  1. A5RE4X[TO4]4 crystal growth: Fluoride flux synthesis of Na5Ln4F[GeO4]4 (Ln=Pr, Nd), the first quaternary germanate oxyfluorides

    NASA Astrophysics Data System (ADS)

    Latshaw, Allison M.; Wilkins, Branford O.; Morrison, Gregory; Smith, Mark D.; zur Loye, Hans-Conrad

    2016-07-01

    Crystals of Na5Pr4F[GeO4]4 and Na5Nd4F[GeO4]4 were synthesized using a eutectic sodium fluoride, sodium chloride flux. Both compounds crystallize in the tetragonal space group I-4 with lattice parameters of a=12.1173(4) Å and c=5.6795(2) Å (Pr) and of a=12.0642(17) Å and c=5.6674(11) Å (Nd). The structure of the reported compounds is three-dimensional with face and corner sharing lanthanide polyhedra which edge and corner share with isolated germanium tetrahedra. These novel compositions represent the first example of quaternary germanium containing oxyfluorides.

  2. Spectroscopic properties of long-lifetime Tm3+ optical centers in Ca-Sr-Ba fluorides in the form of single crystals and ceramics at the 1G4-3H5 magnetic dipole allowed transition

    NASA Astrophysics Data System (ADS)

    Doroshenko, M. E.; Papashvili, A. G.; Martynova, K. A.; Konyushkin, V. A.; Nakladov, A. N.; Osiko, V. V.

    2017-02-01

    The spectroscopic properties of new long-lifetime Tm3+ tetragonal optical centers at low (77 K) temperature were investigated using a site-selective time-resolved technique. The absorption and excitation spectra at the 3H6-1G4 transition and the fluorescence spectra at the 1G4-3H5 transition were measured in CaF2, SrF2, and BaF2 single crystals. The appearance of additional weak lines in the excitation and fluorescence spectra in hot-formed ceramics produced from the same crystals was observed. These lines were attributed to the recently observed long-lifetime tetragonal optical centers with a modified local environment formed in fluoride ceramics.

  3. Complex investigations of structural and optical homogeneities of low-photorefractivity lithium niobate crystals by the conoscopy and photoinduced and Raman light scattering methods

    NASA Astrophysics Data System (ADS)

    Sidorov, N. V.; Pikoul, O. Yu.; Kruk, A. A.; Teplyakova, N. A.; Yanichev, A. A.; Palatnikov, M. N.

    2015-02-01

    Using photoinduced light scattering, conoscopy, and Raman spectroscopy methods, we have studied stoichiometric lithium niobate crystals and congruent crystals that were doped with Mg(0.078, 0.89 mas %), Zn(0.03, 0.52, 0.62), Cu(0.015), B(0.12), Gd(0.51), Y(0.46), Gd(0.23):Mg(0.75), Mg(0.86):Fe(0.0036), Ta(1.13):Mg(0.011), and Y(0.24):Mg(0.63) cations. It has been found that, depending on the kind of the pattern of photoinduced light scattering, investigated specimens can be divided into three groups. We have shown that the asymmetry of the indicatrix of photoinduced light scattering of LiNbO3 crystals is caused by birefringence of exciting laser radiation as it propagates perpendicularly to the polar axis of the crystal, whereas the asymmetry of the Raman spectrum arises due to the occurrence of spontaneous polarization, the vector of which is directed along the polar axis, and by birefringence. The pattern of the photoinduced light scattering depends on the difference of the refractive indices Δ n = n o - n e of the ordinary ( n o ) and extraordinary ( n e ) rays and their energies E. If En o {ie259-1} En e , the proportion of the photoinduced light scattering has the shape of a three-layer round spot. For equal energies, the pattern has the shape of a symmetric figure-eight. At En o < En e , the figure-eight is asymmetric. In this case, its large "lobe" is directed in the positive direction of the polar axis of the crystal.

  4. Unique 1D Co3O4 crystallized nanofibers with (220) oriented facets as high-performance lithium ion battery anode material

    PubMed Central

    Tan, Yanli; Gao, Qiuming; Li, Zeyu; Tian, Weiqian; Qian, Weiwei; Yang, Chunxiao; Zhang, Hang

    2016-01-01

    A novel one-step hydrothermal and calcination strategy was developed to synthesize the unique 1D oriented Co3O4 crystal nanofibers with (220) facets on the carbon matrix derived from the natural, abundant and low cost wool fibers acting as both carbon precursor and template reagent. The resultant W2@Co3O4 nanocomposite exhibited very high specific capacity and favorable high-rate capability when used as anode material of lithium ion battery. The high reversible Li+ ion storage capacity of 986 mAh g−1 was obtained at 100 mA g−1 after 150 cycles, higher than the theoretical capacity of Co3O4 (890 mAh g−1). Even at the higher current density of 1 A g−1, the electrode could still deliver a remarkable discharge capacity of 720 mAh g−1 over 150 cycles. PMID:27217201

  5. [Fluoride emission from different soil minerals at high temperatures].

