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Sample records for crystal field effects

  1. Crystal-field effects in fluoride crystals for optical refrigeration

    SciTech Connect

    Hehlen, Markus P

    2010-01-01

    thermal energy from the solid and carries it away as high-entropy light, thereby cooling the material. In the ideal case, the respective laser-cooling power is given by the pump wavelength ({lambda}{sub p}), the mean fluorescence wavelength ({bar {lambda}}{sub L}), and the absorption coefficient (a{sub r}) of the pumped transition. These quantities are solely determined by crystal field interactions. On one hand, a large crystal-field splitting offers a favorably large difference of {lambda}{sub p} - {bar {lambda}}{sub L} and thus a high cooling efficiency {eta}{sub cool} = ({lambda}{sub p} - {bar {lambda}}{sub L})/{bar {lambda}}{sub L}. On the other hand, a small crystal-field splitting offers a high thermal population (n{sub i}) of the initial state of the pumped transition, giving a high pump absorption coefficient and thus high laser cooling power, particularly at low temperatures. A quantitative description of crystal-field interactions is therefore critical to the understanding and optimization of optical refrigeration. In the case of Yb3+ as the laser cooling ion, however, development of a crystal-field model is met with substantial difficulties. First, Yb3+ has only two 4/multiplets, {sup 2}F{sub 7/2} and {sup 2}F{sub 5/2}, which lead to at most 7 crystal-field levels. This makes it difficult, and in some cases impossible, to evaluate the crystal-field Hamiltonian, which has at least 4 parameters for any Yb3+ point symmety lower than cubic. Second, {sup 2}F{sub 7/2}{leftrightarrow}{sup 2}F{sub 5/2} transitions exhibit an exceptionally strong electron-phonon coupling compared to 4f transitions of other rare earths. This makes it difficult to distinguish electronic from vibronic transitions in the absorption and luminescence spectra and to reliably identify the crystal-field levels. Yb3+ crystal-field splittings reported in the literature should thus generally be viewed with caution. This paper explores the effects of crystal-field interactions on the laser cooling

  2. Oxidation and crystal field effects in uranium

    SciTech Connect

    Tobin, J. G.; Booth, C. H.; Shuh, D. K.; van der Laan, G.; Sokaras, D.; Weng, T. -C.; Yu, S. W.; Bagus, P. S.; Tyliszczak, T.; Nordlund, D.

    2015-07-06

    An extensive investigation of oxidation in uranium has been pursued. This includes the utilization of soft x-ray absorption spectroscopy, hard x-ray absorption near-edge structure, resonant (hard) x-ray emission spectroscopy, cluster calculations, and a branching ratio analysis founded on atomic theory. The samples utilized were uranium dioxide (UO2), uranium trioxide (UO3), and uranium tetrafluoride (UF4). As a result, a discussion of the role of non-spherical perturbations, i.e., crystal or ligand field effects, will be presented.

  3. Oxidation and crystal field effects in uranium

    NASA Astrophysics Data System (ADS)

    Tobin, J. G.; Yu, S.-W.; Booth, C. H.; Tyliszczak, T.; Shuh, D. K.; van der Laan, G.; Sokaras, D.; Nordlund, D.; Weng, T.-C.; Bagus, P. S.

    2015-07-01

    An extensive investigation of oxidation in uranium has been pursued. This includes the utilization of soft x-ray absorption spectroscopy, hard x-ray absorption near-edge structure, resonant (hard) x-ray emission spectroscopy, cluster calculations, and a branching ratio analysis founded on atomic theory. The samples utilized were uranium dioxide (U O2) , uranium trioxide (U O3) , and uranium tetrafluoride (U F4) . A discussion of the role of nonspherical perturbations, i.e., crystal or ligand field effects, will be presented.

  4. Effects of magnetic fields on dissolution of arthritis causing crystals

    NASA Astrophysics Data System (ADS)

    Takeuchi, Y.; Iwasaka, M.

    2015-05-01

    The number of gout patients has rapidly increased because of excess alcohol and salt intake. The agent responsible for gout is the monosodium urate (MSU) crystal. MSU crystals are found in blood and consist of uric acid and sodium. As a substitute for drug dosing or excessive water intake, physical stimulation by magnetic fields represents a new medical treatment for gout. In this study, we investigated the effects of a magnetic field on the dissolution of a MSU crystal suspension. The white MSU crystal suspension was dissolved in an alkaline solution. We measured the light transmission of the MSU crystal suspension by a transmitted light measuring system. The magnetic field was generated by a horizontal electromagnet (maximum field strength was 500 mT). The MSU crystal suspension that dissolved during the application of a magnetic field of 500 mT clearly had a higher dissolution rate when compared with the control sample. We postulate that the alkali solution promoted penetration upon diamagnetic rotation and this magnetic field orienting is because of the pronounced diamagnetic susceptibility anisotropy of the MSU crystal. The results indicate that magnetic fields represent an effective gout treatment approach.

  5. Electromagnetic Field Effects in Semiconductor Crystal Growth

    NASA Technical Reports Server (NTRS)

    Dulikravich, George S.

    1996-01-01

    This proposed two-year research project was to involve development of an analytical model, a numerical algorithm for its integration, and a software for the analysis of a solidification process under the influence of electric and magnetic fields in microgravity. Due to the complexity of the analytical model that was developed and its boundary conditions, only a preliminary version of the numerical algorithm was developed while the development of the software package was not completed.

  6. Reflective liquid crystal light valve with hybrid field effect mode

    NASA Technical Reports Server (NTRS)

    Boswell, Donald D. (Inventor); Grinberg, Jan (Inventor); Jacobson, Alexander D. (Inventor); Myer, Gary D. (Inventor)

    1977-01-01

    There is disclosed a high performance reflective mode liquid crystal light valve suitable for general image processing and projection and particularly suited for application to real-time coherent optical data processing. A preferred example of the device uses a CdS photoconductor, a CdTe light absorbing layer, a dielectric mirror, and a liquid crystal layer sandwiched between indium-tin-oxide transparent electrodes deposited on optical quality glass flats. The non-coherent light image is directed onto the photoconductor; this reduces the impedance of the photoconductor, thereby switching the AC voltage that is impressed across the electrodes onto the liquid crystal to activate the device. The liquid crystal is operated in a hybrid field effect mode. It utilizes the twisted nematic effect to create a dark off-state (voltage off the liquid crystal) and the optical birefringence effect to create the bright on-state. The liquid crystal thus modulates the polarization of the coherent read-out or projection light responsively to the non-coherent image. An analyzer is used to create an intensity modulated output beam.

  7. TOPICAL REVIEW: Organic field-effect transistors using single crystals

    NASA Astrophysics Data System (ADS)

    Hasegawa, Tatsuo; Takeya, Jun

    2009-04-01

    Organic field-effect transistors using small-molecule organic single crystals are developed to investigate fundamental aspects of organic thin-film transistors that have been widely studied for possible future markets for 'plastic electronics'. In reviewing the physics and chemistry of single-crystal organic field-effect transistors (SC-OFETs), the nature of intrinsic charge dynamics is elucidated for the carriers induced at the single crystal surfaces of molecular semiconductors. Materials for SC-OFETs are first reviewed with descriptions of the fabrication methods and the field-effect characteristics. In particular, a benchmark carrier mobility of 20-40 cm2 Vs-1, achieved with thin platelets of rubrene single crystals, demonstrates the significance of the SC-OFETs and clarifies material limitations for organic devices. In the latter part of this review, we discuss the physics of microscopic charge transport by using SC-OFETs at metal/semiconductor contacts and along semiconductor/insulator interfaces. Most importantly, Hall effect and electron spin resonance (ESR) measurements reveal that interface charge transport in molecular semiconductors is properly described in terms of band transport and localization by charge traps.

  8. Crystal Field Handbook

    NASA Astrophysics Data System (ADS)

    Newman, D. J.; Ng, Betty

    2007-09-01

    List of contributors; Preface; Introduction; 1. Crystal field splitting mechanisms D. J. Newman and Betty Ng; 2. Empirical crystal fields D. J. Newman and Betty Ng; 3. Fitting crystal field parameters D. J. Newman and Betty Ng; 4. Lanthanide and actinide optical spectra G. K. Liu; 5. Superposition model D. J. Newman and Betty Ng; 6. Effects of electron correlation on crystal field splitting M. F. Reid and D. J. Newman; 7. Ground state splittings in S-state ions D. J. Newman and Betty Ng; 8. Invariants and moments Y. Y. Yeung; 9. Semiclassical model K. S. Chan; 10. Transition intensities M. F. Reid; Appendix 1. Point symmetry D. J. Newman and Betty Ng; Appendix 2. QBASIC programs D. J. Newman and Betty Ng; Appendix 3. Accessible program packages Y. Y. Yeung, M. F. Reid and D. J. Newman; Appendix 4. Computer package CST Cz. Rudowicz; Bibliography; Index.

  9. Effect of an electric field on nucleation and growth of crystals

    NASA Astrophysics Data System (ADS)

    Yurov, V. M.; Guchenko, S. A.; Gyngazova, M. S.

    2016-02-01

    The effect of the electric field strength on nucleation and growth of the crystals of ammonium halides and alkali metal sulfates has been studied. The optimal electric field strength for NH4Cl and NH4Br crystals was found to be 15 kV/cm, and for NH4I, it equaled 10 kV/cm. No effect of the electric field strength on the crystal growth was found for alkali metal sulfates. This difference is analyzed in terms of the crystal growth thermodynamics. In case, when the electric field is small and the Gibbs energy is of a significant value, the influence of the electric field at the crystal growth is negligible. A method to estimate the critical radius of homogeneous nucleation of the crystal is suggested.

  10. Spontaneous emission control of quantum dots embedded in photonic crystals: Effects of external fields and dimension

    NASA Astrophysics Data System (ADS)

    Vaseghi, B.; Hashemi, H.

    2016-06-01

    In this paper simultaneous effects of external electric and magnetic fields and quantum confinement on the radiation properties of spherical quantum dot embedded in a photonic crystal are investigated. Under the influence of photonic band-gap, effects of external static fields and dot dimension on the amplitude and spectrum of different radiation fields emitted by the quantum dot are studied. Our results show the considerable effects of external fields and quantum confinement on the spontaneous emission of the system.

  11. Electronic transitions, crystal field effects and phonons in UO 2

    NASA Astrophysics Data System (ADS)

    Schoenes, J.

    1980-08-01

    An extensive optical study of the 5f magnetic semiconductor UO 2 is presented. The experimental data include near normal incidence reflectivity measurements from 0.0025 to 13 eV, absorption and Faraday rotation measurements as function of temperature and of magnetic fields up to 100 kOe and photoemission results. From the data in the fundamental absorption region an energy level scheme is derived. This level scheme differs markedly from an earlier model but it is quantitatively supported by a calculation using the thermochemical Haber-Born process and also by cluster calculations. The localized nature of the 5f electrons is demonstrated. The absorption edge at 2 eV shows an abrupt shift to lower energies at the first order phase transition of UO 2 to the antiferromagnetic state. This shift is shown to be larger than expected from the lattice contraction indicating a magnetic order induced contribution to the total red shift. Below the absorption edge, intra-5f transitions and multiphonon excitations are reported, showing striking order induced effects at and below TN = 30.8 K. New results are presented for ε st, ε opt, ω TO and ω LO which fulfill the Lyddane-Sachs-Teller relation.

  12. Monitoring of hydroxyapatite crystal formation using field-effect transistor

    NASA Astrophysics Data System (ADS)

    Kajisa, Taira; Sakata, Toshiya

    2016-04-01

    The biomineralization process of hydroxyapatite (HAp) in simulated body fluid (SBF) was monitored in realtime using extended-gate FETs whose gate electrode was modified with a variety of alkanethiol self-assembled monolayers (SAMs). It was found that the gate surface potential of the carboxyl- and amino-group-terminated SAM-coated gate FET was increased in SBF as HAp crystals grew on the gate surface. Moreover, in the carboxyl-group-terminated SAM-coated gate FET, the rate of increase and the shift of gate surface potential of the FET were found to depend on the concentration of calcium ions in the SBF. It was concluded that the process of HAp crystallization at a SAM-modified surface can be detected using FETs. Thus, a FET device that enables the easy detection of ionic charges in a real-time and label-free manner, will be useful for evaluating biomaterials based on biomineralization such as those in the bone regeneration process.

  13. Determination of optimal ionic liquid for organic single-crystal field-effect transistors

    NASA Astrophysics Data System (ADS)

    Ono, S.; Miwa, K.; Seki, S.

    2016-02-01

    We investigate organic single-crystal field-effect transistors with various ionic liquids as gate dielectric. We find that the mobility of the field-effect transistors for both p-type and n-type organic semiconductors increases with decreasing total capacitance of the ionic liquid. However, it does not depend on the ion species at the interface between the organic semiconductor and the ionic liquid. By choosing an appropriate ionic liquid, a high carrier mobility of 12.4 cm2/V s in rubrene single crystals (p-type) and 0.13 cm2/V s in 7.7.8.8-Tetracyanoquinodimethane single crystals (n-type) are achieved. This study clarifies the influence of ionic liquids on the device performance of organic field-effect transistors and shows a way to maximize carrier mobility at the solid/liquid interface.

  14. Controlled deposition or organic semiconductor single crystals and its application in field-effect transistors

    NASA Astrophysics Data System (ADS)

    Liu, Shuhong

    The search for low-cost, large area, flexible devices has led to a remarkable increase in the research and development of organic semiconductors. Single-crystal organic field-effect transistors (OFETs) are ideal device structures for studying fundamental science associated with charge transport in organic materials and have demonstrated high mobility and outstanding electrical characteristics. For example, an exceptionally high carrier mobility of 20 cm2/Vs has been demonstrated for rubrene single crystal field effect transistors. However, it remains a technical challenge to integrate single-crystal devices into practical electronic applications. A key difficulty is that organic single-crystal devices are usually fabricated one device at a time by handpicking a single crystal and placing it onto the device substrate. This makes it impossible to mass-produce at high density with reasonable throughput. Therefore, there is a great need for a high-throughput method for depositing large arrays of organic semiconductor single crystals directly onto device structures. In this dissertation, I develop several approaches towards realizing this goal. The first approach is a solution-processing technique, which relies on solvent wetting and de-wetting on substrates with patterned wettability to selectively direct the deposition or removal of organic crystals. The assembly of different organic crystals over centimeter-squared areas on Au, SiO 2 and flexible plastic substrates is demonstrated. By designing line features on the substrate, alignment of needle-like crystals is also achieved. As a demonstration of the potential application of this approach, arrays of organic single crystal FETs are fabricated by patterning organic single crystals directly onto and between transistor source and drain electrodes. Besides organic single crystals, this self-assembly strategy is also applicable for patterning other objects such as metallic nanowires. In the second technique, organic

  15. Electric field effects on phase transitions in the 8CB liquid crystal doped with ferroelectric nanoparticles

    NASA Astrophysics Data System (ADS)

    Lin, Y.; Daoudi, A.; Segovia-Mera, A.; Dubois, F.; Legrand, C.; Douali, R.

    2016-06-01

    The influence of a low ac electric field on phase transitions is discussed in the case of a nematic liquid crystal 4 -n -octyl-4 '-cyanobiphenyl (8CB) doped with Sn2P2S6 ferroelectric nanoparticles. The phase-transition temperatures obtained from temperature-dependent dielectric measurements were higher than those determined by the calorimetric method. This difference is explained by the presence of the measuring electric field which induces two effects. The first one is the amplification of the interactions between the nanoparticle polarization and the liquid-crystal order parameter. The second one is the field-induced disaggregation or aggregation process at high nanoparticle concentrations.

  16. Diffraction and fringing field effects in small pixel liquid crystal devices with homeotropic alignment

    NASA Astrophysics Data System (ADS)

    Vanbrabant, Pieter J. M.; Beeckman, Jeroen; Neyts, Kristiaan; Willman, Eero; Fernandez, F. Anibal

    2010-10-01

    Reducing the pixel dimensions of liquid crystal microdisplays in search of high resolution has a fundamental impact on their electro-optic behavior. The liquid crystal director orientation becomes distorted due to fringing fields and diffraction effects influence the optical characteristics of the device once the structure features approach the wavelength of the incident light. Three-dimensional finite element simulation of the liquid crystal dynamics with a variable order approach is combined with a full-vector beam propagation analysis to investigate how elasticity and diffraction limit the resolution as a function of the pixel size for transmissive and reflective architectures with vertical liquid crystal alignment. The key liquid crystal properties are considered and the importance of materials with high birefringence is confirmed for small pixel devices as these improve the contrast for a fixed pixel size.

  17. Metal electrode dependent field effect transistors made of lanthanide ion-doped DNA crystals

    NASA Astrophysics Data System (ADS)

    Reddy Dugasani, Sreekantha; Hwang, Taehyun; Kim, Jang Ah; Gnapareddy, Bramaramba; Kim, Taesung; Park, Sung Ha

    2016-03-01

    We fabricated lanthanide ion (Ln3+, e.g. Dy3+, Er3+, Eu3+, and Gd3+)-doped self-assembled double-crossover (DX) DNA crystals grown on the surface of field effect transistors (FETs) containing either a Cr, Au, or Ni electrode. Here we demonstrate the metal electrode dependent FET characteristics as a function of various Ln3+. The drain-source current (I ds), controlled by the drain-source voltage (V ds) of Ln3+-doped DX DNA crystals with a Cr electrode on an FET, changed significantly under various gate voltages (V g) due to the relative closeness of the work function of Cr to the energy band gap of Ln3+-DNA crystals compared to those of Au and Ni. For Ln3+-DNA crystals on an FET with either a Cr or Ni electrode at a fixed V ds, I ds decreased with increasing V g ranging from  -2 to 0 V and from 0 to  +3 V in the positive and negative regions, respectively. By contrast, I ds for Ln3+-DNA crystals on an FET with Au decreased with increasing V g in only the positive region due to the greater electronegativity of Au. Furthermore, Ln3+-DNA crystals on an FET exhibited behaviour sensitive to V g due to the appreciable charge carriers generated from Ln3+. Finally, we address the resistivity and the mobility of Ln3+-DNA crystals on an FET with different metal electrodes obtained from I ds-V ds and I ds-V g curves. The resistivities of Ln3+-DNA crystals on FETs with Cr and Au electrodes were smaller than those of pristine DNA crystals on an FET, and the mobility of Ln3+-DNA crystals on an FET with Cr was relatively higher than that associated with other electrodes.

  18. Crystal field effect on EPR and optical absorption properties of natural green zoisite.

    PubMed

    Javier-Ccallata, Henry; Watanabe, Shigueo

    2013-03-01

    In this study the electron paramagnetic resonance (EPR) and optical absorption (OA) of natural crystal of zoisite were investigated after γ ((60)Co) irradiation and high temperature annealing. EPR measurements show that the zoisite from Tefilo Otoni MG Brazil contain Cr(3+), Fe(3+) and Mn(2+) ions and occupy distorted Al(3+) octahedral and tetrahedral sites which are subjected to the action of a strong crystal field in axial direction. Absorption bands which in principle give rise to sets of EPR lines between 500 and 2500 G were found using the deconvolution method. The application of high doses of gamma ray and high temperature annealing has shown no significant effects on EPR and OA spectra. Spin-allowed, spin-forbidden and crystal field parameters were calculated for 3d(3) configuration and interpreted using the spin Hamiltonian formalism containing axial and rhombic terms in low symmetries. PMID:23291113

  19. Electric field effects in nematic liquid crystals doped with carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Cîrtoaje, Cristina; Petrescu, Emil; Moţoc, Cornelia

    2013-12-01

    The aim of this paper was to investigate electric field induced effects in mixtures of nematic liquid crystals (NLCs) with positive electric anisotropies (MCL 6601 Merck) with carbon nanotubes (MWCNT from Aldrich). In planar alignment, the current-electric field dependence and the current-temperature dependence were explained by assuming a Poole-Frenkel effect (i.e. a tunnelling mechanism) and good agreement with the experimental data was obtained. Within this high field range it resulted that in planar aligned NLC-CNTs mixture the conductivity decreases when the temperature was increased. In homeotropic aligned mixture, the conduction mechanism is similar to the one occurring in a semiconductor: the conductivity increases when increasing temperature. This happens because in thin liquid crystal cells there is a possibility to realize an inner contact between nanotubes and electrodes so the mixture behaves like a semiconductor.

  20. Paramagnetic Meissner effect at high fields in YCaBaCuO single crystal

    NASA Astrophysics Data System (ADS)

    Dias, F. T.; Vieira, V. N.; Falck, A. L.; da Silva, D. L.; Pureur, P.; Schaf, J.

    2012-12-01

    We report on systematic magnetization experiments in an Y1-xCaxBa2Cu3O7-δ (x = 0.25 at%) single crystal. The magnetization experiments were made using a superconducting quantum interference device magnetometer (SQUID). Magnetic moments were measured as functions of the temperature according to the zero-field cooling (ZFC), field-cooled cooling (FCC), and field-cooled warming (FCW) prescriptions. The time-dependence of the FC magnetization at fixed magnetic fields was studied. Magnetic fields up to 50 kOe were applied and a paramagnetic response related to the superconducting state was observed when strong enough fields were applied parallel to the c axis. The magnitude of the high field paramagnetic moment (HFPME) increases when the field is augmented. The effect shows strong and anomalous time dependence, such that the paramagnetic moment increases as a function of the time. An YBa2Cu3O7-δ single crystal exhibiting the same effect was used for comparison. We discuss our results in terms of the flux compression scenario into the sample modulated by Ca concentration.

  1. Resistive memory effects in BiFeO3 single crystals controlled by transverse electric fields

    NASA Astrophysics Data System (ADS)

    Kawachi, S.; Kuroe, H.; Ito, T.; Miyake, A.; Tokunaga, M.

    2016-04-01

    The effects of electric fields perpendicular to the c-axis of the trigonal cell in single crystals of BiFeO3 are investigated through magnetization and resistance measurements. Magnetization and resistance exhibit hysteretic changes under applied electric fields, which can be ascribed to the reorientation of the magnetoelectric domains. Samples are repetitively switched between high- and low-resistance states by changing the polarity of the applied electric fields over 20 000 cycles at room temperature. These results demonstrate the potential of BiFeO3 for use in non-volatile memory devices.