    PubMed

    Wu, W; Xie, Z; Xu, J; Liu, C

    2001-03-01

    The emission characteristics of fluoride pollutants from montmorillonite, kaolinite, vermiculite, geothite and allophane were studied to elucidate the mechanism of fluoride-releasing from soils during brick and tile making at high temperatures from 300 degrees C to 1000 degrees C. The rate of fluoride emission varied with temperature, mineral type, heating time, specific surface area and cations added to minerals. The escape of crystalline water resulting from crystal lattice collapse at a certain high temperature was found to affect the rate of fluoride emission. Calcium compounds could decrease fluoride emission rate from montmorillonite. At 800 degrees C, the rate of fluoride emission from Ca-treated montmorillonite decreased by 59.6% compared to untreated montmorillonite. The order for fluoride-fixing capacity of the 5 calcium compounds at 800 degrees C was as follows: CaCO3 > CaO > Ca3(PO4)2 > Ca(OH)2 > CaSO4.

  6. High-pressure synthesis and crystal structure of the lithium borate HP-LiB{sub 3}O{sub 5}

    SciTech Connect

    Neumair, Stephanie C.; Vanicek, Stefan; Kaindl, Reinhard; Toebbens, Daniel M.; Wurst, Klaus; Huppertz, Hubert

    2011-09-15

    The new lithium borate HP-LiB{sub 3}O{sub 5} was synthesized under high-pressure/high-temperature conditions of 6 GPa and 1050 deg. C in a multianvil press with a Walker-type module. The compound crystallizes in the space group Pnma (no. 62) with the lattice parameters a=829.7(2), b=759.6(2), and c=1726.8(4) pm (Z=16). The high-pressure compound HP-LiB{sub 3}O{sub 5} is built up from a three-dimensional network of BO{sub 4} tetrahedra and BO{sub 3} groups, which incorporates Li{sup +} ions in channels along the b-axis. Band assignments of measured IR- and Raman spectra were done via quantum-mechanical calculations. Additionally, the thermal behavior of HP-LiB{sub 3}O{sub 5} was investigated. - Graphical abstract: The new high-pressure compound HP-LiB{sub 3}O{sub 5} is built up from a three-dimensional network of BO4 tetrahedra and BO{sub 3} groups, which incorporates Li{sup +} ions in channels along the b-axis. In this paper, the synthesis, the crystal structure, and the properties of HP-LiB{sub 3}O{sub 5} are described. Highlights: > Synthesis of a new lithium borate with the composition HP-LiB{sub 3}O{sub 5} at high pressure. > In contrast to the non-centrosymmetric phase LiB{sub 3}O{sub 5}, this high-pressure phase is centrosymmetric. > First example of ternary alkali borates exhibiting threefold bridging oxygen atoms.

  7. Low-temperature crystal structure, specific heat, and dielectric properties of lithium tetraborate Li2B4O7

    NASA Astrophysics Data System (ADS)

    Senyshyn, A.; Schwarz, B.; Lorenz, T.; Adamiv, V. T.; Burak, Ya. V.; Banys, J.; Grigalaitis, R.; Vasylechko, L.; Ehrenberg, H.; Fuess, H.

    2010-11-01

    Coherent neutron powder diffraction experiments were carried out together with specific heat, dilatometry, and dielectric spectroscopy studies on Li2B4O7 enriched with B11 isotope to 99.3% at low temperatures. Neither traces of phase transformations nor discontinuous changes in physical properties were observed. Negative thermal expansion, anomalous thermal behavior of selected interatomic distances/angles, isotropic displacement parameters on specific sites as well as dielectric constant were discussed in terms of dynamic lithium disorder.

  8. Salt fluoridation: a review.

    PubMed

    Pollick, Howard F

    2013-06-01

    Salt fluoridation is sometimes suggested as a prospect for communities that have a low water fluoride concentration and have no possibility of implementing community water fluoridation. School-based milk fluoridation programs also are practiced in some countries as an alternative. This paper reviews the evidence of effectiveness in dental caries prevention and risks of dental fluorosis in countries where salt or milk fluoridation is practiced.

  9. Gd(3+)-Yb(3+) Exchange Interactions in LiYb(x)Y(1-x)F4 Single Crystals

    DTIC Science & Technology

    2001-01-01

    fluorolanthanate phases," Inorg. Chem. 9, pp. 1096-1101, 1970. 6. L. E. Misiak, P. Mikolajczak and M. Subotowicz, "Lithium rare-earth fluoride crystal growth and...of Gd 34 in LiYF 4 determined by EPR," Solid State Commun. 45, pp. 1093-1098, 1983. 8. S. K. Misra, M. Kahrizi, P. Mikolajczak and L. E. Misiak, "EPR...and P. Mikolajczak , "EPR of Gd34 -doped single crystals of LiYbxY_,-F 4," Phys. Rev. B 38, pp. 8673-8682, 1988. 10. M. R. St. John and R. J. Myers

  10. Electrical Relaxation in Rare Earth Doped Cadmium Fluoride.

    DTIC Science & Technology

    1986-09-01

    RD-A172 412 ELECTRICAL RELAXATION IN RARE EARTH DOPED CNANIUN idpi FLUORIDE (U NAVAL ACADEMY ANNAPOLIS ND DEPT OF PHYSICS J J FONTANELLA ET AL. Gi SEP...Doped Cadmium Fluoride by John J. Fontanella & Mary C. Wintersgill Prepared for Publication in Crystal Lattice Defects and Amorphous Materials U. S...Include Security Classification) Electrical Relaxation in Rare Earth Doped Cadmium Fluoride (Unclassified) 12 PERSONAL AUTHOR(S) John J. Fontanella and

  11. Thermal and structural study of the crystal phases and mesophases in the lithium and thallium(i) propanoates and pentanoates binary systems: formation of mixed salts and stabilization of the ionic liquid crystal phase.