  2. Effect of vertical magnetic field on convection and segregation in vertical Bridgman crystal growth

    NASA Technical Reports Server (NTRS)

    Kim, Do Hyun; Adornato, Peter M.; Brown, Robert A.

    1988-01-01

    A previous finite-element analysis of vertical Bridgman growth for dilute and nondilute alloys is extended to include the effect of a vertically-aligned magnetic field in the limit of zero magnetic Reynolds number. Calculations are presented for growth of a dilute gallium-germanium alloy in a vertically stabilized Bridgman-Stockbarger system and in a furnace with a uniform temperature gradient imposed along the ampoule. Steady cellular convection driven by radial temperature gradients causes good axial and radial mixing in both systems without a magnetic field. A weak magnetic field decreases the intensity of convection and the effectiveness of solute mixing. The radial nonuniformity is greatest for an intermediate field strength. Stronger fields suppress flow recirculation completely, and lead to uniform solute segregation across the crystal and to diffusion-controlled axial segregation.

  3. The Effects of a Magnetic Field on the Crystallization of a Fluorozirconate Glass

    NASA Technical Reports Server (NTRS)

    Tucker, Dennis S.; Lapointe, Michael R.; Jia, Zhiyong

    2006-01-01

    An axial magnetic field of 0.1T was applied to ZrF4-BaF2-LaF3-AlF3-NaF (ZBLAN) fibers during heating to the glass crystallization temperature. Scanning electron microscopy and x-ray diffraction were used to identify crystal phases. It was shown that fibers exposed to the magnetic field did not crystallize while fibers not exposed to the field did crystallize. A hypothesis based on magnetic work was proposed to explain the results and tested by measuring the magnetic susceptibilities of the glass and crystal.

  4. Light quasiparticles dominate electronic transport in molecular crystal field-effect transistors

    SciTech Connect

    Li, Z. Q.; Podzorov, V.; Sai, N.; Martin, Michael C.; Gershenson, M. E.; Di Ventra, M.; Basov, D. N.

    2007-03-01

    We report on an infrared spectroscopy study of mobile holes in the accumulation layer of organic field-effect transistors based on rubrene single crystals. Our data indicate that both transport and infrared properties of these transistors at room temperature are governed by light quasiparticles in molecular orbital bands with the effective masses m[small star, filled]comparable to free electron mass. Furthermore, the m[small star, filled]values inferred from our experiments are in agreement with those determined from band structure calculations. These findings reveal no evidence for prominent polaronic effects, which is at variance with the common beliefs of polaron formation in molecular solids.

  5. Effect of intense magnetic fields on the convection of biogenic guanine crystals in aqueous solution

    NASA Astrophysics Data System (ADS)

    Iwasaka, M.; Mizukawa, Y.

    2015-05-01

    In this study, the basic magneto-optic properties of biogenic microcrystals in aqueous media were investigated. Microcrystals, mica plates, silica, and microcrystals from a diatom cell and biogenic guanine crystals from goldfish showed light scattering inhibition when the crystals were observed in water under a 5 T magnetic field and dark-field illumination. In particular, in 50% ethanol/water medium, convection of the biogenic guanine particle aggregates was reversibly inhibited when the microcrystal suspension was exposed to a 5 T magnetic field. Microscopic observation comparing the biogenic guanine crystals in water with 95% ethanol or 99% acetone revealed that light flickering on the surface of the crystals was affected by the surface interaction of the crystal with the surrounding medium. By considering both the magnetic orientation of the microcrystals and the possible interactions of crystals with the surrounding medium, a magnetically controllable fluidic tracer was suggested.

  6. Transferred large area single crystal MoS2 field effect transistors

    NASA Astrophysics Data System (ADS)

    Lee, Choong Hee; McCulloch, William; Lee, Edwin W.; Ma, Lu; Krishnamoorthy, Sriram; Hwang, Jinwoo; Wu, Yiying; Rajan, Siddharth

    2015-11-01

    Transfer of epitaxial, two-dimensional (2D) MoS2 on sapphire grown via synthetic approaches is a prerequisite for practical device applications. We report centimeter-scale, single crystal, synthesized MoS2 field effect transistors (FETs) transferred onto SiO2/Si substrates, with a field-effect mobility of 4.5 cm2 V-1 s-1, which is among the highest mobility values reported for the transferred large-area MoS2 transistors. We demonstrate simple and clean transfer of large-area MoS2 films using deionized water, which can effectively avoid chemical contamination. The transfer method reported here allows standard i-line stepper lithography process to realize multiple devices over the entire film area.

  7. Oxygen content and crystal field effects in RBa sub 2 Cu sub 3 O sub x

    SciTech Connect

    Podlesnyak, A.A.; Mirmelstein, A.V.; Bobrovskii, V.I.; Zhadhin, I.L.; Blinovskov, Y.N.; Kozhenvnikov, V.L.; Goshchitskii, B.N. )

    1991-05-10

    Effects of crystal electrical field (CEF) in the orthorhombic phase of RBa{sub 2}Cu{sub 3}O{sub x} (R = Ho, Er; x = 6.9, 6.4) are investigated by inelastic magnetic neutron scattering (IMNS). The level schemes of the lowest multiplet of 4f-shell of the rare-earth ion are found. In this paper it is shown that the experimental scattering spectra and their variation depending on the oxygen content may be explained by spacial distribution of the negative charge within the unit cell.

  8. Rubrene crystal field-effect mobility modulation via conducting channel wrinkling

    PubMed Central

    Reyes-Martinez, Marcos A.; Crosby, Alfred J.; Briseno, Alejandro L.

    2015-01-01

    With the impending surge of flexible organic electronic technologies, it has become essential to understand how mechanical deformation affects the electrical performance of organic thin-film devices. Organic single crystals are ideal for the systematic study of strain effects on electrical properties without being concerned about grain boundaries and other defects. Here we investigate how the deformation affects the field-effect mobility of single crystals of the benchmark semiconductor rubrene. The wrinkling instability is used to apply local strains of different magnitudes along the conducting channel in field-effect transistors. We discover that the mobility changes as dictated by the net strain at the dielectric/semiconductor interface. We propose a model based on the plate bending theory to quantify the net strain in wrinkled transistors and predict the change in mobility. These contributions represent a significant step forward in structure–function relationships in organic semiconductors, critical for the development of the next generation of flexible electronic devices. PMID:25939864

  9. Rubrene crystal field-effect mobility modulation via conducting channel wrinkling.

    PubMed

    Reyes-Martinez, Marcos A; Crosby, Alfred J; Briseno, Alejandro L

    2015-01-01

    With the impending surge of flexible organic electronic technologies, it has become essential to understand how mechanical deformation affects the electrical performance of organic thin-film devices. Organic single crystals are ideal for the systematic study of strain effects on electrical properties without being concerned about grain boundaries and other defects. Here we investigate how the deformation affects the field-effect mobility of single crystals of the benchmark semiconductor rubrene. The wrinkling instability is used to apply local strains of different magnitudes along the conducting channel in field-effect transistors. We discover that the mobility changes as dictated by the net strain at the dielectric/semiconductor interface. We propose a model based on the plate bending theory to quantify the net strain in wrinkled transistors and predict the change in mobility. These contributions represent a significant step forward in structure-function relationships in organic semiconductors, critical for the development of the next generation of flexible electronic devices. PMID:25939864

  10. Effect of far-field flow on a columnar crystal in the convective undercooled melt

    NASA Astrophysics Data System (ADS)

    Ji, Xiao-Jian; Chen, Ming-Wen; Xu, Xiao-Hua; Wang, Zi-Dong

    2015-01-01

    The growth behavior of a columnar crystal in the convective undercooled melt affected by the far-field uniform flow is studied and the asymptotic solution for the interface evolution of the columnar crystal is derived by means of the asymptotic expansion method. The results obtained reveal that the far-field flow induces a significant change of the temperature around the columnar crystal and the convective flow caused by the far-field flow accelerates the growth velocity of the interface of the growing columnar crystal in the upstream direction and inhibits its growth velocity in the downstream direction. Our results are similar to the experimental data and numerical simulations. Project supported by the Overseas Distinguished Scholar Program by the Ministry of Education of China (Grant No. MS2010BJKJ005), the National Natural Science Foundation of China (Grant No. 10972030), and the Science and Technology Support Project of Jiangxi, China (Grant No. 20112BBE50006).

  11. Ferroelectric Single-Crystal Gated Graphene/Hexagonal-BN/Ferroelectric Field-Effect Transistor.

    PubMed

    Park, Nahee; Kang, Haeyong; Park, Jeongmin; Lee, Yourack; Yun, Yoojoo; Lee, Jeong-Ho; Lee, Sang-Goo; Lee, Young Hee; Suh, Dongseok

    2015-11-24

    The effect of a ferroelectric polarization field on the charge transport in a two-dimensional (2D) material was examined using a graphene monolayer on a hexagonal boron nitride (hBN) field-effect transistor (FET) fabricated using a ferroelectric single-crystal substrate, (1-x)[Pb(Mg1/3Nb2/3)O3]-x[PbTiO3] (PMN-PT). In this configuration, the intrinsic properties of graphene were preserved with the use of an hBN flake, and the influence of the polarization field from PMN-PT could be distinguished. During a wide-range gate-voltage (VG) sweep, a sharp inversion of the spontaneous polarization affected the graphene channel conductance asymmetrically as well as an antihysteretic behavior. Additionally, a transition from antihysteresis to normal ferroelectric hysteresis occurred, depending on the V(G) sweep range relative to the ferroelectric coercive field. We developed a model to interpret the complex coupling among antihysteresis, current saturation, and sudden conductance variation in relation with the ferroelectric switching and the polarization-assisted charge trapping, which can be generalized to explain the combination of 2D structured materials with ferroelectrics. PMID:26487348

  12. Crystal field and magnetic properties

    NASA Technical Reports Server (NTRS)

    Flood, D. J.

    1977-01-01

    Magnetization and magnetic susceptibility measurements have been made in the temperature range 1.3 to 4.2 K on powdered samples of ErH3. The susceptibility exhibits Curie-Weiss behavior from 4.2 to 2 K, and intercepts the negative temperature axis at theta = 1.05 + or - 0.05 K, indicating that the material is antiferromagnetic. The low field effective moment is 6.77 + or - 0.27 Bohr magnetons per ion. The magnetization exhibits a temperature independent contribution, the slope of which is (5 + or - 1.2) x 10 to the -6th Weber m/kg Tesla. The saturation moment is 3.84 + or - 1 - 0.15 Bohr magnetons per ion. The results can be qualitatively explained by the effects of crystal fields on the magnetic ions. No definitive assignment of a crystal field ground state can be given, nor can a clear choice between cubically or hexagonally symmetric crystal fields be made. For hexagonal symmetry, the first excited state is estimated to be 86 to 100 K above the ground state. For cubic symmetry, the splitting is on the order of 160 to 180 K.

  13. Phase-field study of crystal growth in three-dimensional capillaries: Effects of crystalline anisotropy.

    PubMed

    Debierre, Jean-Marc; Guérin, Rahma; Kassner, Klaus

    2016-07-01

    Phase-field simulations are performed to explore the thermal solidification of a pure melt in three-dimensional capillaries. Motivated by our previous work for isotropic or slightly anisotropic materials, we focus here on the more general case of anisotropic materials. Different channel cross sections are compared (square, hexagonal, circular) to reveal the influence of geometry and the effects of a competition between the crystal and the channel symmetries. In particular, a compass effect toward growth directions favored by the surface energy is identified. At given undercooling and anisotropy, the simulations generally show the coexistence of several growth modes. The relative stability of these growth modes is tested by submitting them to a strong spatiotemporal noise for a short time, which reveals a subtle hierarchy between them. Similarities and differences with experimental growth modes in confined geometry are discussed qualitatively. PMID:27575207

  14. Phase-field study of crystal growth in three-dimensional capillaries: Effects of crystalline anisotropy

    NASA Astrophysics Data System (ADS)

    Debierre, Jean-Marc; Guérin, Rahma; Kassner, Klaus

    2016-07-01

    Phase-field simulations are performed to explore the thermal solidification of a pure melt in three-dimensional capillaries. Motivated by our previous work for isotropic or slightly anisotropic materials, we focus here on the more general case of anisotropic materials. Different channel cross sections are compared (square, hexagonal, circular) to reveal the influence of geometry and the effects of a competition between the crystal and the channel symmetries. In particular, a compass effect toward growth directions favored by the surface energy is identified. At given undercooling and anisotropy, the simulations generally show the coexistence of several growth modes. The relative stability of these growth modes is tested by submitting them to a strong spatiotemporal noise for a short time, which reveals a subtle hierarchy between them. Similarities and differences with experimental growth modes in confined geometry are discussed qualitatively.

  15. Effects of the biaxial transverse crystal-field on the phase diagrams of a spin-1 nanowire

    NASA Astrophysics Data System (ADS)

    Magoussi, H.; Zaim, A.; Boughrara, M.; Kerouad, M.

    2016-09-01

    By using the effective field theory based on a probability distribution method, the phase diagrams and the magnetic properties of an Ising nanowire in the presence of the biaxial transverse crystal-field are investigated. The effects of the biaxial transverse crystal field, the interfacial coupling and the exchange interaction in the surface on the phase diagram, the magnetization and the internal energy are examined. Some characteristic phenomena are found such as the tricritical behavior, the critical end point and the re-entrant phenomenon.

  16. Field Control of the Surface Electroclinic Effect in Liquid Crystal Displays II

    NASA Astrophysics Data System (ADS)

    Zappitelli, Kara; Hipolite, Dana; Saunders, Karl

    2012-11-01

    As previously introduced in the presentation by Dana Hipolite, chiral, smectic liquid crystal molecules aligned in layers can be controlled by the application of an electric field, which has a variety of implications for the quality of LCD displays. Both the bulk electroclinic effect (BECE) and surface electroclinic effect (SECE) impact the angle at which the molecules tilt with respect to the director in different areas of the cell. Certain LC's exhibit a continuous Sm-A* to Sm-C* transition, where the angle of the surface and bulk molecules change continually with the electric field. Other LC's exhibit first order transitions where we see jumps in the tilt at different values of the applied electric field for the bulk and surface molecules respectively. The difference in angle of the bulk and surface molecules in both of these situations causes discrepancies in the layer spacing within the LC cell. These discrepancies lead to frustrations within the cell, which can be quantified by the strain (?). These frustrations can be relieved in multiple ways, however the method of relief may lead to negative impacts on the alignment quality of the display itself.

  17. Enhanced mobility in organic field-effect transistors due to semiconductor/dielectric interface control and very thin single crystal

    NASA Astrophysics Data System (ADS)

    Dong, Ji; Yu, Peng; Atika Arabi, Syeda; Wang, Jiawei; He, Jun; Jiang, Chao

    2016-07-01

    A perfect organic crystal while keeping high quality semiconductor/dielectric interface with minimal defects and disorder is crucial for the realization of high performance organic single crystal field-effect transistors (OSCFETs). However, in most reported OSCFET devices, the crystal transfer processes is extensively used. Therefore, the semiconductor/dielectric interface is inevitably damaged. Carrier traps and scattering centers are brought into the conduction channel, so that the intrinsic high mobility of OSCFET devices is entirely disguised. Here, very thin pentacene single crystal is grown directly on bare SiO2 by developing a ‘seed-controlled’ pentacene single crystal method. The interface quality is controlled by an in situ fabrication of OSCFETs. The interface is kept intact without any transfer process. Furthermore, we quantitatively analyze the influence of crystal thickness on device performance. With a pristine interface and very thin crystal, we have achieved the highest mobility: 5.7 cm2 V‑1 s‑1—more than twice the highest ever reported pentacene OSCFET mobility on bare SiO2. This study may provide a universal route for the use of small organic molecules to achieve high performance in lamellar single crystal field-effect devices.

  18. Effect of temperature and electric field on 2D nematic colloidal crystals stabilised by vortex-like topological defects.

    PubMed

    Zuhail, K P; Dhara, Surajit

    2016-08-10

    We report experimental studies on 2D colloidal crystals of dimers stabilized by vortex-like defects in planar nematic and π/2 twisted nematic cells. The dimers are prepared and self-assembled using a laser tweezer. We study the effect of temperature and electric field on the lattice parameters of the colloidal crystals. The lattice parameters vary with the temperature in the nematic phase and a discontinuous structural change is observed at the nematic to smectic-A phase transition. In the nematic phase, we observed a large change in the lattice parameters (≃30%) by applying an external electric field perpendicular to the plane of the 2D crystals. The idea and the active control of the lattice parameters could be useful for designing tunable colloidal crystals. PMID:27445255

  19. Solitary waves in two-dimensional dusty plasma crystal: Effects of weak magnetic field

    SciTech Connect

    Ghosh, Samiran; Gupta, M. R.

    2010-03-15

    It is shown that in the presence of weak magnetic field, the dust lattice solitary wave in two-dimensional (2D) hexagonal dusty plasma crystal is governed by a gyration-modified 2D Korteweg-de Vries equation due to the action of Lorentz force on the dust particles. Numerical solutions reveal that only for weak magnetic field an apparently single hump solitary wave solution exist. But, for strong magnetic field dust lattice solitary wave becomes unstable showing repetitive solitary hump of increasing magnitude with time.

  20. Crystal-Field and Covalency Effects in Uranates: An X-ray Spectroscopic Study.

    PubMed

    Butorin, Sergei M; Kvashnina, Kristina O; Smith, Anna L; Popa, Karin; Martin, Philippe M

    2016-07-01

    The electronic structure of U(V) - and U(VI) -containing uranates NaUO3 and Pb3 UO6 was studied by using an advanced technique, namely X-ray absorption spectroscopy (XAS) in high-energy-resolution fluorescence-detection (HERFD) mode. Due to a significant reduction in core-hole lifetime broadening, the crystal-field splittings of the 5f shell were probed directly in HERFD-XAS spectra collected at the U 3d edge, which is not possible by using conventional XAS. In addition, the charge-transfer satellites that result from U 5f-O 2p hybridization were clearly resolved. The crystal-field parameters, 5f occupancy, and degree of covalency of the chemical bonding in these uranates were estimated by using the Anderson impurity model by calculating the U 3d HERFD-XAS, conventional XAS, core-to-core (U 4f-3d transitions) resonant inelastic X-ray scattering (RIXS), and U 4f X-ray photoelectron spectra. The crystal field was found to be strong in these systems and the 5f occupancy was determined to be 1.32 and 0.84 electrons in the ground state for NaUO3 and Pb3 UO6 , respectively, which indicates a significant covalent character for these compounds. PMID:27257782

  1. Effect of an electric field on the magnetization of a SmFe3(BO3)4 single crystal

    NASA Astrophysics Data System (ADS)

    Freidman, A. L.; Balaev, A. D.; Dubrovskii, A. A.; Eremin, E. V.; Shaikhutdinov, K. A.; Temerov, V. L.; Gudim, I. A.

    2015-07-01

    A change in the magnetization of a SmFe3(BO3)4 single crystal in response to an applied alternating electric field has been experimentally observed for the first time. The measurements have demonstrated that the magnetization oscillates not only at a frequency of the applied electric field but also at twice the frequency. The dependences of the magnetoelectric effect on the magnetic and electric fields and temperature have been measured. It has been assumed that the existence of the second harmonic of the magnetoelectric effect is due to the electrostriction.

  2. Magnetic anisotropy and crystalline electric field effects in RRh{sub 4}B{sub 4} single crystals.

    SciTech Connect

    Zhou, H.; Lambert, S. E.; Maple, M. B.; Dunlap, B. D.; Materials Science Division; Univ. of California at San Diego

    2009-08-01

    Research on polycrystalline RRh{sub 4}B{sub 4} samples has shown that crystalline electric field (CEF) effects play an important role in these compounds. The successful synthesis of single crystal samples of RRh{sub 4}B{sub 4} with R = Y, Sm, Gd, Tb, Dy, Ho, Er, Tm, and Lu has provided an opportunity to further investigate CEF effects in these materials. Magnetization and magnetic susceptibility measurements on the RRh{sub 4}B{sub 4} single crystals revealed strong magnetic anisotropy, and the experimental results could be described well by CEF calculations based on the parameters derived from an analysis of experimental data for ErRh{sub 4}B{sub 4} single crystals. The easy directions of magnetization of these compounds are consistent with the signs of the Stevens factor {alpha}J of the CEF Hamiltonian. A strong influence of magnetic anisotropy on superconductivity was also observed.

  3. Dependence of Pentacene Crystal Growth on Dielectric Roughness for Fabrication of Flexible Field-Effect Transistors

    SciTech Connect

    Yang, H.; Yang, C; Kim, S; Jang, M; Park, C

    2010-01-01

    The dependence of pentacene nanostructures on gate dielectric surfaces were investigated for flexible organic field-effect transistor (OFET) applications. Two bilayer types of polymer/aluminum oxide (Al{sub 2}O{sub 3}) gate dielectrics were fabricated on commercial Al foils laminated onto a polymer back plate. Some Al foils were directly used as gate electrodes, and others were smoothly polished by an electrolytic etching. These Al surfaces were then anodized and coated with poly({alpha}-methyl styrene) (PAMS). For PAMS/Al{sub 2}O{sub 3} dielectrics onto etched Al foils, surface roughness up to 1 nm could be reached, although isolated dimples with a lateral diameter of several micrometers were still present. On PAMS/Al{sub 2}O{sub 3} dielectrics (surface roughness >40 nm) containing mechanical grooves of Al foil, average hole mobility ({mu}FET) of 50 nm thick pentacene-FETs under the low operating voltages (|V| < 6 V) was {approx}0.15 cm{sup 2} V{sup -1} s{sup -1}. In contrast, pentacene-FETs employing the etched Al gates exhibited {mu}FET of 0.39 cm{sup 2} V{sup -1} s{sup -1}, which was comparable to that of reference samples with PAMS/Al{sub 2}O{sub 3} dielectrics onto flat sputtered Al gates. Conducting-probe atomic force microscopy and two-dimensional X-ray diffraction of pentacene films with various thicknesses revealed different out-of-plane and in-plane crystal orderings of pentacene, depending on the surface roughness of the gate dielectrics.