    PubMed

    Martínez Casado, F J; Ramos Riesco, M; da Silva, I; Labrador, A; Redondo, M I; García Pérez, M V; López-Andrés, S; Rodríguez Cheda, J A

    2010-08-12

    The temperature and enthalpy vs composition phase diagrams of the binary systems [xC(2)H(5)CO(2)Li + (1 - x)C(2)H(5)CO(2)Tl], and [x(n-C(4)H(9)CO(2)Li) + (1 - x)n-C(4)H(9)CO(2)Tl], where x is the mole fraction, were determined by DSC. Both binary systems display the formation of one 2:1 mixed salt each (at x = 0.667) that appear as a peritectic (incongruent melting) at T(fus) = 512.0 K, and T(fus) = 461.1 K, with Delta(fus)H(m) = 13.76 and 8.08 kJ.mol(-1) for Li-Tl (I) propanoates, and n-pentanoate mixed salts, respectively. The thermotropic liquid crystal of the thallium(I) n-pentanoate transforms into a more stable liquid-crystal phase, which appears in the phase diagram between 380 and 488 K and for x = 0 up to x = 0.56. The crystal structure of thallium(I) propanoate and of the two mixed salts were obtained via X-ray synchrotron radiation diffraction measurements. These compounds present a bilayered structure similar to the two pure lithium salts previously found by our group.

  12. Fluoride and Water (For Parents)

    MedlinePlus

    ... Your 1- to 2-Year-Old Fluoride and Water KidsHealth > For Parents > Fluoride and Water A A ... to 19-year-olds continue Fluoride and the Water Supply For more than 60 years, water fluoridation ...

  13. Private Well Water and Fluoride

    MedlinePlus

    ... well. What do I need to know about fluoride and groundwater from a well? Fluoride is present ... well has less than the recommended level of fluoride for preventing tooth decay? The recommended fluoride level ...

  14. Fluoride and Water (For Parents)

    MedlinePlus

    ... Your 1- to 2-Year-Old Fluoride and Water KidsHealth > For Parents > Fluoride and Water Print A ... to 19-year-olds continue Fluoride and the Water Supply For more than 60 years, water fluoridation ...

  15. Crystal structure of [bis-(2,6-diiso-propyl-phen-yl) phosphato-κO]tris-(methanol-κO)lithium methanol monosolvate.

    PubMed

    Minyaev, Mikhail E; Nifant'ev, Ilya E; Tavtorkin, Alexander N; Korchagina, Sof'ya A; Zeynalova, Shadana Sh

    2015-05-01

    Crystals of the title compound, [Li{OOP(O-2,6-(i)Pr2C6H3)2}(CH3OH)3]·CH3OH or [Li(C24H34O4P)(CH3OH)3]·CH3OH, have been formed in the reaction between HOOP(O-2,6-(i)Pr2C6H3)2 and LiOH in methanol. The title compound is of inter-est as it represents the first reported crystal structure of the family of lithium phosphate diesters. The {Li(CH3OH)3[O2P(O-(i)Pr2C6H3)2]} unit displays the Li atom in a slightly distorted tetra-hedral coordination environment and exhibits one intra-molecular O-H⋯O hydrogen bond between a coordinating methanol mol-ecule and the terminal non-coordinating O atom of the phosphate group. The unit is connected with two non-coordinating methanol mol-ecules through two inter-molecular O-H⋯O hydrogen bonds, and with a neighbouring unit through two other O-H⋯O inter-actions. These inter-molecular hydrogen bonds lead to the formation of infinite chains along [100]. There are no significant inter-actions between the chains.

  16. STS lithium/CF(x) battery

    NASA Technical Reports Server (NTRS)

    Gnacek, Dee

    1991-01-01

    Lithium carbon fluoride batteries are used on Space Shuttle Rocket Boosters and external tanks. These batteries have been extremely successful in terms of mission reliability with the exception of cell yield variances. The function/system and battery descriptions are given. A description is given of the battery range safety system.

  17. STS lithium/CF(x) battery

    NASA Technical Reports Server (NTRS)

    Gnacek, Dee

    1991-01-01

    Lithium carbon fluoride batteries are used on Space Shuttle Rocket Boosters and external tanks. These batteries have been extremely successful in terms of mission reliability with the exception of cell yield variances. The function/system and battery descriptions are given. A description is given of the battery range safety system.

  18. Practitioner's guide to fluoride.

    PubMed

    Scheifele, Erik; Studen-Pavlovich, Deborah; Markovic, Nina

    2002-10-01

    The current health care trend is to provide evidence-based recommendations and treatment. Many literature reviews have shown fluoride's effectiveness against caries. The current use of fluoride in the prevention of dental caries is based on community, professional, and individual strategies. Personalized fluoride regimens should include a risk analysis and a review of the patient's current fluoride exposure. The future of fluoride may be found in its slow release and retention in the oral cavity through various modalities. Because of the many uncertainties still associated with fluoride, further research is needed.