  4. Touch sensors based on planar liquid crystal-gated-organic field-effect transistors

    SciTech Connect

    Seo, Jooyeok; Lee, Chulyeon; Han, Hyemi; Lee, Sooyong; Nam, Sungho; Kim, Youngkyoo; Kim, Hwajeong; Lee, Joon-Hyung; Park, Soo-Young; Kang, Inn-Kyu

    2014-09-15

    We report a tactile touch sensor based on a planar liquid crystal-gated-organic field-effect transistor (LC-g-OFET) structure. The LC-g-OFET touch sensors were fabricated by forming the 10 μm thick LC layer (4-cyano-4{sup ′}-pentylbiphenyl - 5CB) on top of the 50 nm thick channel layer (poly(3-hexylthiophene) - P3HT) that is coated on the in-plane aligned drain/source/gate electrodes (indium-tin oxide - ITO). As an external physical stimulation to examine the tactile touch performance, a weak nitrogen flow (83.3 μl/s) was employed to stimulate the LC layer of the touch device. The LC-g-OFET device exhibited p-type transistor characteristics with a hole mobility of 1.5 cm{sup 2}/Vs, but no sensing current by the nitrogen flow touch was measured at sufficiently high drain (V{sub D}) and gate (V{sub G}) voltages. However, a clear sensing current signal was detected at lower voltages, which was quite sensitive to the combination of V{sub D} and V{sub G}. The best voltage combination was V{sub D} = −0.2 V and V{sub G} = −1 V for the highest ratio of signal currents to base currents (i.e., signal-to-noise ratio). The change in the LC alignment upon the nitrogen flow touch was assigned as the mechanism for the present LC-g-OFET touch sensors.

  5. Field-induced phase transitions in an antiferroelectric liquid crystal using the pyroelectric effect

    PubMed

    Shtykov; Vij; Lewis; Hird; Goodby

    2000-08-01

    The antiferroelectric liquid crystal (AFLC) under investigation possesses different helical polar phases. Measurements of pyroelectric response of these phases as a function of temperature and bias field have elucidated the ability of this method for investigating the nature of antiferroelectric phases and phase transitions under the bias field. The pyroelectric signal as a function of the bias field at fixed temperatures and as a function of temperature for fixed bias fields was measured for different phases of the investigated AFLC material. A theoretical model describing the pyroelectric response in different phases of AFLC is given, and the experimental results are interpreted. The threshold fields for field induced phase transitions are determined. The type of field induced phase transition from the AF phase in particular is found to be dependent on the temperature within its range. The properties of an unusual ferrielectric phase existing between ferrielectric chiral smectic-C (SmC*) and antiferroelectric AF phases are studied in a great detail. The results confirm that this phase is one of the incommensurate phases, predicted by the axial next-nearest neighbor Ising model and Landau model for this temperature region. PMID:11088695

  6. Effects of polarized organosilane self-assembled monolayers on organic single-crystal field-effect transistors

    NASA Astrophysics Data System (ADS)

    Takeya, J.; Nishikawa, T.; Takenobu, T.; Kobayashi, S.; Iwasa, Y.; Mitani, T.; Goldmann, C.; Krellner, C.; Batlogg, B.

    2004-11-01

    The surface conductivity is measured by a four-probe technique for pentacene and rubrene single crystals laminated on polarized and nearly unpolarized molecular monolayers with application of perpendicular electric fields. The polarization of the self-assembled monolayers (SAMs) shifts the threshold gate voltage, while maintaining a very low subthreshold swing of the single-crystal devices (0.11 V/decade). The results, excluding influences of parasitic contacts and grain boundaries, demonstrate SAM-induced nanoscale charge injection up to ˜1012cm-2 at the surface of the organic single crystals.

  7. Giant rotating magnetocaloric effect at low magnetic fields in multiferroic TbMn2O5 single crystals

    NASA Astrophysics Data System (ADS)

    Balli, M.; Jandl, S.; Fournier, P.; Dimitrov, D. Z.

    2016-03-01

    In conventional magnetocaloric refrigeration systems, the magnetocaloric effect is exploited by moving the active material in and out of the magnetic field source. Here, we demonstrate that a large and reversible magnetocaloric effect (-ΔSR, max = 6.4 J/kg K and ΔTR, max = 8 K under 2 T) can be generated simply by rotating the multiferroic TbMn2O5 single crystal around its b axis in a relatively low constant magnetic field applied in the ac plane. Our results should inspire and open ways toward the implementation of compact, efficient and embedded magnetocaloric devices for low temperature and space applications.

  8. Metastable Copper-Phthalocyanine Single-Crystal Nanowires and Their Use in Fabricating High-Performance Field-Effect Transistors

    SciTech Connect

    Xiao, Kai; Li, Rongjin; Tao, Jing; Payzant, E Andrew; Ivanov, Ilia N; Puretzky, Alexander A; Hu, Wenping; Geohegan, David B

    2009-01-01

    This paper describes a simple, vapor-phase route to the synthesis of metastable α-phase copper-phthalocyanine (CuPc) single-crystal nanowires through control of the growth temperature. The influence of the growth temperature on the crystal structures, morphology, and size of the CuPc nanostructures was explored by XRD, optical absorption and Transmission Electron Microscopy (TEM). α-CuPc nanowires were successfully incorporated as active semiconductors in field-effect transistors (FETs). Single nanowire devices exhibited the carrier mobilities and current on/off ratios as high as 0.4 cm2/Vs and > 104, respectively, rendering them useful for organic photovoltaic cells, organic light-emitting diodes, field-effect transistors, memories and gas sensors

  9. Effect of Magnetic Fields on g-jitter Induced Convection and Solute Striation During Space Processing of Single Crystals

    NASA Technical Reports Server (NTRS)

    deGroh, H. C.; Li, K.; Li, B. Q.

    2002-01-01

    A 2-D finite element model is presented for the melt growth of single crystals in a microgravity environment with a superimposed DC magnetic field. The model is developed based on the deforming finite element methodology and is capable of predicting the phenomena of the steady and transient convective flows, heat transfer, solute distribution, and solid-liquid interface morphology associated with the melt growth of single crystals in microgravity with and without an applied magnetic field. Numerical simulations were carried out for a wide range of parameters including idealized microgravity conditions, the synthesized g-jitter and the real g-jitter data taken by on-board accelerometers during space flights. The results reveal that the time varying g-jitter disturbances, although small in magnitude, cause an appreciable convective flow in the liquid pool, which in turn produces detrimental effects during the space processing of single crystal growth. An applied magnetic field of appropriate strength, superimposed on microgravity, can be very effective in suppressing the deleterious effects resulting from the g-jitter disturbances.

  10. Effect of crystal-field splitting and interband hybridization on the metal-insulator transitions of strongly correlated systems

    NASA Astrophysics Data System (ADS)

    Poteryaev, Alexander I.; Ferrero, Michel; Georges, Antoine; Parcollet, Olivier

    2008-07-01

    We investigate a quarter-filled two-band Hubbard model involving a crystal-field splitting, which lifts the orbital degeneracy as well as an interorbital hopping (interband hybridization). Both terms are relevant to the realistic description of correlated materials such as transition-metal oxides. The nature of the Mott metal-insulator transition is clarified and is found to depend on the magnitude of the crystal-field splitting. At large values of the splitting, a transition from a two-band to a one-band metal is first found as the on-site repulsion is increased and is followed by a Mott transition for the remaining band, which follows the single-band (Brinkman-Rice) scenario well documented previously within dynamical mean-field theory. At small values of the crystal-field splitting, a direct transition from a two-band metal to a Mott insulator with partial orbital polarization is found, which takes place simultaneously for both orbitals. This transition is characterized by a vanishing of the quasiparticle weight for the majority orbital but has a first-order character for the minority orbital. It is pointed out that finite-temperature effects may easily turn the metallic regime into a bad metal close to the orbital polarization transition in the metallic phase.

  11. Partial Dissolution of Charge Order Phase Observed in β-(BEDT-TTF)2PF6 Single Crystal Field Effect Transistor.

    PubMed

    Sakai, Masatoshi; Moritoshi, Norifumi; Kuniyoshi, Shigekazu; Yamauchi, Hiroshi; Kudo, Kazuhiro; Masu, Hyuma

    2016-04-01

    The effect of an applied gate electric field on the charge-order phase in β-(BEDT-TTF)2PF6 single-crystal field-effect transistor structure was observed at around room temperature by technical improvement with respect to sample preparation and electrical measurements. A relatively slight but systematic increase of the electrical conductance induced by the applied gate electric field and its temperature dependence was observed at around the metal-insulator transition temperature (TMI). The temperature dependence of the modulated electrical conductance demonstrated that TMI was shifted toward the lower side by application of a gate electric field, which corresponds to partial dissolution of the charge-order phase. The thickness of the partially dissolved charge order region was estimated to be several score times larger than the charge accumulation region. PMID:27451615

  12. Effects of composition and temperature on the large-field behavior of [001]C relaxor single crystals.

    PubMed

    Gallagher, John; Lynch, Christopher; Tian, Jian

    2014-12-01

    The compositional dependence of the large-field behavior of [001]C-cut relaxor ferroelectric xPb(In1/2Nb1/2) O3-(1-x-y)Pb(Mg1/3Nb2/3)O3-yPbTiO3 (PIN-PMN-PT) single crystals that are on the rhombohedral side of the morphotropic phase boundary was characterized under electrical, mechanical, and thermal loading. The effects of varying the concentrations of PIN and PT are discussed. Composition was found to impact the material constants and the field-induced phase transformation threshold in the piezoelectric d333-mode configuration. PMID:25474790

  13. Single-crystal field-effect transistors of new Cl2-NDI polymorph processed by sublimation in air

    NASA Astrophysics Data System (ADS)

    He, Tao; Stolte, Matthias; Burschka, Christian; Hansen, Nis Hauke; Musiol, Thomas; Kälblein, Daniel; Pflaum, Jens; Tao, Xutang; Brill, Jochen; Würthner, Frank

    2015-01-01

    Physical properties of active materials built up from small molecules are dictated by their molecular packing in the solid state. Here we demonstrate for the first time the growth of n-channel single-crystal field-effect transistors and organic thin-film transistors by sublimation of 2,6-dichloro-naphthalene diimide in air. Under these conditions, a new polymorph with two-dimensional brick-wall packing mode (β-phase) is obtained that is distinguished from the previously reported herringbone packing motif obtained from solution (α-phase). We are able to fabricate single-crystal field-effect transistors with electron mobilities in air of up to 8.6 cm2 V-1 s-1 (α-phase) and up to 3.5 cm2 V-1 s-1 (β-phase) on n-octadecyltriethoxysilane-modified substrates. On silicon dioxide, thin-film devices based on β-phase can be manufactured in air giving rise to electron mobilities of 0.37 cm2 V-1 s-1. The simple crystal and thin-film growth procedures by sublimation under ambient conditions avoid elaborate substrate modifications and costly vacuum equipment-based fabrication steps.

  14. Near infrared Kerr effect and description of field-induced phase transitions in polymer-stabilized blue phase liquid crystals

    NASA Astrophysics Data System (ADS)

    Atorf, B.; Rasouli, H.; Nordendorf, G.; Wilkes, D.; Kitzerow, H.

    2016-02-01

    Studies of the influence of an electric field E on the effective refractive index of a polymer-stabilized blue phase in the near infrared spectral range reveal a considerable field-induced birefringence. At moderate voltages, the birefringence increases linearly with the square of the field strength as expected for the electro-optic Kerr effect, with an effective Kerr constant of K ≈ 6.3 - 6.9 × 10-10 m V-2. However, for E > ≈7.3 V/μm, the slope of the field-induced birefringence versus E2 increases abruptly, before saturation is reached at E > ≈8.5 V/μm. Based on previous observations on blue phases in the visible wavelength range, the discontinuous change can be attributed to a field-induced phase transition. A modification of the extended Kerr model introduced by Wu and coworkers is suggested to take this additional effect into account. In addition to the promising properties of blue phases for improved liquid crystal displays, the observed field-induced birefringence in the infrared region opens interesting perspectives for telecommunication and other non-display applications.

  15. Fabrication of graphene field-effect transistor on top of ferroelectric single-crystal substrate

    NASA Astrophysics Data System (ADS)

    Park, Nahee; Kang, Haeyong; Lee, Yourack; Kim, Jeong-Gyun; Kim, Joong-Gyu; Yun, Yoojoo; Park, Jeongmin; Kim, Taesoo; Kim, Jung Ho; Jin, Youngjo; Shin, Yong Seon; Lee, Young Hee; Suh, Dongseok

    2015-03-01

    In the analysis of Graphene field-effect transistor, the substrate material which has the direct contact with Graphene layer plays an important in the device performance. In this presentation, we have tested PMN-PT(i.e.(1-x)Pb(Mg1/3Nb2/3) O3-xPbTiO3) substrate as a gate dielectric of Graphene field-effect transistor. Unlike the case of previously used substrates such as silicon oxide or hexagonal Boron-Nitride(h-BN), the PMN-PT substrate can induce giant amount of surface charge that is directly injected to the attached Graphene layer due to its ferroelectric property. And the hysteresis of polarization versus electric field of PMN-PT can cause the device to show the ferroelectric nonvolatile memory operation. We had successfully fabricated Graphene field-effect transistor using the mechanically exfoliated Graphene layer transferred on the PMN-PT(001) substrate. Unlike the case of mechanical exfoliation on the surface of silicon-oxide or the Poly(methyl methacrylate) (PMMA), the weak adhesion properties between graphene and PMNPT required the pretreatment on PMMA before the exfoliation process. The device performance is analyzed in terms of the effect of ferro- and piezo-electric effect of PMNPT substrate.

  16. Effect of Crystal Fields in Ho1 - xDyxNi2B2 C

    NASA Astrophysics Data System (ADS)

    Lee, W. C.

    2013-03-01

    From the anisotropy and the temperature dependence of magnetic susceptibilities of Ho1 - x Dyx Ni2B2 C system with magnetic field H perpendicular or parallel to c-axis, the crystalline electric field (CEF) effect has been studied and the magnetic exchange interaction constant Jex of rare-earth ions perpendicular to the c-axis estimated for 0 <=x <=1. The crystalline electric field parameter, B02, the first Steven parameter and the most dominant term in this system, are determined from the high-temperature-limit anisotropic Weiss temperatures of the magnetic susceptibilities and there is a broad minimum around x ~ 0.3, where superconducting transition temperature, TC, and Néel temperature, TN, are almost same.

  17. Anisotropy of the upper critical fields and the paramagnetic Meissner effect in La1.85Sr0.15CuO4 single crystals.

    PubMed

    Felner, I; Tsindlekht, M I; Drachuck, G; Keren, A

    2013-02-13

    Optimally doped La(1.85)Sr(0.15)CuO(4) single crystals have been investigated by dc and ac magnetic measurements. These crystals have rectangular needle-like shapes with the long needle axis parallel to the crystallographic c axis (c-crystal) or parallel to the basal planes (a-crystal). In both crystals, the temperature dependence of the upper critical fields (H(C2)) and the surface critical field (H(C3)) were measured. The H-T phase diagram is presented. Close to T(C) = 35 K, for the c-crystal, γ(C) = H(C3)(c)/H(C2)(c) = 1.80(2), whereas for the a-crystal the γ(a) = H(C3)(a)/H(C2)(a) = 4.0(2) obtained is much higher than 1.69, predicted by the ideal mathematical model. At low applied dc fields, positive field-cooled branches known as the 'paramagnetic Meissner effect' (PME) are observed; their magnitude is inversely proportional to H. The anisotropic PME is observed in both a- and c-crystals, only when the applied field is along the basal planes. It is speculated that the high γ(a) and the PME are connected to each other. PMID:23315336

  18. Effect of two-dimensional confinement on switching of vertically aligned liquid crystals by an in-plane electric field.

    PubMed

    Choi, Tae-Hoon; Woo, Jae-Hyeon; Choi, Yeongyu; Yoon, Tae-Hoon

    2016-09-01

    We investigated the two-dimensional (2-D) confinement effect of liquid crystals (LCs) on the switching of vertically aligned LCs by an in-plane electric field. When an in-plane field is applied to a vertical alignment (VA) cell, virtual walls are built at the center of the interdigitated electrodes and at the middle of the gaps between them. The LC molecules are confined not only by the two substrates but also by the virtual walls so that the turn-off time of a VA cell driven by an in-plane field is dependent on the pitch of the interdigitated electrodes as well as the cell gap. Therefore, the turn-off time of a VA cell driven by an in-plane field can be reduced simply by decreasing the pitch of the interdigitated electrodes as a result of the enhanced anchoring provided by the virtual walls. The experimental results showed good agreement with a simple model based on the 2-D confinement effect of LCs. PMID:27607702

  19. Electrostimulation of the magnetoplastic effect in LiF crystals by an "internal" electric field induced during indentation

    NASA Astrophysics Data System (ADS)

    Galustashvili, M. V.; Driaev, D. G.; Akopov, F. Kh.; Tsakadze, S. D.

    2013-08-01

    Indented LiF crystals demonstrate a change in the length of the dislocation rosette rays during their exposure to jointly acting dc magnetic and electric fields. It is shown that magnetic field with induction B = 1 T causes the electrostimulation or electrosuppression depending on the magnitude and direction of the external electric field with respect to the "internal" electric field induced by the charge transfer due to dislocations moving during the indentation.

  20. Unusual Kondo-hole effect and crystal-field frustration in Nd-doped CeRhIn5

    NASA Astrophysics Data System (ADS)

    Rosa, P. F. S.; Oostra, A.; Thompson, J. D.; Pagliuso, P. G.; Fisk, Z.

    2016-07-01

    We investigate single crystals of Ce1 -xNdxRhIn5 by means of x-ray-diffraction, microprobe, magnetic susceptibility, heat capacity, and electrical resistivity measurements. Our data reveal that the antiferromagnetic transition of CeRhIn5, at TNCe=3.8 K, is linearly suppressed with xNd. We associate this effect with the presence of a "Kondo hole" created by Nd substitution. The extrapolation of TNCe to zero temperature, however, occurs at xc˜0.3 , which is below the two-dimensional percolation limit found in Ce1 -xLaxRhIn5 . This result strongly suggests the presence of a crystal-field induced magnetic frustration. Near xNd˜0.2 , the Ising antiferromagnetic order from Nd3 + ions is stabilized and TNNd increases up to 11 K in NdRhIn5. Our results shed light on the effects of magnetic doping in heavy-fermion antiferromagnets and stimulate the study of such systems under applied pressure.

  1. Enhanced mobility in organic field-effect transistors due to semiconductor/dielectric iInterface control and very thin single crystal.

    PubMed

    Dong, Ji; Yu, Peng; Arabi, Syeda Atika; Wang, Jiawei; He, Jun; Jiang, Chao

    2016-07-01

    A perfect organic crystal while keeping high quality semiconductor/dielectric interface with minimal defects and disorder is crucial for the realization of high performance organic single crystal field-effect transistors (OSCFETs). However, in most reported OSCFET devices, the crystal transfer processes is extensively used. Therefore, the semiconductor/dielectric interface is inevitably damaged. Carrier traps and scattering centers are brought into the conduction channel, so that the intrinsic high mobility of OSCFET devices is entirely disguised. Here, very thin pentacene single crystal is grown directly on bare SiO2 by developing a 'seed-controlled' pentacene single crystal method. The interface quality is controlled by an in situ fabrication of OSCFETs. The interface is kept intact without any transfer process. Furthermore, we quantitatively analyze the influence of crystal thickness on device performance. With a pristine interface and very thin crystal, we have achieved the highest mobility: 5.7 cm(2) V(-1) s(-1)-more than twice the highest ever reported pentacene OSCFET mobility on bare SiO2. This study may provide a universal route for the use of small organic molecules to achieve high performance in lamellar single crystal field-effect devices. PMID:27211506

  2. Crystal growth of CdTe in space and thermal field effects on mass flux and morphology

    NASA Technical Reports Server (NTRS)

    Wiedemeier, H.

    1988-01-01

    The primary, long-range goals are the development of vapor phase crystal growth experiments, and the growth of technologically useful crystals in space. The necessary ground-based studies include measurements of the effects of temperature variations on the mass flux and crystal morphology in vapor-solid growth processes. For in-situ mass flux measurements dynamic microbalance techniques will be employed. Crystal growth procedures and equipment will be developed to be compatible with microgravity conditions and flight requirements. Emphasis was placed on the further development of crystal growth and the investigation of relevant transport properties of CdTe. The dependence of the mass flux on source temperature was experimentally established. The CdTe synthesis and pretreatment procedures are being developed that yield considerable improvements in mass transport rates, and mass fluxes which are independent of the amount of source material. A higher degree of stoichiometric control of CdTe than before was achieved during this period of investigation. Based on this, a CdTe crystal growth experiment, employing physical vapor transport, yielded very promising results. Optical microscopy and X-ray diffraction studies revealed that the boule contained several large sized crystal grains of a high degree of crystallinity. Further characterization studies of CdTe crystals are in progress. The reaction chamber, furnace dimensions, and ampoule location of the dynamic microbalance system were modified in order to minimize radiation effects on the balance performance.

  3. Effective long-range interlayer interactions and electric-field-induced subphases in ferrielectric liquid crystals

    NASA Astrophysics Data System (ADS)

    Chandani, A. D. L.; Fukuda, Atsuo; Vij, Jagdish K.; Takanishi, Yoichi; Iida, Atsuo

    2016-04-01

    Microbeam resonant x-ray scattering experiments recently revealed the sequential emergence of electric-field-induced subphases (stable states) with exceptionally large unit cells consisting of 12 and 15 smectic layers. We explain the emergence of the field-induced subphases by the quasimolecular model based on the Emelyanenko-Osipov long-range interlayer interactions (LRILIs) together with our primitive way of understanding the frustration in clinicity using the qE number defined as qE=|[R ] -[L ] | /([R ] +[L ] ) ; here [R ] and [L ] refer to the numbers of smectic layers with directors tilted to the right and to the left, respectively, in the unit cell of a field-induced subphase. We show that the model actually stabilizes the field-induced subphases with characteristic composite unit cells consisting of several blocks, each of which is originally a ferrielectric three-layer unit cell stabilized by the LRILIs, but some of which would be modified to become ferroelectric by an applied electric field. In a similar line of thought, we also try to understand the puzzling electric-field-induced birefringence data in terms of the LRILIs.

  4. Liquid crystal-gated-organic field-effect transistors with in-plane drain-source-gate electrode structure.

    PubMed

    Seo, Jooyeok; Nam, Sungho; Jeong, Jaehoon; Lee, Chulyeon; Kim, Hwajeong; Kim, Youngkyoo

    2015-01-14

    We report planar liquid crystal-gated-organic field-effect transistors (LC-g-OFETs) with a simple in-plane drain-source-gate electrode structure, which can be cost-effectively prepared by typical photolithography/etching processes. The LC-g-OFET devices were fabricated by forming the LC layer (4-cyano-4'-pentylbiphenyl, 5CB) on top of the channel layer (poly(3-hexylthiophene), P3HT) that was spin-coated on the patterned indium-tin oxide (ITO)-coated glass substrates. The LC-g-OFET devices showed p-type transistor characteristics, while a current saturation behavior in the output curves was achieved for the 50-150 nm-thick P3HT (channel) layers. A prospective on/off ratio (>1 × 10(3)) was obtained regardless of the P3HT thickness, whereas the resulting hole mobility (0.5-1.1 cm(2)/(V s)) at a linear regime was dependent on the P3HT thickness. The tilted ordering of 5CB at the LC-P3HT interfaces, which is induced by the gate electric field, has been proposed as a core point of working mechanism for the present LC-g-OFETs. PMID:25478816

  5. Effect of 10-T magnetic fields on structural colors in guanine crystals of fish scales

    NASA Astrophysics Data System (ADS)

    Iwasaka, M.; Miyashita, Y.; Kudo, M.; Kurita, S.; Owada, N.

    2012-04-01

    This work reports the magnetically modulated structural colors in the chromatophore of goldfish scales under static magnetic fields up to 10 T. A fiber optic system for spectroscopy measurements and a CCD microscope were set in the horizontal bore of a 10-T superconducting magnet. One leaf of a fish scale was set in a glass chamber, exposed to visible light from its side direction, and then static magnetic fields were applied perpendicular to the surface of the scale. In addition, an optical fiber for spectroscopy was directed perpendicular to the surface. During the magnetic field sweep-up, the aggregate of guanine thin plates partially showed a rapid light quenching under 0.26 to 2 T; however, most of the thin plates continued to scatter the side-light and showed changing iridescence, which was displayed individually by each guanine plate. For example, an aggregate in the chromatophore exhibited a dynamic change in structural color from white-green to dark blue when the magnetic fields changed from 2 to 10 T. The spectrum profile, which was obtained by the fiber optic system, confirmed the image color changes under magnetic field exposure. Also, a linearly polarized light transmission was measured on fish scales by utilizing an optical polarizer and analyzer. The transmitted polarized light intensities increased in the range of 500-550 nm compared to the intensity at 700 nm during the magnetic field sweep-up. These results indicate that the multi-lamella structure of nano-mirror plates in guanine hexagonal micro-plates exhibit diamagnetically modulated structure changes, and its light interference is affected by strong magnetic fields.

  6. Random crystal field effect on the kinetic spin-3/2 Blume-Capel model under a time-dependent oscillating field

    NASA Astrophysics Data System (ADS)

    El Hachimi, A. G.; Dakir, O.; Sidi Ahmed, S.; Zaari, H.; El Yadari, M.; Benyoussef, A.; El Kenz, A.

    2016-09-01

    The effect of random crystal-field on the stationary states of the kinetic spin-3/2 Blume-Capel model is investigated within the framework of the mean-field approach. The Glauber-type stochastic dynamics is used to describe the time evolution of the system which is subject to a time-dependent oscillating external magnetic field. In addition to the well-known phase transitions and the appearance of the partly ferromagnetic phase characterized by the magnetization m = 1 in equilibrium case, a new dynamical regions between the ferromagnetic phases F1/2, F1 and F3/2 are found where F3/2 +F 1 / 2 ,F3/2 +F1, F1 +F1/2 phases coexist for a weak value of the reduced magnetic field (h). Whereas for higher value of h both solutions ordered F and disordered P phases coexist. Hence we present six types topologies of phase diagrams which exhibit dynamical first-order, second-order transition lines, dynamical tricritical and isolated critical end points. Furthermore, the dynamical thermal behavior magnetizations, susceptibilities and phase space trajectories are given and discussed.

  7. Effects of three-dimensional polymer networks in vertical alignment liquid crystal display controlled by in-plane field.

    PubMed

    Lim, Young Jin; Choi, Young Eun; Lee, Jun Hee; Lee, Gi-Dong; Komitov, Lachezar; Lee, Seung Hee

    2014-05-01

    Polymer network in vertical alignment liquid crystal cell driven by in-plane field (VA-IPS) is formed in three dimensions to achieve fast response time and to keep the liquid crystal alignment even when an external pressure is applied to the cell. The network formed by UV irradiation to vertically aligned liquid crystal cell with reactive mesogen does not disturb a dark state while exhibiting very fast decaying response time less than 2ms in all grey scales and almost zero pooling mura. The proposed device has a strong potential to be applicable to field sequential display owing to super-fast response time and flexible display owing to polymer network in bulk which supports a gap between two substrates. PMID:24921764

  8. A new real-time non-coherent to coherent light image converter - The hybrid field effect liquid crystal light valve

    NASA Technical Reports Server (NTRS)

    Grinberg, J.; Jacobson, A.; Bleha, W.; Miller, L.; Fraas, L.; Boswell, D.; Myer, G.

    1975-01-01

    A new, high-performance device has been developed for application to real-time coherent optical data processing. The new device embodies a CdS photoconductor, a CdTe light-absorbing layer, a dielectric mirror, and a liquid crystal layer sandwiched between indium-tin-oxide transparent electrodes deposited on optical quality glass flats. The noncoherent image is directed onto the photoconductor; this reduces the impedance of the photoconductor, thereby switching the ac voltage that is impressed across the electrodes onto the liquid crystal to activate the device. The liquid crystal is operated in a hybrid field effect mode. It utilizes the twisted nematic effect to create a dark off-state and the optical birefringence effect to create the bright on-state. The liquid crystal modulates the polarization of the coherent read-out light so an analyzer must be used to create an intensity modulated output beam.

  9. Effect of an electric field on the orientation of a liquid crystal in a cell with a nonuniform director distribution

    NASA Astrophysics Data System (ADS)

    Aksenova, E. V.; Karetnikov, A. A.; Karetnikov, N. A.; Kovshik, A. P.; Ryumtsev, E. I.; Sakhatskii, A. S.; Svanidze, A. V.

    2016-05-01

    The electric field-induced reorientation of a nematic liquid crystal in cells with a planar helicoidal or a homeoplanar structure of a director field is studied theoretically and experimentally. The dependences of the capacitances of these systems on the voltage in an applied electric field below and above the Fréedericksz threshold are experimentally obtained and numerically calculated. The calculations use the director distribution in volume that is obtained by direct minimization of free energy at various voltages. The inhomogeneity of the electric field inside a cell is taken into account. The calculation results are shown to agree with the experimental data.

  10. Effect of electric field and temperature gradient on the orientational dynamics of liquid crystals in a microvolume cylindrical cavity

    NASA Astrophysics Data System (ADS)

    Zakharov, A. V.; Vakulenko, A. A.; Romano, Silvano

    2009-10-01

    We have considered a homogeneously aligned liquid crystal (HALC) microvolume confined between two infinitely long horizontal coaxial cylinders and investigated dynamic field pumping, i.e., studied the interactions between director, velocity, and electric E fields as well as a radially applied temperature gradient ∇T, where the inner cylinder is kept at a lower temperature than the outer one. In order to elucidate the role of ∇T in producing hydrodynamic flow u, we have carried out a numerical study of a system of hydrodynamic equations including director reorientation, fluid flow, and temperature redistribution across the HALC cavity. Calculations show that only under the influence of ∇T does the initially quiescent HALC sample settle down to a stationary flow regime with horizontal component of velocity ueq(r). The effects of ∇T and of the size of the HALC cavity on magnitude and direction of ueq(r) have been investigated for a number of hydrodynamic regimes. Calculations also showed that E influences only the director redistribution across the HALC but not the magnitude of the velocity ueq(r).

  11. Liquid crystal-on-organic field-effect transistor sensory devices for perceptive sensing of ultralow intensity gas flow touch.

    PubMed

    Seo, Jooyeok; Park, Soohyeong; Nam, Sungho; Kim, Hwajeong; Kim, Youngkyoo

    2013-01-01

    We demonstrate liquid crystal-on-organic field-effect transistor (LC-on-OFET) sensory devices that can perceptively sense ultralow level gas flows. The LC-on-OFET devices were fabricated by mounting LC molecules (4-cyano-4'-pentylbiphenyl - 5CB) on the polymer channel layer of OFET. Results showed that the presence of LC molecules on the channel layer resulted in enhanced drain currents due to a strong dipole effect of LC molecules. Upon applying low intensity nitrogen gas flows, the drain current was sensitively increased depending on the intensity and time of nitrogen flows. The present LC-on-OFET devices could detect extremely low level nitrogen flows (0.7 sccm-11 μl/s), which could not be felt by human skins, thanks to a synergy effect between collective behavior of LC molecules and charge-sensitive channel layer of OFET. The similar sensation was also achieved using the LC-on-OFET devices with a polymer film skin, suggesting viable practical applications of the present LC-on-OFET sensory devices. PMID:23948946

  12. Liquid Crystal-on-Organic Field-Effect Transistor Sensory Devices for Perceptive Sensing of Ultralow Intensity Gas Flow Touch

    NASA Astrophysics Data System (ADS)

    Seo, Jooyeok; Park, Soohyeong; Nam, Sungho; Kim, Hwajeong; Kim, Youngkyoo

    2013-08-01

    We demonstrate liquid crystal-on-organic field-effect transistor (LC-on-OFET) sensory devices that can perceptively sense ultralow level gas flows. The LC-on-OFET devices were fabricated by mounting LC molecules (4-cyano-4'-pentylbiphenyl - 5CB) on the polymer channel layer of OFET. Results showed that the presence of LC molecules on the channel layer resulted in enhanced drain currents due to a strong dipole effect of LC molecules. Upon applying low intensity nitrogen gas flows, the drain current was sensitively increased depending on the intensity and time of nitrogen flows. The present LC-on-OFET devices could detect extremely low level nitrogen flows (0.7 sccm-11 μl/s), which could not be felt by human skins, thanks to a synergy effect between collective behavior of LC molecules and charge-sensitive channel layer of OFET. The similar sensation was also achieved using the LC-on-OFET devices with a polymer film skin, suggesting viable practical applications of the present LC-on-OFET sensory devices.

  13. Liquid Crystal-on-Organic Field-Effect Transistor Sensory Devices for Perceptive Sensing of Ultralow Intensity Gas Flow Touch

    PubMed Central

    Seo, Jooyeok; Park, Soohyeong; Nam, Sungho; Kim, Hwajeong; Kim, Youngkyoo

    2013-01-01

    We demonstrate liquid crystal-on-organic field-effect transistor (LC-on-OFET) sensory devices that can perceptively sense ultralow level gas flows. The LC-on-OFET devices were fabricated by mounting LC molecules (4-cyano-4′-pentylbiphenyl – 5CB) on the polymer channel layer of OFET. Results showed that the presence of LC molecules on the channel layer resulted in enhanced drain currents due to a strong dipole effect of LC molecules. Upon applying low intensity nitrogen gas flows, the drain current was sensitively increased depending on the intensity and time of nitrogen flows. The present LC-on-OFET devices could detect extremely low level nitrogen flows (0.7 sccm–11 μl/s), which could not be felt by human skins, thanks to a synergy effect between collective behavior of LC molecules and charge-sensitive channel layer of OFET. The similar sensation was also achieved using the LC-on-OFET devices with a polymer film skin, suggesting viable practical applications of the present LC-on-OFET sensory devices. PMID:23948946

  14. Pauli-limiting effects in the upper critical fields of a clean LiFeAs single crystal

    NASA Astrophysics Data System (ADS)

    Khim, Seunghyun; Lee, Bumsung; Kim, Jae Wook; Choi, Eun Sang; Stewart, G. R.; Kim, Kee Hoon

    2011-09-01

    We have investigated the temperature dependence of the upper critical field Hc2(T ) in a LiFeAs single crystal by direct measurements of resistivity under static magnetic fields up to 36 T. We find in the case of a magnetic field H along the ab plane that Hc2ab(0) = 30 T is clearly lower than the orbital limiting field Hc2orb,ab(0) = 39.6 T estimated by the |dHc2ab/dT |Tc, suggesting the presence of both Pauli- and orbital-limiting effects in the pair breaking process. The best fit of Hc2ab(T ) to the Werthamer-Helfand-Hohenberg formula results in the Maki parameter α = 0.9 and negligible spin-orbit scattering constant (λso = 0.0). On the other hand, for H along the c axis, Hc2c(T ) increases linearly down to our lowest temperature of 0.8 K, which can be explained by the multiband effects. The anisotropy ratio Hc2ab(T )/Hc2c(T ) is 3 near Tc and systematically decreases upon lowering temperature to become 1.3 at zero temperature. A comparative overview of the behavior of Hc2ab(T ) in various Fe-based superconductors shows that, similar to LiFeAs, the calculated Hc2orb,ab(0) is generally much larger than the measured Hc2ab(0) and thus finite α values ranging from ˜0.4 to 3 are necessary to describe the low temperature Hc2ab(T ) behaviors. Moreover, LiFeAs is found to have the smallest |dHc2ab/dT |Tc values, indicating that LiFeAs is one of the cleanest Fe-based superconductors with a finite Maki parameter. We also discuss the implications of multiband effects and spin-orbit scattering based on the finding that the estimated Pauli-limiting field is generally much larger than the BCS prediction in the Fe-based superconductors.

  15. Electronic transport within a quasi-two-dimensional model for rubrene single-crystal field effect transistors

    NASA Astrophysics Data System (ADS)

    Gargiulo, F.; Perroni, C. A.; Ramaglia, V. Marigliano; Cataudella, V.

    2011-12-01

    Spectral and transport properties of the quasi-two-dimensional adiabatic Su-Schrieffer-Heeger model are studied, adjusting the parameters in order to model rubrene single-crystal field effect transistors with small but finite density of injected charge carriers. We show that, with increasing temperature T, the chemical potential moves into the tail of the density of states corresponding to localized states, but this is not enough to drive the system into an insulating state. The mobility along different crystallographic directions is calculated, including vertex corrections that give rise to a transport lifetime one order of magnitude smaller than the spectral lifetime of the states involved in the transport mechanism. With increasing temperature, the transport properties reach the Ioffe-Regel limit, which is ascribed to less and less appreciable contribution of itinerant states to the conduction process. The model provides features of the mobility in close agreement with experiments: right order of magnitude, scaling as a power law T-γ (with γ close or larger than two), and correct anisotropy ratio between different in-plane directions. Due to a realistic high-dimensional model, the results are not biased by uncontrolled approximations.

  16. The Effect of Dissolved Side-Group Polymers on Pattern Dynamics in Nematic Liquid Crystals in a Rotating Magnetic Field

    NASA Astrophysics Data System (ADS)

    Pashkovsky, E. E.; Stille, W.; Strobl, G.; Talebi, D.

    1997-05-01

    Patterns formed by inversion walls in nematic layers exposed to a rotating magnetic field were studied. Dilute solutions of a mesogenic side group polymethacrylate in a low molecular weight liquid crystal (5CB) were used in comparison with the pure solvent. As found in a previous work, in this system the intensity of backflow (fluid flow induced by director rotation) can be controlled by the polymer concentration due to a specific increase of shear viscosity coefficients. In the synchronous regime of director rotation no significant effects of backflow on the dynamics of the walls are observed. Dynamic solitons known from the synchronous regime were also found at asynchronous rotation, when soliton lattices are formed by continuous nucleation. Here comparison with theory for given values of the lattice period shows soliton currents significantly reduced by backflow. Two of the three additional pattern forming states exclusively found at asynchronous rotation were completely suppressed in solutions with sufficient polymer concentration. The third of these states is affected by backflow in the growth rate of its patterns. Numerical calculations were performed to explain behavior of the patterns in the asynchronous state. For pure 5CB a quantitative comparison with the experiment was possible.

  17. Nonlinear elastic effects in phase field crystal and amplitude equations: Comparison to ab initio simulations of bcc metals and graphene

    NASA Astrophysics Data System (ADS)

    Hüter, Claas; Friák, Martin; Weikamp, Marc; Neugebauer, Jörg; Goldenfeld, Nigel; Svendsen, Bob; Spatschek, Robert

    2016-06-01

    We investigate nonlinear elastic deformations in the phase field crystal model and derived amplitude equation formulations. Two sources of nonlinearity are found, one of them is based on geometric nonlinearity expressed through a finite strain tensor. This strain tensor is based on the inverse right Cauchy-Green deformation tensor and correctly describes the strain dependence of the stiffness for anisotropic and isotropic behavior. In isotropic one- and two-dimensional situations, the elastic energy can be expressed equivalently through the left deformation tensor. The predicted isotropic low-temperature nonlinear elastic effects are directly related to the Birch-Murnaghan equation of state with bulk modulus derivative K'=4 for bcc. A two-dimensional generalization suggests K2D '=5 . These predictions are in agreement with ab initio results for large strain bulk deformations of various bcc elements and graphene. Physical nonlinearity arises if the strain dependence of the density wave amplitudes is taken into account and leads to elastic weakening. For anisotropic deformation, the magnitudes of the amplitudes depend on their relative orientation to the applied strain.

  18. Precise Characterisation of Molecular Orientation in a Single Crystal Field-Effect Transistor Using Polarised Raman Spectroscopy.

    PubMed

    Wood, Sebastian; Rigas, Grigorios-Panagiotis; Zoladek-Lemanczyk, Alina; Blakesley, James C; Georgakopoulos, Stamatis; Mas-Torrent, Marta; Shkunov, Maxim; Castro, Fernando A

    2016-01-01

    Charge transport in organic semiconductors is strongly dependent on the molecular orientation and packing, such that manipulation of this molecular packing is a proven technique for enhancing the charge mobility in organic transistors. However, quantitative measurements of molecular orientation in micrometre-scale structures are experimentally challenging. Several research groups have suggested polarised Raman spectroscopy as a suitable technique for these measurements and have been able to partially characterise molecular orientations using one or two orientation parameters. Here we demonstrate a new approach that allows quantitative measurements of molecular orientations in terms of three parameters, offering the complete characterisation of a three-dimensional orientation. We apply this new method to organic semiconductor molecules in a single crystal field-effect transistor in order to correlate the measured orientation with charge carrier mobility measurements. This approach offers the opportunity for micrometre resolution (diffraction limited) spatial mapping of molecular orientation using bench-top apparatus, enabling a rational approach towards controlling this orientation to achieve optimum device performance. PMID:27619423

  19. Simultaneous monitoring of protein adsorption kinetics using a quartz crystal microbalance and field-effect transistor integrated device.

    PubMed

    Goda, Tatsuro; Maeda, Yasuhiro; Miyahara, Yuji

    2012-09-01

    We developed an integrated device comprising a quartz crystal microbalance (QCM) and a field-effect transistor (FET) with a single common gold electrode in a flow chamber. An alternating current inducing oscillations in the piezoelectric quartz of the QCM sensor is electrically independent of the circuit for the FET output so that the two sensors in different detection mechanisms simultaneously record binding kinetics from a single protein solution on the same electrode. A conjunction of adsorbed mass from QCM with electric nature of bound protein from FET provided deeper understanding on a complex process of nonspecific protein adsorption and subsequent conformational changes at a solid/liquid interface. Lower apparent k(on) values obtained by FET than those obtained by QCM on hydrophobic surfaces are interpreted as preferred binding of protein molecules facing uncharged domains to the electrode surface, whereas higher k(off) values by FET than those by QCM imply active macromolecular rearrangements on the surfaces mainly driven by hydrophobic association in an aqueous medium. The advanced features of the combined sensor including in situ, label-free, and real-time monitoring provide information on structural dynamics, beyond measurements of affinities and kinetics in biological binding reactions. PMID:22861174

  20. Amplified Emission and Field-Effect Transistor Characteristics of One-Dimensionally Structured 2,5-Bis(4-biphenylyl)thiophene Crystals.

    PubMed

    Hashimoto, Kazumasa; Sasaki, Fumio; Hotta, Shu; Yanagi, Hisao

    2016-04-01

    One-dimensional (1D) structures of 2,5-bis(4-biphenylyl)thiophene (BP1T) crystals are fabricated for light amplification and field-effect transistor (FET) measurements. A strip-shaped 1D structure (10 µm width) made by photolitography of a vapor-deposited polycrystalline film shows amplified spontaneous emission and lasing oscillations under optical pumping. An FET fabricated with this 1D structure exhibits hole-conduction with a mobility of µh = 8.0 x 10(-3) cm2/Vs. Another 1 D-structured FET is fabricated with epitaxially grown needle-like crystals of BP1T. This needle-crystal FET exhibits higher mobility of µh = 0.34 cm2/Vs. This improved hole mobility is attributed to the single-crystal channel of epitaxial needles while the grain boudaries in the polycrystalline 1 D-structure decrease the carrier transport. PMID:27451604

  1. Local Field Modulation Induced Three-Order Upconversion Enhancement: Combining Surface Plasmon Effect and Photonic Crystal Effect.