  19. Graphene Fluoride: A Stable Stoichiometric Graphene Derivative and its Chemical Conversion to Graphene

    PubMed Central

    Zbořil, Radek; Karlický, František; Bourlinos, Athanasios B; Steriotis, Theodore A; Stubos, Athanasios K; Georgakilas, Vasilios; Šafářová, Klára; Jančík, Dalibor; Trapalis, Christos; Otyepka, Michal

    2010-01-01

    Stoichoimetric graphene fluoride monolayers are obtained in a single step by the liquid-phase exfoliation of graphite fluoride with sulfolane. Comparative quantum-mechanical calculations reveal that graphene fluoride is the most thermodynamically stable of five studied hypothetical graphene derivatives; graphane, graphene fluoride, bromide, chloride, and iodide. The graphene fluoride is transformed into graphene via graphene iodide, a spontaneously decomposing intermediate. The calculated bandgaps of graphene halides vary from zero for graphene bromide to 3.1 eV for graphene fluoride. It is possible to design the electronic properties of such two-dimensional crystals. PMID:21104801

  20. Structural, morphological and electrical studies of lithium ion irradiated sodium potassium niobate single crystal grown by flux method

    NASA Astrophysics Data System (ADS)

    Saravanan, R.; Rajesh, D.; Rajasekaran, S. V.; Perumal, R.; Chitra, M.; Jayavel, R.

    2013-02-01

    Single crystals of sodium potassium niobate (K0.5Na0.5)NbO3 (KNN) were grown by flux method and crystals were irradiated with 45 MeV Li ions to modify the electrical properties. Energy of the irradiated heavy ion was lower than the threshold energy to produce columnar defect and only clusters of defect was observed. The surface morphology of the irradiated single crystals was studied using scanning electron microscope (SEM) and atomic force microscope (AFM). The results show that the surface roughness value was found to increase with increasing fluence.

  1. Structural, morphological and electrical studies of lithium ion irradiated sodium potassium niobate single crystal grown by flux method

    SciTech Connect

    Saravanan, R.; Rajesh, D.; Rajasekaran, S. V.; Perumal, R.; Chitra, M.; Jayavel, R.

    2013-02-05

    Single crystals of sodium potassium niobate (K{sub 0.5}Na{sub 0.5})NbO{sub 3} (KNN) were grown by flux method and crystals were irradiated with 45 MeV Li ions to modify the electrical properties. Energy of the irradiated heavy ion was lower than the threshold energy to produce columnar defect and only clusters of defect was observed. The surface morphology of the irradiated single crystals was studied using scanning electron microscope (SEM) and atomic force microscope (AFM). The results show that the surface roughness value was found to increase with increasing fluence.

  2. Holographic recording in a doubly doped lithium niobate crystal with two wavelengths: a blue laser diode and a green laser

    NASA Astrophysics Data System (ADS)

    Komori, Yuichi; Ishii, Yukihiro

    2010-08-01

    A doubly-doped LiNbO3 (LN) crystal has been well used as a nonvolatile two-wavelength recording material. By using two levels of the crystal, two-kind holograms can be recorded on one crystal; a hologram is recorded with a 405-nm blue laser diode (LD) for a deep Mn level, and another hologram is with a 532-nm green laser for a shallow Fe level. The recording capacity doubles. A 780-nm LD is non-volatile reconstructing source since the LD line is insensitive to both levels. Multiplexed reconstructed images are demonstrated by using a sharp angular selectivity of a volume LN crystal keeping Bragg condition with spherical reconstructions.

  3. How Does Fluoride Work?

    MedlinePlus

    ... Work? A A A There's fluoride in your toothpaste and even in your water. But how does ... enamel from plaque and sugars. By using fluoride toothpaste, for instance, everyone can enjoy some cavity protection. ...

  4. UV-visible Faraday rotators based on rare-earth fluoride single crystals: LiREF4 (RE = Tb, Dy, Ho, Er and Yb), PrF3 and CeF3.

    PubMed

    Vasyliev, Valentyn; Villora, Encarnacíon G; Nakamura, Masaru; Sugahara, Yoshiyuki; Shimamura, Kiyoshi

    2012-06-18

    High optical quality LiREF(4) (RE = Tb(3+), Dy(3+), Ho(3+), Er(3+) and Yb(3+)), PrF(3) and CeF(3) single crystals have been grown by the Czochralski technique. Their magneto-optical properties have been measured and analyzed in detail in the ultraviolet-visible wavelength region, and their figures of merit as Faraday rotators have been determined. CeF(3) presents superior properties above 300 nm, showing a figure of merit higher than that of the reference material, terbium-gallium-garnet, which is nowadays used in the visible-near infrared. PrF(3) is the best rotator for the 220-300 nm range. Towards shorter wavelength and in the vacuum ultraviolet, it is shown that the LiREF(4) crystals are unique rotators. Overall, the rare-earth fluoride single crystals studied here exhibit better properties than other materials considered so far, and therefore they have potential to cover the increasing demand for new and improved Faraday rotators in the ultraviolet-visible wavelength region.

  5. Fluoridation update 2014.

    PubMed

    Allukian, Myron; Wong, Chloe

    2014-01-01

    This year more than 4 million people living in 140 communities in Massachusetts will have the health and economic benefits of community water fluoridation. However Massachusetts is ranked only 37th in the country for fluoridation, with just 62 percent of the population on a public water supply living in fluoridated communities. Nationally, more than 210 million Americans, about 74.6 percent of the U.S. population on a community water supply live in fluoridated communities.