    PubMed

    Yin, Ze; Li, Hang; Xu, Wen; Cui, Shaobo; Zhou, Donglei; Chen, Xu; Zhu, Yongsheng; Qin, Guanshi; Song, Hongwei

    2016-04-01

    A 2D surface plasmon photonic crystal (SPPC) is achieved by implanting gold nanorods onto the periodic surface apertures of the poly(methyl methacrylate) (PMMA) opal photonic crystals. On the surface of the SPPC, the overall upconversion luminescence intensity of NaYF4 :Yb(3+) , Er(3+) under 980 nm excitation is improved more than 10(3) fold. The device is easily shifted to a transparent flexible substrate, applied to flexible displays. PMID:26833556

  2. Effect of external electric field and background illumination on the intensity distribution of optical surface waves in the metal – photorefractive crystal system

    SciTech Connect

    Akhmedzhanov, I M

    2013-11-30

    The influence of the external electric field and background illumination on the intensity distribution of optical photorefractive surface waves at the metal – photorefractive crystal interface has been numerically simulated. The simulation is performed for a strontium – barium niobate (SBN) crystal using the parameters corresponding to the experimental data. The replacement of a real metal with an ideal one and the choice of the corresponding boundary conditions (depending on the wave power) in the numerical simulation have been substantiated. The calculation results have shown good agreement with the previously published experimental data on the effect of background illumination and a significant discrepancy for the data on the effect of the external electric field. It is found that the effect of the external electric field can be significantly enhanced by reducing the optical power of the photorefractive wave to values close to the threshold ones. (nonlinear optical phenomena)

  3. Crystallization of insulin and lysozyme under reduced convection condition in a large gradient magnetic field

    NASA Astrophysics Data System (ADS)

    Yin, D. C.; Wakayama, N. I.; Fujiwara, M.; Harata, K.; Xue, X. P.; Fu, Z. X.; Zhang, S. W.; Shang, P.; Tanimoto, Y.

    The crystallization of protein from solution is governed by the process of transport phenomenon Any reason affecting the process of solute transport will impose effects on the crystallization process thus further affects the crystal quality Recent advancement in superconducting magnet technology makes it possible to provide a low cost long-time durable low effective gravity environment for the control of convection which is similar to the environment in the space As an ideal means to damp natural convection in a non-conductive solution on the Earth it may find applications in the field of protein crystallization In this presentation the authors investigated the crystallization of orthorhombic lysozyme crystals tetragonal lysozyme crystals and insulin crystals in a large gradient magnetic field Three effective gravity levels were used milli-gravity around 0G normal gravity 1G and hypergravity 1 8G Comparisons of the crystal quality obtained inside and outside the magnetic field showed that both the magnetic field and the effective gravity could affect the crystal quality But the effect also depends on the crystal and protein type For lysozyme crystals in tetragonal form the magnetic field and effective gravity showed no obvious effect on the quality whereas for the crystals in orthorhombic form both the magnetic field and effective gravity improved the crystal quality For insulin crystal which is highly symmetrical magnetic field and effective gravity showed no strong effect on the crystal quality It is well known that

  4. Effect of a High Magnetic Field on Microstructures of Ni-Based Single Crystal Superalloy During Seed Melt-Back

    NASA Astrophysics Data System (ADS)

    Xuan, Weidong; Liu, Huan; Li, Chuanjun; Ren, Zhongming; Zhong, Yunbo; Li, Xi; Cao, Guanghui

    2016-04-01

    The effects of a high magnetic field on microstructures during seed melt-back of superalloy were investigated. Experimental results indicated that the high magnetic field significantly modified the melt-back interface shape and the melt-back zone length. In addition, stray grain on the edge of sample was effectively suppressed in the high magnetic field. Based on experimental results and quantitative analysis, the above results should be attributed to the increasing temperature gradient in a high magnetic field.

  5. Crystal growth under external electric fields

    SciTech Connect

    Uda, Satoshi; Koizumi, Haruhiko; Nozawa, Jun; Fujiwara, Kozo

    2014-10-06

    This is a review article concerning the crystal growth under external electric fields that has been studied in our lab for the past 10 years. An external field is applied electrostatically either through an electrically insulating phase or a direct injection of an electric current to the solid-interface-liquid. The former changes the chemical potential of both solid and liquid and controls the phase relationship while the latter modifies the transport and partitioning of ionic solutes in the oxide melt during crystallization and changes the solute distribution in the crystal.

  6. Grain boundary barrier modification due to coupling effect of crystal polar field and water molecular dipole in ZnO-based structures

    SciTech Connect

    Ji, Xu; Zhu, Yuan E-mail: phzktang@ust.hk; Chen, Mingming; Su, Longxing; Chen, Anqi; Zhao, Chengchun; Gui, Xuchun; Xiang, Rong; Huang, Feng; Tang, Zikang E-mail: phzktang@ust.hk

    2014-06-16

    Surface water molecules induced grain boundaries (GBs) barrier modification was investigated in ZnO and ZnMgO/ZnO films. Tunable electronic transport properties of the samples by water were characterized via a field effect transistor (FET) device structure. The FETs fabricated from polar C-plane ZnO and ZnMgO/ZnO films that have lots of GBs exhibited obvious double Schottky-like current-voltage property, whereas that fabricated from nonpolar M-plane samples with GBs and ZnO bulk single-crystal had no obvious conduction modulation effects. Physically, these hallmark properties are supposed to be caused by the electrostatical coupling effect of crystal polar field and molecular dipole on GBs barrier.

  7. Magnetic Field Induced Phase Transitions in Gd5(Si1.95Ge2.05)Single Crystal and the Anisotropic Magnetocaloric Effect

    SciTech Connect

    H. Tang; V.K. Pecharsky; A.O. Pecharsky; D.L. Schlagel; T.A. Lograsso; K.A. Gschneidner,jr.

    2004-09-30

    The magnetization measurements using a Gd{sub 5}(Si{sub 1.95}Ge{sub 2.05}) single crystal with the magnetic field applied along three crystallographic directions, [001], [010] and [100], were carried out as function of applied field (0-56 kOe) at various temperatures ({approx}5-320 K). The magnetic-field induced phase transformations at temperature above the zero-field critical temperature, i.e. the paramagnetic (PM) {leftrightarrow} ferromagnetic (FM) transitions with application or removal of magnetic field, are found to be temperature dependent and hysteretic. The corresponding critical fields increase with increasing temperature. The magnetic field (H)-temperature (T) phase diagrams have been constructed for the Gd{sub 5}(Si{sub 1.95}Ge{sub 2.05}) single crystal with field along the three directions. A small anisotropy has been observed. The magnetocaloric effect (MCE) has been calculated from the isothermal magnetization data, and the observed anisotropy correlates with H-T phase diagrams. The results are discussed in connection with the magnetic-field induced martensitic-like structural transition observed in the Gd{sub 5}(Si{sub 2}Ge{sub 2})-type compounds.

  8. Magnetic measurements on Pr (BrO3)3 ṡ 9H2O single crystal and a study of the effects and origin of the crystal field

    NASA Astrophysics Data System (ADS)

    Neogy, D.; Purohit, T.; Chatterji, A.

    1986-02-01

    Praseodymium bromate was prepared from Pr2O3 and the single crystals of Pr (BrO3)3 ṡ 9H2O were grown. The principal magnetic susceptibility χ⊥ and the anisotropy χ∥-χ⊥ was measured in the range 300-90 K. The variation of the average magnetic moment peff with temperature is appreciable showing a deviation from the Curie law. The magnetic anistropy χ∥-χ⊥ is found to be much higher than in Pr-ethylsulfate where the Pr3+ ion occupies a site very similar to that in PrBR. A crystal field analysis with a field of D3h symmetry is found to provide an excellent account of the magnetic properties observed by us and Simizu et al. [J. Appl. Phys. 55, 2333 (1984)] from 300 K down to ˜0.06 K. The Hamiltonian was diagonalized in the complete basis of the 3H ground term taking care of the intermediate coupling effects to a large extent. Some important predictions on the electronic heat capacity and the electric quadrupole splitting have been made. An estimate of the crystal field parameters has been made using the available structural data on the crystal and the results are discussed in the light of our phenomenological set of parameters.

  9. Crystal growth under microgravity conditions with using of magnetic fields

    NASA Astrophysics Data System (ADS)

    Feonychev, A.; Bondareva, N.

    The peculiarities of melt flows and crystal growth by the Bridgman and floating zone methods aboard spacecrafts under the action of steady axial or rotating magnetic field are considered. Steady magnetic field can minimize adverse effect of residual accelerations and vibrations on dopant segregation in crystals growing by the Bridgman method but it requires using strong magnetic fields, which induces specific oscillations. Under strong convection in terrestrial conditions steady magnetic field gives positive effect. Under growth of small-sized crystals by the floating zone method in microgravity conditions an use of steady magnetic field brings into dramatic increase of radial segregation due to convective vortex to free fluid surface. The flows being created by rotating magnetic field and resultant under combination of Marangoni convection with rotating magnetic field were studied for wide range of parameters including the regimes of oscillatory (turbulent) convection. Mathematical model and computer program was tested by published results of two experiments. The dependence of transition from laminar to oscillatory flow was obtained for different boundary conditions, geometric parameters of fluid and intensity of magnetic field. Specific oscillations with very low frequency and oscillations of the beating type had been discovered under the action rotating magnetic field on Marangoni convection. The mutual influence of rotating magnetic field and thermocapillary convection on flow stability was noted. Use of rotating magnetic field under crystal growth by floating zone method leads to reduction of azimuth velocity which is responsible for origin of oscillatory convection and striation of crystals. It was shown on concrete examples that there is a possibility to reduce radial segregation under optimization of rotating velocity and intensity of magnetic field. For the Bridgman method (in general for ampoule methods of crystal growth), the use of rotating magnetic

  10. Effect of surface anchoring energy on electro-optic characteristics of a fringe-field switching liquid crystal cell

    NASA Astrophysics Data System (ADS)

    Kim, Jin Hyun; Kang, Wan Seok; Sol Choi, Han; Park, Kiwoong; Lee, Joong Hee; Yoon, Sangho; Yoon, Sukin; Lee, Gi-Dong; Lee, Seung Hee

    2015-11-01

    Surface anchoring strength of the alignment layer on liquid crystal (LC) determines electro-optic characteristics in the LC devices. This paper investigates how azimuthal and polar anchoring strength affects the electro-optic performance of a fringe-field switching (FFS) mode associated with electrode structure, cell gap and dielectric anisotropy of the LC by numerical simulation. Our important findings in the FFS mode are that both azimuthal and polar anchoring energy can considerably affect the operating voltage and also maximum transmittance when using a LC with positive dielectric anisotropy; however, when using a LC with negative dielectric anisotropy only azimuthal anchoring energy affects electro-optic characteristics. The study proposes an optimal design of an alignment layer for maximizing transmittance in the FFS mode.

  11. Effects of composition and temperature on the large field behavior of [011]{sub C} relaxor ferroelectric single crystals

    SciTech Connect

    Gallagher, John A.; Lynch, Christopher S.; Tian, Jian

    2014-08-04

    The large field behavior of [011]{sub C} cut relaxor ferroelectric lead indium niobate–lead magnesium niobate–lead titanate, xPb(In{sub 1/2}Nb{sub 1/2})O{sub 3}-(1-x-y)Pb(Mg{sub 1/3}Nb{sub 2/3})O{sub 3}-yPbTiO{sub 3}, single crystals was experimentally characterized in the piezoelectric d{sub 322}-mode configuration under combined mechanical, electrical, and thermal loading. Increasing the concentration of lead indium niobate and decreasing the concentration of lead titanate in compositions near the morphotropic phase boundary resulted in a decrease of mechanical compliance, dielectric permittivity, and piezoelectric coefficients as well as a shift from a continuous to a discontinuous transformation.

  12. Fluorination of Metal Phthalocyanines: Single-Crystal Growth, Efficient N-Channel Organic Field-Effect Transistors, and Structure-Property Relationships

    NASA Astrophysics Data System (ADS)

    Jiang, Hui; Ye, Jun; Hu, Peng; Wei, Fengxia; Du, Kezhao; Wang, Ning; Ba, Te; Feng, Shuanglong; Kloc, Christian

    2014-12-01

    The fluorination of p-type metal phthalocyanines produces n-type semiconductors, allowing the design of organic electronic circuits that contain inexpensive heterojunctions made from chemically and thermally stable p- and n-type organic semiconductors. For the evaluation of close to intrinsic transport properties, high-quality centimeter-sized single crystals of F16CuPc, F16CoPc and F16ZnPc have been grown. New crystal structures of F16CuPc, F16CoPc and F16ZnPc have been determined. Organic single-crystal field-effect transistors have been fabricated to study the effects of the central metal atom on their charge transport properties. The F16ZnPc has the highest electron mobility (~1.1 cm2 V-1 s-1). Theoretical calculations indicate that the crystal structure and electronic structure of the central metal atom determine the transport properties of fluorinated metal phthalocyanines.

  13. Fluorination of Metal Phthalocyanines: Single-Crystal Growth, Efficient N-Channel Organic Field-Effect Transistors, and Structure-Property Relationships

    PubMed Central

    Jiang, Hui; Ye, Jun; Hu, Peng; Wei, Fengxia; Du, Kezhao; Wang, Ning; Ba, Te; Feng, Shuanglong; Kloc, Christian

    2014-01-01

    The fluorination of p-type metal phthalocyanines produces n-type semiconductors, allowing the design of organic electronic circuits that contain inexpensive heterojunctions made from chemically and thermally stable p- and n-type organic semiconductors. For the evaluation of close to intrinsic transport properties, high-quality centimeter-sized single crystals of F16CuPc, F16CoPc and F16ZnPc have been grown. New crystal structures of F16CuPc, F16CoPc and F16ZnPc have been determined. Organic single-crystal field-effect transistors have been fabricated to study the effects of the central metal atom on their charge transport properties. The F16ZnPc has the highest electron mobility (~1.1 cm2 V−1 s−1). Theoretical calculations indicate that the crystal structure and electronic structure of the central metal atom determine the transport properties of fluorinated metal phthalocyanines. PMID:25524460

  14. The effect of an electric field on the morphological stability of the crystal-melt interface of a binary alloy. III - Weakly nonlinear theory

    NASA Technical Reports Server (NTRS)

    Wheeler, A. A.; Mcfadden, G. B.; Coriell, S. R.; Hurle, D. T. J.

    1990-01-01

    The effect of a constant electric current on the crystal-melt interface morphology during directional solidification at constant velocity of a binary alloy is considered. A linear temperature field is assumed, and thermoelectric effects and Joule heating are neglected; electromigration and differing electrical conductivities of crystal and melt are taken into account. A two-dimensional weakly nonlinear analysis is carried out to third order in the interface amplitude, resulting in a cubic amplitude equation that describes whether the bifurcation from the planar state is supercritical or subcritical. For wavelengths corresponding to the most dangerous mode of linear theory, the demarcation between supercritical and subcritical behavior is calculated as a function of processing conditions and material parameters. The bifurcation behavior is a sensitive function of the magnitude and direction of the electric current and of the electrical conductivity ratio.

  15. Observation of high field DHVA-effect and induced magnetism in single crystal TiBe/sub 2/

    SciTech Connect

    van Deursen, A.P.J.; van Ruitenbeek, J.M.; Verhoef, W.A.; de Vroomen, A.R.; Smith, J.L.; de Groot, R.A.; Koelling, D.D.; Mueller, F.M.

    1981-01-01

    Recently much interest has been given to itinerant magnetism in cubic Laves phase or C15 materials. Primarily this stems from the discussion of the relationship of p-state pairing and ferromagnetism in ZrZn/sub 2/ by Enz and Matthias, and the possibility of triplet superconductivity. The most recent work in this field has focused on the isoelectronic, isostructural material TiBe/sub 2/, and the possibility that this material is metamagnetic. That TiBe/sub 2/ is close to some form of magnetic instability can be infered indirectly from the peaked nature of its density of states near the fermi level, but also from the observation of ferromagnetism in TiBe/sub 2-x/Cu/sub x/, when x is greater than about 0.15. In this paper a single crystal of pure TiBe/sub 2/ is considered in fields larger than 15 Tesla (T) and at a temperature of 1.3/sup 0/K.

  16. Statistical electric field and switching time distributions in PZT 1Nb2Sr ceramics: Crystal- and microstructure effects

    NASA Astrophysics Data System (ADS)

    Zhukov, Sergey; Kungl, Hans; Genenko, Yuri A.; von Seggern, Heinz

    2014-01-01

    Dispersive polarization response of ferroelectric PZT ceramics is analyzed assuming the inhomogeneous field mechanism of polarization switching. In terms of this model, the local polarization switching proceeds according to the Kolmogorov-Avrami-Ishibashi scenario with the switching time determined by the local electric field. As a result, the total polarization reversal is dominated by the statistical distribution of the local field magnitudes. Microscopic parameters of this model (the high-field switching time and the activation field) as well as the statistical field and consequent switching time distributions due to disorder at a mesoscopic scale can be directly determined from a set of experiments measuring the time dependence of the total polarization switching, when applying electric fields of different magnitudes. PZT 1Nb2Sr ceramics with Zr/Ti ratios 51.5/48.5, 52.25/47.75, and 60/40 with four different grain sizes each were analyzed following this approach. Pronounced differences of field and switching time distributions were found depending on the Zr/Ti ratios. Varying grain size also affects polarization reversal parameters, but in another way. The field distributions remain almost constant with grain size whereas switching times and activation field tend to decrease with increasing grain size. The quantitative changes of the latter parameters with grain size are very different depending on composition. The origin of the effects on the field and switching time distributions are related to differences in structural and microstructural characteristics of the materials and are discussed with respect to the hysteresis loops observed under bipolar electrical cycling.

  17. Unifying the crystallization behavior of hexagonal and square crystals with the phase-field-crystal model

    NASA Astrophysics Data System (ADS)

    Tao, Yang; Zheng, Chen; Jing, Zhang; Yongxin, Wang; Yanli, Lu

    2016-03-01

    By employing the phase-field-crystal models, the atomic crystallization process of hexagonal and square crystals is investigated with the emphasis on the growth mechanism and morphological change. A unified regime describing the crystallization behavior of both crystals is obtained with the thermodynamic driving force varying. By increasing the driving force, both crystals (in the steady-state) transform from a faceted polygon to an apex-bulged polygon, and then into a symmetric dendrite. For the faceted polygon, the interface advances by a layer-by-layer (LL) mode while for the apex-bulged polygonal and the dendritic crystals, it first adopts the LL mode and then transits into the multi-layer (ML) mode in the later stage. In particular, a shift of the nucleation sites from the face center to the area around the crystal tips is detected in the early growth stage of both crystals and is rationalized in terms of the relation between the crystal size and the driving force distribution. Finally, a parameter characterizing the complex shape change of square crystal is introduced. Project supported by the National Natural Science Foundation of China (Grant Nos. 54175378, 51474176, and 51274167), the Natural Science Foundation of Shaanxi Province, China (Grant No. 2014JM7261), and the Doctoral Foundation Program of Ministry of China (Grant No. 20136102120021).

  18. Birefringence of the antiferromagnetic crystals linear in a magnetic field

    NASA Astrophysics Data System (ADS)

    Eremenko, V. V.; Kharchenko, N. F.; Beliy, L. I.; Tutakina, O. P.

    1980-01-01

    The new linear magneto-optical effect-birefringence-of a linear polarized light which is directly proportional to the magnetic field strength has been observed. This effect is permitted in crystals which allow piezo-magnetic properties. One was studied in antiferromagnet CoF 2 and CoCO 3 for the longitudinal geometry of an experiment.

  19. Magnetic properties of Ce{sup 3+} in Pb{sub 1{minus}x}Ce{sub x}Se: Kondo and crystal-field effect

    SciTech Connect

    Gratens, X.; Charar, S.; Averous, M.; Isber, S.; Deportes, J.; Golacki, Z.

    1997-10-01

    Electron paramagnetic resonance (EPR) experiments were performed on a Pb{sub 1{minus}x}Ce{sub x}Se crystal at liquid-helium temperatures and show very clearly that the doublet {Gamma}{sub 7} is the ground state for cerium ions. The cubic symmetry is shown and the effective Land{acute e} factor for the Ce{sup 3+} is determined to be 1.354{plus_minus}0.003. An orbital reduction factor is introduced to explain the g experimental value. High-field magnetization results are in good agreement with the EPR results. The nominal Ce composition in PbSe deduced from saturation of the magnetization, x=0.0405{plus_minus}0.0003, is very closed to the value determined by microprobe analysis (x=0.04). At 1.5 K, an antiferromagnetic interaction between the nearest-neighbor cerium atoms is found, J{sub ex}/k{sub B}={minus}0.715thinspK. The low-field magnetic-susceptibility results show that the magnetic moment of cerium impurities is strongly temperature dependent, explained by the presence of the crystal-field effect and the Kondo effect. {copyright} {ital 1997} {ital The American Physical Society}

  20. Electric-field-assisted convective assembly of colloidal crystal coatings.

    PubMed

    Kleinert, Jairus; Kim, Sejong; Velev, Orlin D

    2010-06-15

    A new technique that combines evaporative convective deposition of colloidal crystal coatings with an electric field to achieve more rapid assembly and reduce the defects in the crystal structure is reported. When an ac voltage is applied across the particle suspension and the substrate in the convective assembly process, a longer film spreads from the meniscus by the electrowetting-on-dielectric (EWOD) effect. The data suggest that the EWOD-increased liquid surface area results in increased evaporation-driven particle flux and crystal assembly that is up to five times more rapid. The extended drying film also provides more time for particle rearrangement before the structure becomes fixed, resulting in formation of crystal domains an order of magnitude larger than those deposited by convective assembly alone. The results demonstrate that EWOD is a facile tool for controlling particle assembly processes in wetting films. The technique could be used in improved large-scale colloidal crystal coating processes. PMID:20465234

  1. Consistent Hydrodynamics for Phase Field Crystals.

    PubMed

    Heinonen, V; Achim, C V; Kosterlitz, J M; Ying, See-Chen; Lowengrub, J; Ala-Nissila, T

    2016-01-15

    We use the amplitude expansion in the phase field crystal framework to formulate an approach where the fields describing the microscopic structure of the material are coupled to a hydrodynamic velocity field. The model is shown to reduce to the well-known macroscopic theories in appropriate limits, including compressible Navier-Stokes and wave equations. Moreover, we show that the dynamics proposed allows for long wavelength phonon modes and demonstrate the theory numerically showing that the elastic excitations in the system are relaxed through phonon emission. PMID:26824543

  2. Phase-Field Simulations of Crystal Growth

    NASA Astrophysics Data System (ADS)

    Plapp, Mathis

    2010-07-01

    This course gives an elementary introduction to the phase-field method and to its applications for the modeling of crystal growth. Two different interpretations of the phase-field variable are given and discussed. It can be seen as a physical order parameter that characterizes a phase transition, or as a smoothed indicator function that tracks domain boundaries. Elementary phase-field models for solidification and epitaxial growth are presented and are applied to the dendritic growth of a pure substance and the step-flow growth on a vicinal surface.

  3. Effect of an applied electric field on a weakly anchored non-planar Nematic Liquid Crystal (NLC) layer

    NASA Astrophysics Data System (ADS)

    Mema, Ensela; Cummings, Linda J.; Kondic, Lou

    We consider a mathematical model that consists of a NLC layer sandwiched between two parallel bounding plates, across which an external field is applied. We investigate its effect on the director orientation by considering the dielectric and flexoelectric contributions and varying parameters that represent the anchoring conditions and the electric field strength. In particular, we investigate possible director configurations that occur in weakly anchored and non-planar systems. We observe that non-planar anchoring angles destroy any hysteresis seen in a planar system by eliminating the fully vertical director configuration and the ''saturation threshold'' seen in weakly anchored planar Freedericksz cells. Supported by NSF Grant No. DMS-1211713.

  4. Electric field induced biaxiality and the electro-optic effect in a bent-core nematic liquid crystal

    NASA Astrophysics Data System (ADS)

    Nagaraj, Mamatha; Panarin, Y. P.; Manna, U.; Vij, J. K.; Keith, C.; Tschierske, C.

    2010-01-01

    We report the observation of a biaxial nematic phase in a bent-core molecular system using polarizing microscopy, electro-optics, and dielectric spectroscopy, where we find that the biaxiality exists on a microscopic scale. An application of electric field induces a macroscopic biaxiality and in consequence gives rise to electro-optic switching. This electro-optic effect shows significant potential in applications for displays due to its fast high-contrast response. The observed electro-optic switching is explained in terms of the interaction of the ferroelectric clusters with the electric field.

  5. Entropy change of a Ni45.5Co4.5Mn37In13 single crystal studied by scanning calorimetry in high magnetic fields: Field dependence of the magnetocaloric effect

    NASA Astrophysics Data System (ADS)

    Bourgault, D.; Porcar, L.; Rivoirard, S.; Courtois, P.; Hardy, V.

    2015-08-01

    By using differential scanning calorimetry, direct entropy variations have been recorded along the martensitic transformation of a Ni45.5Co4.5Mn37In13 single crystal in various magnetic fields. A large negative magnetocaloric effect associated to the transformation from virtually non-magnetic martensite to ferromagnetic austenite coexists with a weaker, positive effect related to the Curie transition in the latter phase. It is shown that the field-dependence of the maximum isothermal entropy change can be modelized by taking into account the interplay of both magnetocaloric contributions, as well as the intrinsic width of the martensitic transformation.

  6. Organic Memory Devices: 2D Mica Crystal as Electret in Organic Field-Effect Transistors for Multistate Memory (Adv. Mater. 19/2016).

    PubMed

    Zhang, Xiaotao; He, Yudong; Li, Rongjin; Dong, Huanli; Hu, Wenping

    2016-05-01

    R. Li, H. Dong, and co-workers describe the exfoliation of cheap and abundant minerals, such as mica, into nanometer-thick 2D crystals with atomically flat surfaces. As described on page 3755, the application of the 2D electret in organic field-effect transistors is well-suited for flexible nonvolatile memory devices. Stored information can be retrieved even after power cycling. Moreover, the devices can be used as full-function transistors with a low-resistance and a high-resistance state. PMID:27167032

  7. Anisotropy of the upper critical fields and the paramagnetic Meissner effect in La1.85Sr0.15CuO4 single crystals

    NASA Astrophysics Data System (ADS)

    Felner, I.; Tsindlekht, M. I.; Drachuck, G.; Keren, A.

    2013-02-01

    Optimally doped La1.85Sr0.15CuO4 single crystals have been investigated by dc and ac magnetic measurements. These crystals have rectangular needle-like shapes with the long needle axis parallel to the crystallographic c axis (c-crystal) or parallel to the basal planes (a-crystal). In both crystals, the temperature dependence of the upper critical fields (HC2) and the surface critical field (HC3) were measured. The H-T phase diagram is presented. Close to TC = 35 K, for the c-crystal, {\\boldsymbol{\\gamma}}^{c}={H}_{{C3}}^{c}/{H}_{{C2}}^{c}=1.8 0(2), whereas for the a-crystal the {\\boldsymbol{\\gamma}}^{a}={H}_{{C3}}^{a}/{H}_{{C2}}^{a}=4.0(2) obtained is much higher than 1.69, predicted by the ideal mathematical model. At low applied dc fields, positive field-cooled branches known as the ‘paramagnetic Meissner effect’ (PME) are observed; their magnitude is inversely proportional to H. The anisotropic PME is observed in both a- and c-crystals, only when the applied field is along the basal planes. It is speculated that the high γa and the PME are connected to each other.

  8. Magnetic ordering and crystal field effects in quasi-caged structure compound PrFe2Al8

    NASA Astrophysics Data System (ADS)

    Nair, Harikrishnan S.; Ghosh, Sarit K.; Ramesh Kumar, K.; Strydom, André M.

    2016-04-01

    The compound PrFe2Al8 possesses a three-dimensional network structure resulting from the packing of Al polyhedra centered at the transition metal element Fe and the rare earth Pr. Along the c-axis, Fe and Pr form chains which are separated from each other by the Al-network. In this paper, the magnetism and crystalline electric field effects in PrFe2Al8 are investigated through the analysis of magnetization and specific heat data. A magnetic phase transition in the Pr lattice is identified at TNPr ≈ 4 K in dc magnetization and ac susceptibility data. At 2 K, the magnetization isotherm presents a ferromagnetic saturation, however, failing to reach full spin-only ferromagnetic moment of Pr3+. Metamagnetic step-like low-field features are present in the magnetization curve at 2 K which is shown to shift upon field-cooling the material. Arrott plots centered around TPrN display "S"-like features suggestive of an inhomogeneous magnetic state. The magnetic entropy, Sm, estimated from specific heat outputs a value of R ln(2) at TN2 suggesting a doublet state for Pr3+. The magnetic specific heat is modeled by using a 9-level Schottky equation pertinent to the Pr3+ ion with J=4. Given the crystalline electric field situation of Pr3+, the inference of a doublet state from specific heat and consequent long-range magnetic order is an unexpected result.

  9. Realization of high-performance hetero-field-effect-transistor-type ultraviolet photosensors using p-type GaN comprising three-dimensional island crystals

    NASA Astrophysics Data System (ADS)

    Yamamoto, Yuma; Yoshikawa, Akira; Kusafuka, Toshiki; Okumura, Toshiki; Iwaya, Motoaki; Takeuchi, Tetsuya; Kamiyama, Satoshi; Akasaki, Isamu

    2016-05-01

    High-performance AlGaN/AlGaN hetero-field-effect-transistor (HFET)-type photosensors with high photosensitivity were fabricated using p-type GaN comprising three-dimensional island crystals. The p-type GaN layers were grown on AlGaN layers at a high AlN molar fraction, and the area of p-type GaN comprising three-dimensional island crystals increased as the thickness of the p-type GaN film decreased, resulting in a reduced p-type GaN coverage ratio. The p-type GaN layers comprising three-dimensional island crystals and showing low coverage ratios were then used to fabricate HFET-type photosensors with high photosensitivity. A high light sensitivity of 1.5 × 104 A/W was obtained at a source–drain voltage (V SD) of 0.5 V for a photosensor with a p-type GaN thickness of 20 nm. Moreover, the dark current was suppressed to 10‑10 A/mm and the photosensor achieved an extremely high photocurrent to dark current density ratio.

  10. Ferromagnetic Switching of Knotted Vector Fields in Liquid Crystal Colloids.

    PubMed

    Zhang, Qiaoxuan; Ackerman, Paul J; Liu, Qingkun; Smalyukh, Ivan I

    2015-08-28

    We experimentally realize polydomain and monodomain chiral ferromagnetic liquid crystal colloids that exhibit solitonic and knotted vector field configurations. Formed by dispersions of ferromagnetic nanoplatelets in chiral nematic liquid crystals, these colloidal ferromagnets exhibit spontaneous long-range alignment of magnetic dipole moments of individual platelets, giving rise to a continuum of the magnetization field M(r). Competing effects of surface confinement and chirality prompt spontaneous formation and enable the optical generation of localized twisted solitonic structures with double-twist tubes and torus knots of M(r), which exhibit a strong sensitivity to the direction of weak magnetic fields ∼1  mT. Numerical modeling, implemented through free energy minimization to arrive at a field-dependent three-dimensional M(r), shows a good agreement with experiments and provides insights into the torus knot topology of observed field configurations and the corresponding physical underpinnings. PMID:26371682

  11. Nonequilibrium kinetics of the electron–phonon sybsystem of a crystal in a strong electric field as a base of the electroplastic effect

    SciTech Connect

    Karas, V. I. Vlasenko, A. M.; Sokolenko, V. I.; Zakharov, V. E.

    2015-09-15

    We present the results of a kinetic analysis of nonequilibrium dynamics of the electron–phonon system of a crystal in a strong electric field based on the proposed method of numerically solving a set of Boltzmann equations for electron and phonon distribution functions without expanding the electron distribution function into a series in the phonon energy. It is shown that the electric field action excites the electron subsystem, which by transferring energy to the phonon subsystem creates a large amount of short-wave phonons that effectively influence the lattice defects (point, lines, boundaries of different phases), which results in a redistribution of and decrease in the lattice defect density, in damage healing, in a decrease in the local peak stress, and a decrease in the degradation level of the construction material properties.

  12. The effect of magnetic field on bistability in 1D photonic crystal doped by magnetized plasma and coupled nonlinear defects

    SciTech Connect

    Mehdian, H.; Mohammadzahery, Z.; Hasanbeigi, A.

    2014-01-15

    In this work, we study the defect mode and bistability behavior of 1-D photonic band gap structure with magnetized plasma and coupled nonlinear defects. The transfer matrix method has been employed to investigate the magnetic field effect on defect mode frequency and bistability threshold. The obtained results show that the frequency of defect mode and bistability threshold can be altered, without changing the structure of the photonic multilayer. Therefore, the bistability behavior of the subjected structure in the presence of magnetized plasma can be utilized in manufacturing wide frequency range devices.

  13. Phase-Field Crystals with Elastic Interactions

    SciTech Connect

    Stefanovic, Peter; Provatas, Nikolas; Haataja, Mikko

    2006-06-09

    We report on a novel extension of the recently introduced phase-field crystal (PFC) method [Elder et al., Phys. Rev. Lett. 88, 245701 (2002)], which incorporates elastic interactions as well as crystal plasticity and diffusive dynamics. In our model, elastic interactions are mediated through wave modes that propagate on time scales many orders of magnitude slower than atomic vibrations but still much faster than diffusive time scales. This allows us to preserve the quintessential advantage of the PFC model: the ability to simulate atomic-scale interactions and dynamics on time scales many orders of magnitude longer than characteristic vibrational time scales. We demonstrate the two different modes of propagation in our model and show that simulations of grain growth and elastoplastic deformation are consistent with the microstructural properties of nanocrystals.

  14. Large scale pattern graphene electrode for high performance in transparent organic single crystal field-effect transistors.

    PubMed

    Liu, Wei; Jackson, Biyun Li; Zhu, Jing; Miao, Cong-Qin; Chung, Choong-Heui; Chung, Choon-Heui; Park, Young-Ju; Sun, Ke; Woo, Jason; Xie, Ya-Hong

    2010-07-27

    High quality, large grain size graphene on polycrystalline nickel film on two inch silicon wafers was successfully synthesized by the chemical vapor deposition (CVD) method. The polydimethylsiloxane (PDMS) stamping method was used for graphene transferring in this experiment. The graphene transferred onto Al2O3/ITO substrates was patterned into macroscopic dimension electrodes using conventional lithography followed by oxygen plasma etching. Experimental results show that this graphene can serve as transparent source and drain electrodes in high performance organic semiconductor nanoribbon organic field-effect transistors (OFETs), facilitating high hole injection efficiency due to the preferred work function match with the channel material: single crystalline copper phthalocyanine (CuPc) nanoribbons. The nanoribbons were grown on top of the patterned graphene via evaporate-deposition to form the FET device. The carrier mobility and on/off current ratio of such devices were measured to be as high as 0.36 cm2/(V s) and 10(4). PMID:20536162

  15. Magnetic-field tunable defect modes in a photonic-crystal/liquid-crystal cell.

    PubMed

    Zyryanov, Victor Ya; Myslivets, Sergey A; Gunyakov, Vladimir A; Parshin, Alexander M; Arkhipkin, Vasily G; Shabanov, Vasily F; Lee, Wei

    2010-01-18

    Light transmission spectrum of a multilayer photonic crystal with a central liquid-crystal defect layer placed between crossed polarizers has been studied. Transmittance was varied due to the magnetically induced reorientation of the nematic director from homeotropic to planar alignment. Two notable effects were observed for this scheme: the spectral shift of defect modes corresponding to the extraordinary light wave and its superposition with the ordinary one. As a result, the optical cell allows controlling the intensity of interfering defect modes by applied magnetic field. PMID:20173953

  16. Order by virtual crystal field fluctuations in pyrochlore XY antiferromagnets

    NASA Astrophysics Data System (ADS)

    Rau, Jeffrey G.; Petit, Sylvain; Gingras, Michel J. P.

    2016-05-01

    Conclusive evidence of order by disorder is scarce in real materials. Perhaps one of the strongest cases presented has been for the pyrochlore XY antiferromagnet Er2Ti2O7 , with the ground state selection proceeding by order by disorder induced through the effects of quantum fluctuations. This identification assumes the smallness of the effect of virtual crystal field fluctuations that could provide an alternative route to picking the ground state. Here we show that this order by virtual crystal field fluctuations is not only significant, but competitive with the effects of quantum fluctuations. Further, we argue that higher-multipolar interactions that are generically present in rare-earth magnets can dramatically enhance this effect. From a simplified bilinear-biquadratic model of these multipolar interactions, we show how the virtual crystal field fluctuations manifest in Er2Ti2O7 using a combination of strong-coupling perturbation theory and the random-phase approximation. We find that the experimentally observed ψ2 state is indeed selected and the experimentally measured excitation gap can be reproduced when the bilinear and biquadratic couplings are comparable while maintaining agreement with the entire experimental spin-wave excitation spectrum. Finally, we comment on possible tests of this scenario and discuss implications for other order-by-disorder candidates in rare-earth magnets.

  17. Crystal field and magnetic properties of ErH3

    NASA Technical Reports Server (NTRS)

    Flood, D. J.

    1977-01-01

    Magnetization and magnetic susceptibility measurements have been made in the temperature range 1.3 to 4.2 K on powdered samples of ErH3. The susceptibility exhibits Curie-Weiss behavior from 4.2 to 2 K, and intercepts the negative temperature axis at 1.05 + or - 0.05 K, indicating that the material is antiferromagnetic. The low field effective moment is 6.77 + or - 0.27 Bohr magnetons per ion. The magnetization exhibits a temperature independent contribution, the slope of which is (5 + or - 1.2) times 10 to the minus 6 Weber m/kg Tesla. The saturation moment is 3.84 + or - 0.15 Bohr magnetons per ion. The results can be qualitatively explained by the effects of crystal fields on the magnetic ions. No definitive assignment of a crystal field ground state can be given, nor can a clear choice between cubically or hexagonally symmetric crystal fields be made. For hexagonal symmetry, the first excited state is estimated to be 86 to 100 K above the ground state. For cubic symmetry, the splitting is of the order of 160 to 180 K.

  18. Effects of magnetic field and twin domains on magnetostructural phase mixture in Mn3O4 : Raman scattering studies of untwinned crystals

    NASA Astrophysics Data System (ADS)

    Byrum, T.; Gleason, S. L.; Thaler, A.; MacDougall, G. J.; Cooper, S. L.

    2016-05-01

    The ferrimagnetic spinel Mn3O4 exhibits large and anisotropic changes in electronic and structural properties in response to an applied magnetic field. These changes are thought to result from the field-dependent tuning—via strong spin-lattice coupling—between two nearly degenerate magnetostructural phases. Recent variable-magnetic-field studies of Mn3O4 have been performed on melt-grown crystals, which can exhibit twin domains due to a Jahn-Teller structural transition below the melting temperature. Because of the near degeneracy of the magnetostructural phases, however, strain associated with the twin domains likely affects the magnetic responses of Mn3O4 . In this report, we present a variable-magnetic-field Raman scattering study of untwinned Mn3O4 crystals grown out of a flux below the Jahn-Teller structural transition. We measure distinct q =0 magnetic and vibrational excitation spectra for each isolated magnetostructural phase of untwinned Mn3O4 crystals and determine the symmetries of the observed excitations. We determine how the magnetostructural phase mixture changes in response to magnetic fields applied in the magnetic easy plane. Last, by comparing results on flux- and melt-grown Mn3O4 crystals, we show that the intrinsic mixture of the two magnetostructural phases is indeed strongly influenced by the presence of twin domains.

  19. Paramagnetic Meissner effect at high fields in YCaBaCuO single crystal and melt-textured YBaCuO

    NASA Astrophysics Data System (ADS)

    Dias, F. T.; Vieira, V. N.; de Almeida, M. L.; Falck, A. L.; Pureur, P.; Pimentel, J. L.; Obradors, X.

    2010-12-01

    We report on systematic field-cooled magnetization experiments in an Y0.98Ca0.02Ba2Cu3O7-δ single crystal and melt-textured YBa2Cu3O7-δ samples. Magnetic fields up to 50 kOe were applied and a paramagnetic response related to the superconducting state was observed. We discuss our results in terms of the flux compression scenario into the sample.

  20. Magnetic Field Measurements Based on Terfenol Coated Photonic Crystal Fibers

    PubMed Central

    Quintero, Sully M. M.; Martelli, Cicero; Braga, Arthur M. B.; Valente, Luiz C. G.; Kato, Carla C.

    2011-01-01

    A magnetic field sensor based on the integration of a high birefringence photonic crystal fiber and a composite material made of Terfenol particles and an epoxy resin is proposed. An in-fiber modal interferometer is assembled by evenly exciting both eigenemodes of the HiBi fiber. Changes in the cavity length as well as the effective refractive index are induced by exposing the sensor head to magnetic fields. The magnetic field sensor has a sensitivity of 0.006 (nm/mT) over a range from 0 to 300 mT with a resolution about ±1 mT. A fiber Bragg grating magnetic field sensor is also fabricated and employed to characterize the response of Terfenol composite to the magnetic field. PMID:22247655

  1. The effect of an electric field on the morphological stability of the crystal-melt interface of a binary alloy

    NASA Technical Reports Server (NTRS)

    Wheeler, A. A.; Coriell, S. R.; Mcfadden, G. B.; Hurle, D. T. J.

    1988-01-01

    A fully time-dependent linear stability analysis of the morphological stability of a planar interface during directional solidification of a binary alloy at constant velocity in the presence of an electric field, is performed. The electromigration of solute and the differing electrical conductivities of solid and liquid for a model in which the temperature gradient is constant are taken into account. The present results are compared with the constitutional supercooling criterion, and it is shown there may be substantial differences. A modified constitutional supercooling criterion which is valid over a large range of conditions is derived. It is also found under certain conditions that the onset of instability may be time dependent.

  2. Using Magnetic Fields to Control Convection during Protein Crystallization: Analysis and Validation Studies

    NASA Technical Reports Server (NTRS)

    Ramachandran, N.; Leslie, F. W.

    2004-01-01

    The effect of convection during the crystallization of proteins is not very well understood. In a gravitational field, convection is caused by crystal sedimentation and by solutal buoyancy induced flow and these can lead to crystal imperfections. While crystallization in microgravity can approach diffusion limited growth conditions (no convection), terrestrially strong magnetic fields can be used to control fluid flow and sedimentation effects. In this work, we develop the analysis for magnetic flow control and test the predictions using analog experiments. Specifically, experiments on solutal convection in a paramagnetic fluid were conducted in a strong magnetic field gradient using a dilute solution of Manganese Chloride. The observed flows indicate that the magnetic field can completely counter the settling effects of gravity locally and are consistent with the theoretical predictions presented. This phenomenon suggests that magnetic fields may be useful in mimicking the microgravity environment of space for some crystal growth ana biological applications where fluid convection is undesirable.

  3. Influence of magnetic field on the morphology of the andrographolide crystal from supercritical carbon dioxide extraction crystallization

    NASA Astrophysics Data System (ADS)

    Chen, Kexun; Zhang, Xingyuan; Pan, Jian; Zhang, Wencheng; Yong, Ji; Yin, Wenhong

    2003-10-01

    In this paper, a supercritical fluid extraction-crystallization of andrographolide, a kind of Chinese traditional medicine, was investigated. We have studied the extraction-crystallization process with or without magnet in the extractor, respectively. It was found that the presence of magnetic field is an important factor influencing the quality of the products. SEM images showed that the crystal was slice-like in shape, and many slices reunited together in the absence of magnet. Further research showed that pressure had a certain effect on the morphology of the crystal.