  6. Synthesis of complex fluorides for optical applications

    NASA Astrophysics Data System (ADS)

    Stepleton, Seth Eugene

    Large single crystals of alkali metal fluorides are desirable for many reasons. Fluoride laser crystals have a wide transmission range and on account of their low phonon energies, many efficient laser emissions have been obtained from 285 nm to 4.34 microm.1,2 Inorganic fluoride single crystals feature large bandgaps, very wide optical transmittance ranges from vacuum-ultraviolet (VUV) to mid-IR wavelength regions, lower refractive indices than those of oxides, and typically lower phonon energies (which drastically reduce multiphonon relaxation rates of rare earth ions).3 The main goal of this work was to investigate the hydrothermal synthesis of alkali metal fluorides. Melt techniques have been used thoroughly to research a variety of fluoride systems and showed many phases that were inaccessible due to incongruent melting or phase stability. The existence of these phases was shown but never characterized or grown as a crystalline material. Solution growth in supercritical water was an ideal way to attempt the synthesis of novel compounds and phases. New synthetic routes to known phases and compounds also arose as a part of this work. Optically clear colorless crystals of K2BeF4 were synthesized up to 2 mm in size, and showed no phase transitions up to 1029 K, which suggests paraelectricitys at room temperature, contradicting previous reports.4 Attempts to incorporate a rare earth ion into the fluoroberyllate lattice proved unsuccessful however reactions between beryllium fluoride and lanthanide fluorides could be exploited as a synthetic route to single crystal rare earth fluorides. Hydrothermal reactions with KF produced crystals of three different phases: hexagonal KY2F7, trigonal KYF4 and orthorhombic K2YF5. All were optically clear, colorless crystals, with the K2YF5 crystals growing the largest. This compound is beneficial due to its application as a radiation dosimeter and laser host. 5,6 Optical quality colorless crystals of RbY2F7 and CsY2F7 up to 4 mm in

  7. Preferential growth orientation of laser-patterned LiNbO{sub 3} crystals in lithium niobium silicate glass

    SciTech Connect

    Komatsu, T.; Koshiba, K.; Honma, T.

    2011-02-15

    Dots and lines consisting of LiNbO{sub 3} crystals are patterned on the surface of 1CuO-40Li{sub 2}O-32Nb{sub 2}O{sub 5}-28SiO{sub 2} (mole ratio) glass by irradiations of continuous-wave Nd:YAG laser (wavelength: {lambda}=1064 nm), diode laser ({lambda}=795 nm), and Yb:YVO{sub 4} fiber laser ({lambda}=1080 nm), and the feature of laser-patterned LiNbO{sub 3} crystal growth is examined from linearly polarized micro-Raman scattering spectrum measurements. LiNbO{sub 3} crystals with the c-axis orientation are formed at the edge parts of the surface and cross-section of dots. The growth direction of an LiNbO{sub 3} along the laser scanning direction is the c-axis. It is proposed that the profile of the temperature distribution in the laser-irradiated region and its change along laser scanning would be one of the most important conditions for the patterning of crystals with a preferential growth orientation. Laser irradiation giving a narrow width is also proposed to be one of the important factors for the patterning of LiNbO{sub 3} crystal lines with homogeneous surface morphologies. -- Graphical abstract: Polarized optical microscope observations for the surface and cross-section of the dot obtained by LD laser ({lambda}=795 nm) irradiations of P=1.4 W and t=20 s in Cu-LNS glass. Schematic model for the orientation of LiNbO{sub 3} crystals at the edge parts of the surface and cross-section of the dot is also shown. Display Omitted Research highlights: > Dots and lines with LiNbO{sub 3} crystals are patterned on the glass surface by laser irradiations. > LiNbO{sub 3} crystals with the c-axis orientation are formed at the edge parts of the surface and cross-section of dots. > The profile of the temperature distribution in the laser-irradiated region is one of the most important conditions for the patterning of highly oriented crystals.

  8. Solvothermal indium fluoride chemistry: Syntheses and crystal structures of K{sub 5}In{sub 3}F{sub 14}, beta-(NH{sub 4}){sub 3}InF{sub 6} and [NH{sub 4}]{sub 3}[C{sub 6}H{sub 21}N{sub 4}]{sub 2}[In{sub 4}F{sub 21}

    SciTech Connect

    Jayasundera, Anil C.A.; Goff, Richard J.; Li Yang; Finch, Adrian A.; Lightfoot, Philip

    2010-02-15

    The solvothermal syntheses and crystal structures of three indium fluorides are presented. K{sub 5}In{sub 3}F{sub 14} (1) and beta-(NH{sub 4}){sub 3}InF{sub 6} (2) are variants on known inorganic structure types chiolite and cryolite, respectively, with the latter exhibiting a complex and apparently novel structural distortion. [NH{sub 4}]{sub 3}[C{sub 6}H{sub 21}N{sub 4}]{sub 2}[In{sub 4}F{sub 21}] (3) represents a new hybrid composition displaying a unique trimeric metal fluoride building unit. - Graphical abstract: Solvothermal synthesis has been used to prepare three indium fluorides, including a novel hybrid material containing a unique [In{sub 3}F{sub 15}] trimer templated by tren.

  9. Lithium Ion Mobility in Lithium Phosphidosilicates: Crystal Structure, (7) Li, (29) Si, and (31) P MAS NMR Spectroscopy, and Impedance Spectroscopy of Li8 SiP4 and Li2 SiP2.