  4. Impact of additional Pt and NiSi crystal orientation on channel stress induced by Ni silicide film in metal-oxide-semiconductor field-effect transistors

    NASA Astrophysics Data System (ADS)

    Mizuo, Mariko; Yamaguchi, Tadashi; Kudo, Shuichi; Hirose, Yukinori; Kimura, Hiroshi; Tsuchimoto, Jun-ichi; Hattori, Nobuyoshi

    2014-01-01

    The impact of additional Pt and Ni monosilicide (NiSi) crystal orientation on channel stress from Ni silicide in metal-oxide-semiconductor field-effect transistors (MOSFETs) has been demonstrated. The channel stress generation mechanism can be explained by the NiSi crystal orientation. In pure Ni silicide films, the channel stress in the p-type substrate is much larger than that in the n-type one, since the NiSi a-axis parallel to the channel direction is strongly aligned on the p-type substrate compared with on the n-type one. On the other hand, in NiPt silicide films, the difference in the channel stress between the p- and n-type substrates is small, because the NiSi crystal orientation on the p-type substrate is similar to that on the n-type one. These results can be explained by the Pt segregation at the interface between the NiSi film and the Si surface. Segregated Pt atoms cause the NiSi b-axis to align normal to the Si(001) surface in the nucleation step owing to the expansion of the NiSi lattice spacing at the NiSi/Si interface. Furthermore, the Pt segregation mechanism is considered to be caused by the grain boundary diffusion in the Ni2Si film during NiSi formation. We confirmed that the grains of Ni2Si on the p-type substrate are smaller than those on the n-type one. The Ni2Si film on the p-type substrate has more grain boundary diffusion paths than that on the n-type one. Therefore, the amount of Pt segregation at the NiSi/Si interface on the p-type substrate is larger than that on the n-type one. Consequently, the number of NiSi grains with the b-axis aligned normal to the Si(001) in the p-type substrate is larger than that in the n-type one. As a result, the channel stress induced by NiPt silicide in PMOS is larger than that in NMOS. According to this mechanism, controlling the Pt concentration at the NiSi/Si interface is one of the key factors for channel stress engineering.

  5. Semiconductor Crystal Growth in Static and Rotating Magnetic fields

    NASA Technical Reports Server (NTRS)

    Volz, Martin

    2004-01-01

    Magnetic fields have been applied during the growth of bulk semiconductor crystals to control the convective flow behavior of the melt. A static magnetic field established Lorentz forces which tend to reduce the convective intensity in the melt. At sufficiently high magnetic field strengths, a boundary layer is established ahead of the solid-liquid interface where mass transport is dominated by diffusion. This can have a significant effect on segregation behavior and can eliminate striations in grown crystals resulting from convective instabilities. Experiments on dilute (Ge:Ga) and solid solution (Ge-Si) semiconductor systems show a transition from a completely mixed convective state to a diffusion-controlled state between 0 and 5 Tesla. In HgCdTe, radial segregation approached the diffusion limited regime and the curvature of the solid-liquid interface was reduced by a factor of 3 during growth in magnetic fields in excess of 0.5 Tesla. Convection can also be controlled during growth at reduced gravitational levels. However, the direction of the residual steady-state acceleration vector can compromise this effect if it cannot be controlled. A magnetic field in reduced gravity can suppress disturbances caused by residual transverse accelerations and by random non-steady accelerations. Indeed, a joint program between NASA and the NHMFL resulted in the construction of a prototype spaceflight magnet for crystal growth applications. An alternative to the suppression of convection by static magnetic fields and reduced gravity is the imposition of controlled steady flow generated by rotating magnetic fields (RMF)'s. The potential benefits of an RMF include homogenization of the melt temperature and concentration distribution, and control of the solid-liquid interface shape. Adjusting the strength and frequency of the applied magnetic field allows tailoring of the resultant flow field. A limitation of RMF's is that they introduce deleterious instabilities above a

  6. Investigation of electric field effect on the third order nonlinear optical properties of Fe3O4 nanoparticles-doped nematic liquid crystal

    NASA Astrophysics Data System (ADS)

    Dehghani, Z.; Saievar Iranizad, E.; Nadafan, M.

    2015-01-01

    Third order nonlinearity of Fe3O4 nanoparticles (NPs) doped in nematic liquid crystals (NLCs) was evaluated due to laser induced self-phase modulation. The influence of electric field on the nonlinear optical responses of the NLCs doped with Fe3O4 NPs was considered in different voltages. The measurements were performed for two commonly initial alignments (homogeneous and homeotropic) with different small compositional percentages of magnetic NPs. The experimental results show that the homogenous- aligned cell was considerably affected on the applied electric field while the nonlinearity of homeotropic-aligned NLCs with the Fe3O4 NPs did not approximately change in the presence of electric field.

  7. Electric heating effects in nematic liquid crystals

    NASA Astrophysics Data System (ADS)

    Yin, Y.; Shiyanovskii, S. V.; Lavrentovich, O. D.

    2006-07-01

    Electric heating effects in the nematic liquid crystal change the liquid crystal physical properties and dynamics. We propose a model to quantitatively describe the heating effects caused by dielectric dispersion and ionic conductivity in the nematic liquid crystals upon the application of an ac electric field. The temperature increase of the liquid crystal cell is related to the properties of the liquid crystal such as the imaginary part of the dielectric permittivity, thermal properties of the bounding plates, and the surrounding medium as well as frequency and amplitude of the electric field. To study the temperature dynamics experimentally, we use a small thermocouple inserted directly into the nematic bulk; we assure that the thermocouple does not alter the thermal behavior of the system by comparing the results to those obtained by a noncontact birefringent probing technique recently proposed by Wen and Wu [Appl. Phys. Lett. 86, 231104 (2005)]. We determine how the temperature dynamics and the stationary value of the temperature increase depend on the parameters of the materials and the applied field. We used different surrounding media, from extremely good heat conductors such as aluminum cooling device to extremely poor conductor, Styrofoam; these two provide two limiting cases as compared to typical conditions of nematic cell exploitation in a laboratory or in commercial devices. The experiments confirm the theoretical predictions, namely, that the temperature rise is controlled not only by the heat transfer coefficient of the surrounding medium (as in the previous model) but also by the thickness and the thermal conductivity coefficient of the bounding plates enclosing the nematic layer. The temperature increase strongly depends on the director orientation and can change nonmonotonously with the frequency of the applied field.

  8. Novel vertical hetero- and homo-junction tunnel field-effect transistors based on multi-layer 2D crystals

    NASA Astrophysics Data System (ADS)

    Lu, Shang-Chun; Mohamed, Mohamed; Zhu, Wenjuan

    2016-03-01

    Vertical hetero- and homo-junction tunnel FET (TFET) based on multi-layer black phosphorus (BP) and transition metal dichalcogenides are proposed and studied by numerical simulations employing the semi-classical density gradient quantum correction model. It is found that the vertical TFET based on BP can achieve high on-current (>200 μA μm-1) and steep subthreshold swing (average value = 24.6 mV/dec) simultaneously, due to its high mobility, direct narrow bandgap, and low dielectric constant. We also found that the on-current in vertical TFETs based on MoS2/MoSe2 hetero-junction is two orders of magnitudes higher than the one in MoS2 homo-junction TFET, due to the reduced effective bandgap in heterostructure with staggered band alignment. In addition, we present various design considerations and recommendations as well as provide a qualitative comparison with published data.

  9. Analysis of NAD(P)+/NAD(P)H cofactors by imprinted polymer membranes associated with ion-sensitive field-effect transistor devices and Au-quartz crystals.

    PubMed

    Pogorelova, Svetlana P; Zayats, Maya; Bourenko, Tatyana; Kharitonov, Andrei B; Lioubashevski, Oleg; Katz, Eugenii; Willner, Itamar

    2003-02-01

    Specific recognition sites for the NAD(P)+ and NAD(P)H cofactors are imprinted in a cross-linked acrylamide-acrylamidophenylboronic acid copolymer membrane. The imprinted membranes, associated with pH-sensitive field-effect transistors (ISFETs) or Au-quartz piezoelectric crystals, enable the potentiometric or microgravimetric analysis of the oxidized NAD(P)+ cofactors and the reduced NAD(P)H cofactors, respectively. The NAD+- and NADP+-imprinted membranes associated with the ISFET allow the analysis of NAD+ and NADP+ with sensitivities that correspond to 15.0 and 18.0 mVdecade(-1) and detection limits of 4 x 10(-7) and 2 x 10(-7) M, respectively. The NADH- and NADPH-imprinted membranes associated with the ISFET device enable the analysis of NADH and NADPH with sensitivities that correspond to 24.2 and 21.8 mV x decade(-1) and lower detection limits that are 1 x 10(-7) and 2 x 10(-7) M, respectively. The ISFET devices functionalized with the NADH and NADPH membranes are employed in the analysis of the biocatalyzed oxidation of lactic acid and ethanol in the presence of lactate dehydrogenase and alcohol dehydrogenase, respectively. PMID:12585477

  10. Subsurface Stress Fields In Single Crystal (Anisotropic) Contacts

    NASA Technical Reports Server (NTRS)

    Arakere, Nagaraj K.; Knudsen, Erik C.; Duke, Greg; Battista, Gilda; Swanson, Greg

    2004-01-01

    Single crystal superalloy turbine blades used in high pressure turbomachinery are subject to conditions of high temperature, triaxial steady and alternating stresses, fretting stresses in the blade attachment and damper contact locations, and exposure to high-pressure hydrogen. The blades are also subjected to extreme variations in temperature during start-up and shutdown transients. The most prevalent HCF failure modes observed in these blades during operation include crystallographic crack initiation/propagation on octahedral planes, and noncrystallographic initiation with crystallographic growth. Numerous cases of crack initiation and crack propagation at the blade leading edge tip, blade attachment regions, and damper contact locations have been documented. Understanding crack initiation/propagation under mixed-mode loading conditions is critical for establishing a systematic procedure for evaluating HCF life of single crystal turbine blades. This paper presents analytical and numerical techniques for evaluating two and three dimensional subsurface stress fields in anisotropic contacts. The subsurface stress results are required for evaluating contact fatigue life at damper contacts and dovetail attachment regions in single crystal nickel-base superalloy turbine blades. An analytical procedure is , presented, for evaluating the subsurface stresses in the elastic half-space, using a complex potential method outlined by Lekhnitskii. Numerical results are presented for cylindrical and spherical anisotropic contacts, using finite element analysis. Effects of crystal orientation on stress response and fatigue life are examined.

  11. Size effects in spin-crossover nanoparticles in framework of 2D and 3D Ising-like breathing crystal field model

    NASA Astrophysics Data System (ADS)

    Gudyma, Iu.; Maksymov, A.; Spinu, L.

    2015-10-01

    The spin-crossover nanoparticles of different sizes and stochastic perturbations in external field taking into account the influence of the dimensionality of the lattice was studied. The analytical tools used for the investigation of spin-crossover system are based on an Ising-like model described using of the breathing crystal field concept. The changes of transition temperatures characterizing the systems' bistable properties for 2D and 3D lattices, and their dependence on its size and fluctuations strength were obtained. The state diagrams with hysteretic and non-hysteretic behavior regions have also been determined.

  12. Magnetic rotations of uric acid crystals and uratic crystals by static magnetic fields of up to 500 mT.

    PubMed

    Takeuchi, Yuka; Mizukawa, Yuri; Iwasaka, Masakazu

    2013-01-01

    In recent years, the disease concerning ureteral calculus is increasing possibly due to the changing lifestyles. For example, it is well known that the urinary calculi have a large impact to gout. As eating habitual diseases, gout and the hyper-uricemia are related to the formation of urinary calculus. In the previous studies, therapeutic agents were developed to enhance the uric acid excretion. From the viewpoint of side effects induction by the chemical agents, we are motivated to explore an alternative method to control the formation of ureteral crystals stimulator by physical stimulations. Therefore in the present study, we focused on the behaviors of uric acid crystals under magnetic fields of several hundreds of mT (Tesla). The uric acid crystals were re-crystallized from a suspension of uric acid powder, and the micro-crystals were prepared to be floating in the solution. We generated horizontal magnetic fields of maximum 500 mT by an electromagnet which contained a CCD microscope. A permanent magnet with magnetic fields of 200∼400 mT was also utilized. During the magnetic fields were applied to the uric acid crystals, we observed that the uric acid crystals were oriented by the magnetic fields down to 200 mT at the room temperature. It was speculated that the dimagnetic anisotropy in the uric acid crystals exhibited the rotational responses. The results indicate the possible remote control of the uric acid crystals in living body by the magnetic fields of 200 mT to 500 mT. PMID:24110424

  13. Field expulsion and reconfiguration in polaritonic photonic crystals.

    PubMed

    Huang, Kerwyn Casey; Bienstman, Peter; Joannopoulos, John D; Nelson, Keith A; Fan, Shanhui

    2003-05-16

    We uncover a rich set of optical phenomena stemming from the incorporation of polar materials exhibiting transverse phonon polariton excitations into a photonic crystal structure. We identify in the frequency spectrum two regimes in which the dielectric response of the polaritonic medium can induce extreme localization of the electromagnetic energy. Our analysis of the effect of polarization and the interaction between the polariton and photonic band gaps on the Bloch states leads to a pair of mechanisms for sensitive frequency-controlled relocation and/or reconfiguration of the fields. PMID:12785962

  14. Subsurface Stress Fields in FCC Single Crystal Anisotropic Contacts

    NASA Technical Reports Server (NTRS)

    Arakere, Nagaraj K.; Knudsen, Erik; Swanson, Gregory R.; Duke, Gregory; Ham-Battista, Gilda

    2004-01-01

    Single crystal superalloy turbine blades used in high pressure turbomachinery are subject to conditions of high temperature, triaxial steady and alternating stresses, fretting stresses in the blade attachment and damper contact locations, and exposure to high-pressure hydrogen. The blades are also subjected to extreme variations in temperature during start-up and shutdown transients. The most prevalent high cycle fatigue (HCF) failure modes observed in these blades during operation include crystallographic crack initiation/propagation on octahedral planes, and non-crystallographic initiation with crystallographic growth. Numerous cases of crack initiation and crack propagation at the blade leading edge tip, blade attachment regions, and damper contact locations have been documented. Understanding crack initiation/propagation under mixed-mode loading conditions is critical for establishing a systematic procedure for evaluating HCF life of single crystal turbine blades. This paper presents analytical and numerical techniques for evaluating two and three dimensional subsurface stress fields in anisotropic contacts. The subsurface stress results are required for evaluating contact fatigue life at damper contacts and dovetail attachment regions in single crystal nickel-base superalloy turbine blades. An analytical procedure is presented for evaluating the subsurface stresses in the elastic half-space, based on the adaptation of a stress function method outlined by Lekhnitskii. Numerical results are presented for cylindrical and spherical anisotropic contacts, using finite element analysis (FEA). Effects of crystal orientation on stress response and fatigue life are examined. Obtaining accurate subsurface stress results for anisotropic single crystal contact problems require extremely refined three-dimensional (3-D) finite element grids, especially in the edge of contact region. Obtaining resolved shear stresses (RSS) on the principal slip planes also involves

  15. Enhancement of crystal homogeneity of protein crystals under application of an external alternating current electric field

    SciTech Connect

    Koizumi, H.; Uda, S.; Fujiwara, K.; Nozawa, J.; Tachibana, M.; Kojima, K.

    2014-10-06

    X-ray diffraction rocking-curve measurements were performed on tetragonal hen egg white (HEW) lysozyme crystals grown with and without the application of an external alternating current (AC) electric field. The crystal quality was assessed by the full width at half maximum (FWHM) value for each rocking curve. For two-dimensional maps of the FWHMs measured on the 440 and the 12 12 0 reflection, the crystal homogeneity was improved under application of an external electric field at 1 MHz, compared with that without. In particular, the significant improvement of the crystal homogeneity was observed for the 12 12 0 reflection.

  16. Hidden local symmetry of Eu{sup 3+} in xenotime-like crystals revealed by high magnetic fields

    SciTech Connect

    Han, Yibo; Ma, Zongwei; Zhang, Junpei; Wang, Junfeng; Du, Guihuan; Xia, Zhengcai; Han, Junbo Li, Liang; Yu, Xuefeng

    2015-02-07

    The excellent optical properties of europium-doped crystals in visible and near infrared wavelength regions enable them to have broad applications in optoelectronics, laser crystals and sensing devices. The local site crystal fields can affect the intensities and peak positions of the photo-emission lines strongly, but they are usually difficult to be clarified due to magnetically degenerate 4f electronic levels coupling with the crystal fields. Here, we provide an effective way to explore the hidden local symmetry of the Eu{sup 3+} sites in different hosts by taking photoluminescence measurements under pulsed high magnetic fields up to 46 T. The zero-field photoluminescence peaks split further at high magnetic fields when the Zeeman splitting energy is comparable to or larger than that of the crystal field induced zero-field splitting. In particular, a magnetic field induced crossover of the local crystal fields has been observed in the GdVO{sub 4}:Eu{sup 3+} crystal, which resulted from the alignment of Gd{sup 3+} magnetic moment in high magnetic fields; and a hexagonally symmetric local crystal fields was observed in the YPO{sub 4} nanocrystals at the Eu{sup 3+} sites characterized by the special axial and rhombic crystal field terms. These distinct Zeeman splitting behaviors uncover the crystal fields-related local symmetry of luminescent Eu{sup 3+} centers in different hosts or magnetic environments, which are significant for their applications in optics and optoelectronics.

  17. An efficient algorithm for solving the phase field crystal model

    SciTech Connect

    Cheng Mowei Warren, James A.

    2008-06-01

    We present and discuss the development of an unconditionally stable algorithm used to solve the evolution equations of the phase field crystal (PFC) model. This algorithm allows for an arbitrarily large algorithmic time step. As the basis for our analysis of the accuracy of this algorithm, we determine an effective time step in Fourier space. We then compare our calculations with a set of representative numerical results, and demonstrate that this algorithm is an effective approach for the study of the PFC models, yielding a time step effectively 180 times larger than the Euler algorithm for a representative set of material parameters. As the PFC model is just a simple example of a wide class of density functional theories, we expect this method will have wide applicability to modeling systems of considerable interest to the materials modeling communities.

  18. Pendellösung effect in photonic crystals

    NASA Astrophysics Data System (ADS)

    Savo, S.; di Gennaro, E.; Miletto, C.; Andreone, A.; Dardano, P.; Moretti, L.; Mocella, V.

    2008-06-01

    At the exit surface of a photonic crystal, the intensity of the diffracted wave can be periodically modulated, showing a maximum in the "positive" (forward diffracted) or in the "negative" (diffracted) direction, depending on the slab thickness. This thickness dependence is a direct result of the so-called Pendellosung phenomenon, consisting of the periodic exchange inside the crystal of the energy between direct and diffracted beams. We report the experimental observation of this effect in the microwave region at about 14 GHz by irradiating 2D photonic crystal slabs of different thickness and detecting the intensity distribution of the electromagnetic field at the exit surface and inside the crystal itself.

  19. Effects of impurities on crystal growth in fructose crystallization

    NASA Astrophysics Data System (ADS)

    Chu, Y. D.; Shiau, L. D.; Berglund, K. A.

    1989-10-01

    The influence of impurities on the crystallization of anhydrous fructose from aqueous solution was studied. The growth kinetics of fructose crystals in the fructose-water-glucose and fructose-water-difructose dianhydrides systems were investigated using photomicroscopic contact nucleation techniques. Glucose is the major impurity likely to be present in fructose syrup formed during corn wet milling, while several difructose dianhydrides are formed in situ under crystallization conditions and have been proposed as a cause in the decrease of overall yields. Both sets of impurities were found to cause inhibition of crystal growth, but the mechanisms responsible in each case are different. It was found that the presence of glucose increases the solubility of fructose in water and thus lowers the supersaturation of the solution. This is probably the main effect responsible for the decrease of crystal growth. Since the molecular structures of difructose dianhydrides are similar to that of fructose, they are probably "tailor-made" impurities. The decrease of crystal growth is probably caused by the incorporation of these impurities into or adsorption to the crystal surface which would accept fructose molecules in the orientation that existed in the difructose dianhydride.

  20. Energy levels fitting and crystal-field calculations of Nd3+ doped in GYSGG crystal

    NASA Astrophysics Data System (ADS)

    Gao, Jinyun; Zhang, Qingli; Sun, Dunlu; Luo, Jianqiao; Liu, Wenpeng; Yin, Shaotang

    2012-10-01

    The single crystal Nd3+-doped in GdY2Sc2Ga3O12 (Nd3+:GYSGG) was grown by Czochralski method successfully, and its absorption spectra was analyzed in a wider spectral wavelength range at 7.6 K and 300 K, respectively. The free-ions and crystal-field parameters were fitted to the experimental energy levels at 7.6 K and 300 K with the root mean square deviation of 11.25 and 12.48 cm-1, respectively. According to the crystal-field calculations, 116 levels of Nd3+ at 7.6 K and 114 levels of Nd3+ at 300 K were assigned. The fitting results of free-ions and crystal-field parameters were compared with those already reported of Nd3+:GSGG and Nd3+:YSAG. The results indicated that the free-ions parameters are similar to those of the Nd3+ in GYSGG, GSGG and YSAG crystals, and the crystal-field interaction of GSGG and YSAG is stronger than that of GYSGG, which results in the dual-wavelength properties of Nd3+:GYSGG crystal.

  1. Crystal field spectra of lunar pyroxenes.

    NASA Technical Reports Server (NTRS)

    Burns, R. G.; Abu-Eid, R. M.; Huggins, F. E.

    1972-01-01

    Absorption spectra in the visible and near infrared regions have been obtained for pyroxene single crystals in rocks from the Apollo 11, 12, 14, and 15 missions. The polarized spectra are compared with those obtained from terrestrial calcic clinopyroxenes, subcalcic augites, pigeonites, and orthopyroxenes. The lunar pyroxenes contain several broad, intense absorption bands in the near infrared, the positions of which are related to bulk composition, Fe(2+) site occupancy and structure type of the pyroxene. The visible spectra contain several sharp, weak peaks mainly due to spin-forbidden transitions in Fe(2+). Additional weak bands in this region in Apollo 11 pyroxenes are attributed to Ti(3+) ions. Spectral features from Fe(3+), Mn(2+), Cr(3+), and Cr(2+) were not observed.

  2. Heat transport in polymer-dispersed liquid crystals under electric field

    NASA Astrophysics Data System (ADS)

    Hadj Sahraoui, Abdelhak; Delenclos, Sylvain; Longuemart, Stéphane; Dadarlat, Dorin

    2011-08-01

    The concepts of effective thermal conductivity and interfacial thermal contact resistance in composite media are applied to study heat transport in polymer-dispersed liquid crystals (PDLC). In these systems, the thermal properties of liquid crystal inclusions are changed by an imposed electric field. The photopyroelectric (PPE) technique with a cell allowing the application of an electric field to the sample is used to measure the thermal parameters. A model based on effective medium approximation is used to assess the impact of interfaces on the flow of heat through the determination of the Kapitza radius. It was found that the effect of interfaces becomes dominant compared to the volume conduction of the droplet when the liquid crystal (LC) droplet radius becomes smaller than 1 micron. The comparison of the thermal behavior of LC in the droplets with that of bulk liquid crystal allowed to evaluate the effect of confinement on the LC nematic phase.