    PubMed

    Toffoletti, Lorenzo; Kirchhain, Holger; Landesfeind, Johannes; Klein, Wilhelm; van Wüllen, Leo; Gasteiger, Hubert A; Fässler, Thomas F

    2016-12-05

    The need to improve electrodes and Li-ion conducting materials for rechargeable all-solid-state batteries has drawn enhanced attention to the investigation of lithium-rich compounds. The study of the ternary system Li-Si-P revealed a series of new compounds, two of which, Li8 SiP4 and Li2 SiP2 , are presented. Both phases represent members of a new family of Li ion conductors that display Li ion conductivity in the range from 1.15(7)×10(-6) Scm(-1) at 0 °C to 1.2(2)×10(-4) Scm(-1) at 75 °C (Li8 SiP4 ) and from 6.1(7)×10(-8) Scm(-1) at 0 °C to 6(1)×10(-6) Scm(-1) at 75 °C (Li2 SiP2 ), as determined by impedance measurements. Temperature-dependent solid-state (7) Li NMR spectroscopy revealed low activation energies of about 36 kJ mol(-1) for Li8 SiP4 and about 47 kJ mol(-1) for Li2 SiP2 . Both compounds were structurally characterized by X-ray diffraction analysis (single crystal and powder methods) and by (7) Li, (29) Si, and (31) P MAS NMR spectroscopy. Both phases consist of tetrahedral SiP4 anions and Li counterions. Li8 SiP4 contains isolated SiP4 units surrounded by Li atoms, while Li2 SiP2 comprises a three-dimensional network based on corner-sharing SiP4 tetrahedra, with the Li ions located in cavities and channels. © 2016 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. Structural and photoluminescence studies on europium-doped lithium tetraborate (Eu:Li2B4O7) single crystal grown by microtube Czochralski (μT-Cz) technique

    NASA Astrophysics Data System (ADS)

    A, Kumaresh; R, Arun Kumar; N, Ravikumar; U, Madhusoodanan; B, S. Panigrahi; K, Marimuthu; M, Anuradha

    2016-05-01

    Rare earth europium (Eu3+)-doped lithium tetraborate (Eu:Li2B4O7) crystal is grown from its stoichiometric melt by microtube Czochralski pulling technique (μT-Cz) for the first time. The grown crystals are subjected to powder x-ray diffraction (PXRD) analysis which reveals the tetragonal crystal structure of the crystals. UV-vis-NIR spectral analysis is carried out to study the optical characteristics of the grown crystals. The crystal is transparent in the entire visible region, and the lower cutoff is observed to be at 304 nm. The existence of BO3 and BO4 bonding structure and the molecular associations are analyzed by Fourier transform infrared (FTIR) spectroscopy. The results of excitation and emission-photoluminescence spectra of europium ion incorporated in lithium tetraborate (LTB) single crystal reveal that the observations of peaks at 258, 297, and 318 nm in the excitation spectra and peaks at 579, 591, 597, 613, and 651 nm are observed in the emission spectra. The chromaticity coordinates are calculated from the emission spectra, and the emission intensity of the grown crystal is characterized through a CIE 1931 (Commission International d’Eclairage) color chromaticity diagram. Project supported by the Department of Science and Technology-Science and Engineering Research Board (Grant No. SR/S2/LOP-0012/2011), the Government of India for Awarding Major Research Project, the University Grants Commission-Department of Atomic Research-Consortium for Scientific Research (Grant No. CSR-KN/CSR-63/2014-2015/503), and the Kalpakkam and Indore, India.

  11. Characterization of pore and crystal structure of synthesized LiBOB with varying quality of raw materials as electrolyte for lithium-ion battery

    NASA Astrophysics Data System (ADS)

    Lestariningsih, Titik; Ratri, Christin Rina; Wigayati, Etty Marty; Sabrina, Qolby

    2016-02-01

    Characterization of pore structure and crystal structure of the LiB(C2O4)2H2O or LIBOB compound has been performed in this study. These recent years, research regarding LiBOB electrolyte salt have been performed using analytical-grade raw materials, therefore this research was aimed to synthesized LiBOB electrolyte salt using the cheaper and abundant technical-grade raw materials. Lithium hydroxide (LiOH), oxalic acid dihydrate (H2C2O4.2H2O), and boric acid (H3BO3) both in technical-grade and analytical-grade quality were used as raw materials for the synthesis of LiBOB. Crystal structure characterization results of synthesized LiBOB from both technical-grade and analytical-grade raw materials have shown the existence of LiBOB and LiBOB hydrate phase with orthorombic structure. These results were also confirmed by FT-IR analysis, which showed the functional groups of LiBOB compounds. SEM analysis results showed that synthesized LiBOB has spherical structure, while commercial LiBOB has cylindrical structure. Synthesized LiBOB has a similar pore size of commercial LiBOB, i.e. 19 nm (mesoporous material). Surface area of synthesized LiBOB from analytical-grade raw materials and technical-grade materials as well as commercial LIBOB were 88.556 m2/g, 41.524 m2/g, and 108.776 m2/g, respectively. EIS analysis results showed that synthesized LiBOB from technical-grade raw materials has lower conductivity than synthesized LiBOB from analytical-grade raw materials.

  12. Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic)

    SciTech Connect

    Rozhdestvenskaya, I. V. Bronzova, Yu. M.; Frank-Kamenetskaya, O. V.; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I.

    2008-03-15

    The crystal structure of a natural calcium-lithium-aluminum tourmaline, which has the unique composition (Ca{sub 0.62}Na{sub 0.32}{open_square}{sub 0.06})(Al{sub 1.08}Li{sub 0.99}Fe{sub 0.66}{sup 2+} Mg{sub 0.24}Ti{sub 0.03})Al{sub 6}[Si{sub 6}O{sub 18}](BO{sub 3}){sub 3}(OH{sub 2.28}O{sub 0.72}) . (F{sub 0.84}O{sub 0.16}), is refined (R = 0.019, R{sub w} = 0.022, S = 1.47). It is found that the O(1)(W) site is split into two sites, O(1) and O(11), which are incompletely occupied by fluorine and oxygen anions, respectively, and that the O(3)(V) site contains bivalent oxygen anions. The solid solution studied is close in composition to the liddicoatite mineral species and differs from the latter one by the Li: Al ratio in the Y octahedra and the presence of bivalent oxygen anions in the O(3) site. The tourmaline studied differs from the hypothetical oxyliddicoatite by the population of the O(1)(W) site by fluorine and accommodation of additional oxygen anions in the O(3)(V) site.

  13. Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic)

    SciTech Connect

    Rozhdestvenskaya, I. V. Bronzova, Yu. M.; Frank-Kamenetskaya, O. V.; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I.

    2008-03-15

    The crystal structure of a natural calcium-lithium-aluminum tourmaline, which has the unique composition (Ca{sub 0.62}Na{sub 0.32}{open_square}{sub 0.06})(Al{sub 1.08}Li{sub 0.99}Fe{sub 0.66}{sup 2+} Mg{sub 0.24}Ti{sub 0.03})Al{sub 6}[Si{sub 6}O{sub 18}](BO{sub 3}){sub 3}(OH{sub 2.28}O{sub 0.72}) {center_dot} (F{sub 0.84}O{sub 0.16}), is refined (R = 0.019, R{sub w} = 0.022, S = 1.47). It is found that the O(1)(W) site is split into two sites, O(1) and O(11), which are incompletely occupied by fluorine and oxygen anions, respectively, and that the O(3)(V) site contains bivalent oxygen anions. The solid solution studied is close in composition to the liddicoatite mineral species and differs from the latter one by the Li: Al ratio in the Y octahedra and the presence of bivalent oxygen anions in the O(3) site. The tourmaline studied differs from the hypothetical oxyliddicoatite by the population of the O(1)(W) site by fluorine and accommodation of additional oxygen anions in the O(3)(V) site.

  14. Lithium battery technology

    SciTech Connect

    Venkatasetty, A.V.

    1984-01-01

    This book presents papers on the use of lithium in electric batteries. Topics considered include solvents for lithium battery technology, transport properties and structure of nonaqueous electrolyte solutions, primary lithium batteries, lithium sulfur dioxide batteries, lithium oxyhalide batteries, medical batteries, ambient-temperature rechargeable lithium cells, high-temperature lithium batteries, and lithium ion-conducting solid electrolytes.

  15. Containerless processing of fluoride glass

    NASA Technical Reports Server (NTRS)

    Doremus, Robert H.

    1990-01-01

    Ground-based experiments on glass formation, crystallization, surface tension, vaporization, and chemical durability of a zirconium-barium-lanthanum (ZBL) fluoride glass are summarized. In a container large, columnar grains grew out from the container-glass interface during cooling. The main crystalline phase was alpha BaZrF6. A ZBL glass sphere was levitated acoustically during Shuttle flight STS-11. The glass was melted and then cooled while being levitated (containerless). Crystallization in the recovered sample was very fine and mainly beta BaZr2F10, showing the influence of the container on the nucleation and microstructure of crystallization in the glass. Glass formation should be easier for a containerless glass than in a container.

  16. Containerless processing of fluoride glass

    NASA Technical Reports Server (NTRS)

    Doremus, Robert H.

    1990-01-01

    Ground-based experiments on glass formation, crystallization, surface tension, vaporization, and chemical durability of a zirconium-barium-lanthanum (ZBL) fluoride glass are summarized. In a container large, columnar grains grew out from the container-glass interface during cooling. The main crystalline phase was alpha BaZrF6. A ZBL glass sphere was levitated acoustically during Shuttle flight STS-11. The glass was melted and then cooled while being levitated (containerless). Crystallization in the recovered sample was very fine and mainly beta BaZr2F10, showing the influence of the container on the nucleation and microstructure of crystallization in the glass. Glass formation should be easier for a containerless glass than in a container.

  17. The Effect of Crystal Face of Fe2O3 on the Electrochemical Performance for Lithium-ion Batteries

    PubMed Central

    Chen, Minmin; Zhao, Enyue; Yan, Qingbo; Hu, Zhongbo; Xiao, Xiaoling; Chen, Dongfeng

    2016-01-01

    Fe2O3 nanorods exposing (001) and (010) plane as well as Fe2O3 nanosheets exposing (001) plane have been successfully synthesized. Fe2O3 nanosheets exhibit better cycle performance and rate capabilities than that of Fe2O3 nanorods. The discharge capacity of Fe2O3 nanosheets can stabilize at 865 mAh/g at the rate of 0.2 C (1C = 1000 mA/g) and 570 mAh/g at the rate of 1.2 C after 80 cycles, which increased by 90% and 79% compared with 456 mAh/g and 318 mAh/g of Fe2O3 nanorods. In comparison with (010) plane, the (001) plane of hematite possesses larger packing density of Fe3+ and O2−, which is responsible for the superior electrochemical performances of Fe2O3 nanosheets than that of Fe2O3 nanorods. In addition, potentiostatic intermittent titration (PITT) results show the diffusion coefficients of Li+ (DLi) of Fe2O3 nanosheets is higher than that of Fe2O3 nanorods. The higher diffusion coefficients of Li+ is favorable for the excellent lithium-storage capabilities and rate capability of Fe2O3 nanosheets. Inspired by our results, we can design and synthesize Fe2O3 or other electrodes with high performances according to their structure features in future. PMID:27380891

  18. The Effect of Crystal Face of Fe2O3 on the Electrochemical Performance for Lithium-ion Batteries

    NASA Astrophysics Data System (ADS)

    Chen, Minmin; Zhao, Enyue; Yan, Qingbo; Hu, Zhongbo; Xiao, Xiaoling; Chen, Dongfeng

    2016-07-01

    Fe2O3 nanorods exposing (001) and (010) plane as well as Fe2O3 nanosheets exposing (001) plane have been successfully synthesized. Fe2O3 nanosheets exhibit better cycle performance and rate capabilities than that of Fe2O3 nanorods. The discharge capacity of Fe2O3 nanosheets can stabilize at 865 mAh/g at the rate of 0.2 C (1C = 1000 mA/g) and 570 mAh/g at the rate of 1.2 C after 80 cycles, which increased by 90% and 79% compared with 456 mAh/g and 318 mAh/g of Fe2O3 nanorods. In comparison with (010) plane, the (001) plane of hematite possesses larger packing density of Fe3+ and O2‑, which is responsible for the superior electrochemical performances of Fe2O3 nanosheets than that of Fe2O3 nanorods. In addition, potentiostatic intermittent titration (PITT) results show the diffusion coefficients of Li+ (DLi) of Fe2O3 nanosheets is higher than that of Fe2O3 nanorods. The higher diffusion coefficients of Li+ is favorable for the excellent lithium-storage capabilities and rate capability of Fe2O3 nanosheets. Inspired by our results, we can design and synthesize Fe2O3 or other electrodes with high performances according to their structure features in future.

  19. The Effect of Crystal Face of Fe2O3 on the Electrochemical Performance for Lithium-ion Batteries.

    PubMed

    Chen, Minmin; Zhao, Enyue; Yan, Qingbo; Hu, Zhongbo; Xiao, Xiaoling; Chen, Dongfeng

    2016-07-06

    Fe2O3 nanorods exposing (001) and (010) plane as well as Fe2O3 nanosheets exposing (001) plane have been successfully synthesized. Fe2O3 nanosheets exhibit better cycle performance and rate capabilities than that of Fe2O3 nanorods. The discharge capacity of Fe2O3 nanosheets can stabilize at 865 mAh/g at the rate of 0.2 C (1C = 1000 mA/g) and 570 mAh/g at the rate of 1.2 C after 80 cycles, which increased by 90% and 79% compared with 456 mAh/g and 318 mAh/g of Fe2O3 nanorods. In comparison with (010) plane, the (001) plane of hematite possesses larger packing density of Fe(3+) and O(2-), which is responsible for the superior electrochemical performances of Fe2O3 nanosheets than that of Fe2O3 nanorods. In addition, potentiostatic intermittent titration (PITT) results show the diffusion coefficients of Li(+) (DLi) of Fe2O3 nanosheets is higher than that of Fe2O3 nanorods. The higher diffusion coefficients of Li(+) is favorable for the excellent lithium-storage capabilities and rate capability of Fe2O3 nanosheets. Inspired by our results, we can design and synthesize Fe2O3 or other electrodes with high performances according to their structure features in future.

  20. Mild hydrothermal crystal growth of new uranium(IV) fluorides, Na3.13Mg1.43U6F30 and Na2.50Mn1.75U6F30: Structures, optical and magnetic properties

    NASA Astrophysics Data System (ADS)

    Yeon, Jeongho; Smith, Mark D.; Tapp, Joshua; Möller, Angela; zur Loye, Hans-Conrad

    2016-04-01

    Two new uranium(IV) fluorides, Na3.13Mg1.43U6F30 (1) and Na2.50Mn1.75U6F30 (2), were synthesized through an in situ mild hydrothermal route, and were structurally characterized by single crystal X-ray diffraction. The compounds exhibit complex crystal structures composed of corner- or edge-shared UF9 and MF6 (M=Mg, Mn) polyhedra, forming hexagonal channels in the three-dimensional framework, in which ordered or disordered divalent metal and sodium atoms reside. The large hexagonal voids contain the nearly regular M(II)F6 octahedra and sodium ions, whereas the small hexagonal cavities include M(II) and sodium ions on a mixed-occupied site. Magnetic susceptibility measurements yielded effective magnetic moments of 8.36 and 11.6 μB for 1 and 2, respectively, confirming the presence and oxidation states of U(IV) and Mn(II). The large negative Weiss constants indicate the spin gap between a triplet and a singlet state in the U(IV). Magnetization data as a function of applied fields revealed that 2 exhibits paramagnetic behavior due to the nonmagnetic singlet ground state of U(IV) at low temperature. UV-vis diffuse reflectance and X-ray photoelectron spectroscopy data were also analyzed.