  3. Modeling nuclear volume isotope effects in crystals

    PubMed Central

    Schauble, Edwin A.

    2013-01-01

    Mass-independent isotope fractionations driven by differences in volumes and shapes of nuclei (the field shift effect) are known in several elements and are likely to be found in more. All-electron relativistic electronic structure calculations can predict this effect but at present are computationally intensive and limited to modeling small gas phase molecules and clusters. Density functional theory, using the projector augmented wave method (DFT-PAW), has advantages in greater speed and compatibility with a three-dimensional periodic boundary condition while preserving information about the effects of chemistry on electron densities within nuclei. These electron density variations determine the volume component of the field shift effect. In this study, DFT-PAW calculations are calibrated against all-electron, relativistic Dirac–Hartree–Fock, and coupled-cluster with single, double (triple) excitation methods for estimating nuclear volume isotope effects. DFT-PAW calculations accurately reproduce changes in electron densities within nuclei in typical molecules, when PAW datasets constructed with finite nuclei are used. Nuclear volume contributions to vapor–crystal isotope fractionation are calculated for elemental cadmium and mercury, showing good agreement with experiments. The nuclear-volume component of mercury and cadmium isotope fractionations between atomic vapor and montroydite (HgO), cinnabar (HgS), calomel (Hg2Cl2), monteponite (CdO), and the CdS polymorphs hawleyite and greenockite are calculated, indicating preferential incorporation of neutron-rich isotopes in more oxidized, ionically bonded phases. Finally, field shift energies are related to Mössbauer isomer shifts, and equilibrium mass-independent fractionations for several tin-bearing crystals are calculated from 119Sn spectra. Isomer shift data should simplify calculations of mass-independent isotope fractionations in other elements with Mössbauer isotopes, such as platinum and uranium

  4. Modeling nuclear volume isotope effects in crystals.

    PubMed

    Schauble, Edwin A

    2013-10-29

    Mass-independent isotope fractionations driven by differences in volumes and shapes of nuclei (the field shift effect) are known in several elements and are likely to be found in more. All-electron relativistic electronic structure calculations can predict this effect but at present are computationally intensive and limited to modeling small gas phase molecules and clusters. Density functional theory, using the projector augmented wave method (DFT-PAW), has advantages in greater speed and compatibility with a three-dimensional periodic boundary condition while preserving information about the effects of chemistry on electron densities within nuclei. These electron density variations determine the volume component of the field shift effect. In this study, DFT-PAW calculations are calibrated against all-electron, relativistic Dirac-Hartree-Fock, and coupled-cluster with single, double (triple) excitation methods for estimating nuclear volume isotope effects. DFT-PAW calculations accurately reproduce changes in electron densities within nuclei in typical molecules, when PAW datasets constructed with finite nuclei are used. Nuclear volume contributions to vapor-crystal isotope fractionation are calculated for elemental cadmium and mercury, showing good agreement with experiments. The nuclear-volume component of mercury and cadmium isotope fractionations between atomic vapor and montroydite (HgO), cinnabar (HgS), calomel (Hg2Cl2), monteponite (CdO), and the CdS polymorphs hawleyite and greenockite are calculated, indicating preferential incorporation of neutron-rich isotopes in more oxidized, ionically bonded phases. Finally, field shift energies are related to Mössbauer isomer shifts, and equilibrium mass-independent fractionations for several tin-bearing crystals are calculated from (119)Sn spectra. Isomer shift data should simplify calculations of mass-independent isotope fractionations in other elements with Mössbauer isotopes, such as platinum and uranium. PMID

  5. Modeling nuclear volume isotope effects in crystals

    NASA Astrophysics Data System (ADS)

    Schauble, Edwin A.

    2013-10-01

    Mass-independent isotope fractionations driven by differences in volumes and shapes of nuclei (the field shift effect) are known in several elements and are likely to be found in more. All-electron relativistic electronic structure calculations can predict this effect but at present are computationally intensive and limited to modeling small gas phase molecules and clusters. Density functional theory, using the projector augmented wave method (DFT-PAW), has advantages in greater speed and compatibility with a three-dimensional periodic boundary condition while preserving information about the effects of chemistry on electron densities within nuclei. These electron density variations determine the volume component of the field shift effect. In this study, DFT-PAW calculations are calibrated against all-electron, relativistic Dirac-Hartree-Fock, and coupled-cluster with single, double (triple) excitation methods for estimating nuclear volume isotope effects. DFT-PAW calculations accurately reproduce changes in electron densities within nuclei in typical molecules, when PAW datasets constructed with finite nuclei are used. Nuclear volume contributions to vapor-crystal isotope fractionation are calculated for elemental cadmium and mercury, showing good agreement with experiments. The nuclear-volume component of mercury and cadmium isotope fractionations between atomic vapor and montroydite (HgO), cinnabar (HgS), calomel (Hg2Cl2), monteponite (CdO), and the CdS polymorphs hawleyite and greenockite are calculated, indicating preferential incorporation of neutron-rich isotopes in more oxidized, ionically bonded phases. Finally, field shift energies are related to Mössbauer isomer shifts, and equilibrium mass-independent fractionations for several tin-bearing crystals are calculated from 119Sn spectra. Isomer shift data should simplify calculations of mass-independent isotope fractionations in other elements with Mössbauer isotopes, such as platinum and uranium.

  6. The flow structure in the near field of jets and its effect on cavitation inception, and, Implementation of ferroelectric liquid crystal and birefringent crystal for image shifting in particle image velocimetry

    NASA Astrophysics Data System (ADS)

    Gopalan, Shridhar

    1999-10-01

    Cavitation experiments performed in the near field of a 50-mm diameter (D) jet at ReD = 5 × 105, showed inception in the form of inclined ``cylindrical'' bubbles at axial distances (x/D) less than 0.55, with indices of 2.5. On tripping the boundary layer, cavitation inception occurred at x/D ~ 2, as distorted ``spherical'' bubbles with inception indices of 1.7. To investigate these substantial differences, the near field of the jet was measured using Particle Image Velocimetry (PIV). Data on the primary flow, the strength distribution of the ``streamwise''vortices and the velocity profiles within the initial boundary layers were obtained. The untripped case showed a direct transition to three-dimensional flow in the near field (x/D < 0.7) even before rolling up to distinct vortex rings. Strong ``streamwise'' vortices with strengths up to 25% of the jet velocity times the characteristic wavelength were seen. Cavitation inception occurred in the core of these vortices. In contrast, in the tripped jet the vortex sheet rolled up to the familiar Kelvin- Helmholtz vortex rings with weak secondary vortices. Using the measured nuclei distribution, strengths and straining of the ``streamwise'' structures, the rates of cavitation events were estimated. The estimated results match very well with the measured cavitation rates. Also, the Reynolds stresses in the near field of the jet show similar trends and magnitudes to those of Browand & Latigo (1979) and Bell & Mehta (1990) for a plane shear layer. In the second part of this essay we discuss the implementation of electro-optical image shifting to resolve directional ambiguity in PIV measurements. The technique uses a ferroelectric liquid crystal (FLC) as an electro-optic half wave plate and a birefringent crystal (calcite) as the shifter. The system can be used with non-polarized light sources and fluorescent particles. The minimum shifting time is approximately 100μs. This compact electrooptical device usually is

  7. Modeling nuclear field shift isotope fractionation in crystals

    NASA Astrophysics Data System (ADS)

    Schauble, E. A.

    2013-12-01

    In this study nuclear field shift fractionations in solids (and chemically similar liquids) are estimated using calibrated density functional theory calculations. The nuclear field shift effect is a potential driver of mass independent isotope fractionation(1,2), especially for elements with high atomic number such as Hg, Tl and U. This effect is caused by the different shapes and volumes of isotopic nuclei, and their interactions with electronic structures and energies. Nuclear field shift isotope fractionations can be estimated with first principles methods, but the calculations are computationally difficult, limiting most theoretical studies so far to small gas-phase molecules and molecular clusters. Many natural materials of interest are more complex, and it is important to develop ways to estimate field shift effects that can be applied to minerals, solutions, in biomolecules, and at mineral-solution interfaces. Plane-wave density functional theory, in combination with the projector augmented wave method (DFT-PAW), is much more readily adapted to complex materials than the relativistic all-electron calculations that have been the focus of most previous studies. DFT-PAW is a particularly effective tool for studying crystals with periodic boundary conditions, and may also be incorporated into molecular dynamics simulations of solutions and other disordered phases. Initial calibrations of DFT-PAW calculations against high-level all-electron models of field shift fractionation suggest that there may be broad applicability of this method to a variety of elements and types of materials. In addition, the close relationship between the isomer shift of Mössbauer spectroscopy and the nuclear field shift isotope effect makes it possible, at least in principle, to estimate the volume component of field shift fractionations in some species that are too complex even for DFT-PAW models, so long as there is a Mössbauer isotope for the element of interest. Initial results

  8. Control of active liquid crystals with a magnetic field.

    PubMed

    Guillamat, Pau; Ignés-Mullol, Jordi; Sagués, Francesc

    2016-05-17

    Living cells sense the mechanical features of their environment and adapt to it by actively remodeling their peripheral network of filamentary proteins, known as cortical cytoskeleton. By mimicking this principle, we demonstrate an effective control strategy for a microtubule-based active nematic in contact with a hydrophobic thermotropic liquid crystal. By using well-established protocols for the orientation of liquid crystals with a uniform magnetic field, and through the mediation of anisotropic shear stresses, the active nematic reversibly self-assembles with aligned flows and textures that feature orientational order at the millimeter scale. The turbulent flow, characteristic of active nematics, is in this way regularized into a laminar flow with periodic velocity oscillations. Once patterned, the microtubule assembly reveals its intrinsic length and time scales, which we correlate with the activity of motor proteins, as predicted by existing theories of active nematics. The demonstrated commanding strategy should be compatible with other viable active biomaterials at interfaces, and we envision its use to probe the mechanics of the intracellular matrix. PMID:27140604

  9. Magnetic Field Applications in Semiconductor Crystal Growth and Metallurgy

    NASA Technical Reports Server (NTRS)

    Mazuruk, Konstantin; Ramachandran, Narayanan; Grugel, Richard; Curreri, Peter A. (Technical Monitor)

    2002-01-01

    The Traveling Magnetic Field (TMF) technique, recently proposed to control meridional flow in electrically conducting melts, is reviewed. In particular, the natural convection damping capability of this technique has been numerically demonstrated with the implication of significantly improving crystal quality. Advantages of the traveling magnetic field, in comparison to the more mature rotating magnetic field method, are discussed. Finally, results of experiments with mixing metallic alloys in long ampoules using TMF is presented

  10. Scale effects in crystal plasticity

    NASA Astrophysics Data System (ADS)

    Padubidri Janardhanachar, Guruprasad

    The goal of this research work is to further the understanding of crystal plasticity, particularly at reduced structural and material length scales. Fundamental understanding of plasticity is central to various challenges facing design and manufacturing of materials for structural and electronic device applications. The development of microstructurally tailored advanced metallic materials with enhanced mechanical properties that can withstand extremes in stress, strain, and temperature, will aid in increasing the efficiency of power generating systems by allowing them to work at higher temperatures and pressures. High specific strength materials can lead to low fuel consumption in transport vehicles. Experiments have shown that enhanced mechanical properties can be obtained in materials by constraining their size, microstructure (e.g. grain size), or both for various applications. For the successful design of these materials, it is necessary to have a thorough understanding of the influence of different length scales and evolving microstructure on the overall behavior. In this study, distinction is made between the effect of structural and material length scale on the mechanical behavior of materials. A length scale associated with an underlying physical mechanism influencing the mechanical behavior can overlap with either structural length scales or material length scales. If it overlaps with structural length scales, then the material is said to be dimensionally constrained. On the other hand, if it overlaps with material length scales, for example grain size, then the material is said to be microstructurally constrained. The objectives of this research work are: (1) to investigate scale and size effects due to dimensional constraints; (2) to investigate size effects due to microstructural constraints; and (3) to develop a size dependent hardening model through coarse graining of dislocation dynamics. A discrete dislocation dynamics (DDD) framework where the

  11. Rashba coupling amplification by a staggered crystal field

    PubMed Central

    Santos-Cottin, David; Casula, Michele; Lantz, Gabriel; Klein, Yannick; Petaccia, Luca; Le Fèvre, Patrick; Bertran, François; Papalazarou, Evangelos; Marsi, Marino; Gauzzi, Andrea

    2016-01-01

    There has been increasing interest in materials where relativistic effects induce non-trivial electronic states with promise for spintronics applications. One example is the splitting of bands with opposite spin chirality produced by the Rashba spin-orbit coupling in asymmetric potentials. Sizable splittings have been hitherto obtained using either heavy elements, where this coupling is intrinsically strong, or large surface electric fields. Here by means of angular resolved photoemission spectroscopy and first-principles calculations, we give evidence of a large Rashba coupling of 0.25 eV Å, leading to a remarkable band splitting up to 0.15 eV with hidden spin-chiral polarization in centrosymmetric BaNiS2. This is explained by a huge staggered crystal field of 1.4 V Å−1, produced by a gliding plane symmetry, that breaks inversion symmetry at the Ni site. This unexpected result in the absence of heavy elements demonstrates an effective mechanism of Rashba coupling amplification that may foster spin-orbit band engineering. PMID:27089869

  12. Rashba coupling amplification by a staggered crystal field

    NASA Astrophysics Data System (ADS)

    Santos-Cottin, David; Casula, Michele; Lantz, Gabriel; Klein, Yannick; Petaccia, Luca; Le Fèvre, Patrick; Bertran, François; Papalazarou, Evangelos; Marsi, Marino; Gauzzi, Andrea

    2016-04-01

    There has been increasing interest in materials where relativistic effects induce non-trivial electronic states with promise for spintronics applications. One example is the splitting of bands with opposite spin chirality produced by the Rashba spin-orbit coupling in asymmetric potentials. Sizable splittings have been hitherto obtained using either heavy elements, where this coupling is intrinsically strong, or large surface electric fields. Here by means of angular resolved photoemission spectroscopy and first-principles calculations, we give evidence of a large Rashba coupling of 0.25 eV Å, leading to a remarkable band splitting up to 0.15 eV with hidden spin-chiral polarization in centrosymmetric BaNiS2. This is explained by a huge staggered crystal field of 1.4 V Å-1, produced by a gliding plane symmetry, that breaks inversion symmetry at the Ni site. This unexpected result in the absence of heavy elements demonstrates an effective mechanism of Rashba coupling amplification that may foster spin-orbit band engineering.

  13. Study of Fluid Flow Control in Protein Crystallization using Strong Magnetic Fields

    NASA Technical Reports Server (NTRS)

    Ramachandran, Narayanan; Leslie, Fred; Ciszak, Ewa

    2002-01-01

    positioning the crystal growth cell so that the magnetic susceptibility force counteracts terrestrial gravity. The general objective is to test the hypothesis of convective control using a strong magnetic field and magnetic field gradient and to understand the nature of the various forces that come into play. Specifically we aim to delineate causative factors and to quantify them through experiments, analysis and numerical modeling. Once the basic understanding is obtained, the study will focus on testing the hypothesis on proteins of pyruvate dehydrogenase complex (PDC), proteins E1 and E3. Obtaining high crystal quality of these proteins is of great importance to structural biologists since their structures need to be determined. Specific goals for the investigation are: 1. To develop an understanding of convection control in diamagnetic fluids with concentration gradients through experimentation and numerical modeling. Specifically solutal buoyancy driven convection due to crystal growth will be considered. 2. To develop predictive measures for successful crystallization in a magnetic field using analyses and numerical modeling for use in future protein crystal growth experiments. This will establish criteria that can be used to estimate the efficacy of magnetic field flow damping on crystallization of candidate proteins. 3. To demonstrate the understanding of convection damping by high magnetic fields to a class of proteins that is of interest and whose structure is as yet not determined. 4. To compare quantitatively, the quality of the grown crystals with and without a magnetic field. X-ray diffraction techniques will be used for the comparative studies. In a preliminary set of experiments, we studied crystal dissolution effects in a 5 Tesla magnet available at NASA Marshall Space Flight Center (MSFC). Using a Schlieren setup, a 1mm crystal of Alum (Aluminum-Potassium Sulfate) was introduced in a 75% saturated solution and the resulting dissolution plume was observed

  14. Control over colloidal crystallization by shear and electric fields

    NASA Astrophysics Data System (ADS)

    Wu, Y. L.

    2007-05-01

    We used shear flow and an electric field to control colloidal crystallization. The structures were examined in situ with confocal microscopy. For experiments under shear, a new parallel plate shear cell was designed. It had a zero-velocity plane that was stationary with respect to the microscope. The plates were microscopy slides of a few square centimeters. They both had a maximum travel of 1 cm and for the systems that we study an oscillatory shear with such a large amplitude can be regarded as a continuous shear. The gap width was variable between 20- 200 m. The plates were parallel within 1-2 m. The flow profile of a dilute suspension was linear, but that of a crystallizing dispersion appeared to be non-linear. At the walls a sliding layer structure formed of which the local viscosity was 1.5 times smaller than that of the liquid-like structure in the middle of the gap. At low shear rates hexagonal layers of a crystal showed a zigzag motion. We also examined shear melting and crystallization. Shear melting appeared to be a local process in which the local order sometimes increased and sometimes decreased while the average order decreased. Shear induced crystallization occurred uniformly over the sample and the order increased monotonously. By spin coating colloidal crystalline films were fabricated that consisted of randomly stacked hexagonal layers. The structures could be made permanent by using a dispersing medium that could be polymerized. The interparticle spacing was not fixed, but probably depended subtly on the surface charge of the particles and the ionic strength of the medium. Different from crystals formed by sedimentation, spin coated crystals were crystalline to the top. This is one of the indications that crystal formation started at the air interface with a 2D layer that grew into a 3D multilayer structure while it was sedimenting. From these spin coated crystals freestanding colloidal crystalline films could be made. Without crack

  15. Bridgman Growth of Germanium Crystals in a Rotating Magnetic Field

    NASA Technical Reports Server (NTRS)

    Volz, M. P.; Schweizer, M.; Cobb, S. D.; Walker, J. S.; Szofran, F. R.; Curreri, Peter A. (Technical Monitor)

    2002-01-01

    A series of (100)-oriented gallium-doped germanium crystals have been grown by the Bridgman method and under the influence of a rotating magnetic field (RMF). The RMF has a marked affect on the interface shape, changing it from concave to nearly flat. The onset of time-dependent flow instabilities occurs when the critical magnetic Taylor number is exceeded, and this can be observed by noting the appearance of striations in the grown crystals. The critical magnetic Taylor number is a sensitive function of the aspect ratio and, as the crystal grows under a constant applied magnetic field, the induced striations change from nonperiodic to periodic, undergo a period-doubling transition, and then cease to exist. Also, by pulsing the RMF on and off, it is shown that intentional interface demarcations can be introduced.

  16. Tailor-made force fields for crystal-structure prediction.

    PubMed

    Neumann, Marcus A

    2008-08-14

    A general procedure is presented to derive a complete set of force-field parameters for flexible molecules in the crystalline state on a case-by-case basis. The force-field parameters are fitted to the electrostatic potential as well as to accurate energies and forces generated by means of a hybrid method that combines solid-state density functional theory (DFT) calculations with an empirical van der Waals correction. All DFT calculations are carried out with the VASP program. The mathematical structure of the force field, the generation of reference data, the choice of the figure of merit, the optimization algorithm, and the parameter-refinement strategy are discussed in detail. The approach is applied to cyclohexane-1,4-dione, a small flexible ring. The tailor-made force field obtained for cyclohexane-1,4-dione is used to search for low-energy crystal packings in all 230 space groups with one molecule per asymmetric unit, and the most stable crystal structures are reoptimized in a second step with the hybrid method. The experimental crystal structure is found as the most stable predicted crystal structure both with the tailor-made force field and the hybrid method. The same methodology has also been applied successfully to the four compounds of the fourth CCDC blind test on crystal-structure prediction. For the five aforementioned compounds, the root-mean-square deviations between lattice energies calculated with the tailor-made force fields and the hybrid method range from 0.024 to 0.053 kcal/mol per atom around an average value of 0.034 kcal/mol per atom. PMID:18642947

  17. Effects of trace elements on the crystal field parameters of Nd ions at the surface of Nd{sub 2}Fe{sub 14}B grains

    SciTech Connect

    Toga, Yuta; Suzuki, Tsuneaki; Sakuma, Akimasa

    2015-06-14

    Using first-principles calculations, we investigate the positional dependence of trace elements such as O and Cu on the crystal field parameter A{sub 2}{sup 0}, proportional to the magnetic anisotropy constant K{sub u} of Nd ions placed at the surface of Nd{sub 2}Fe{sub 14}B grains. The results suggest the possibility that the A{sub 2}{sup 0} parameter of Nd ions at the (001) surface of Nd{sub 2}Fe{sub 14}B grains exhibits a negative value when the O or Cu atom is located near the surface, closer than its equilibrium position. At the (110) surface, however, O atoms located at the equilibrium position provide a negative A{sub 2}{sup 0}, while for Cu additions A{sub 2}{sup 0} remains positive regardless of Cu's position. Thus, Cu atoms are expected to maintain a positive local K{sub u} of surface Nd ions more frequently than O atoms when they approach the grain surfaces in the Nd-Fe-B grains.

  18. Application of a rotating magnetic field to semiconductor crystal growth in Space

    NASA Astrophysics Data System (ADS)

    Senchenkov, A. S.; Barmin, I. V.

    2003-12-01

    To eliminate the tremendous influence of the residual accelerations on homogeneity of the crystal growing in a space experiment, a rotating magnetic field (RMF) is used. A number of the experiments have been performed in space within the RMF both in the frame of the Russian national program and together with European scientists. In the paper some theoretical and experimental results illustrating the effectiveness of RMF application to crystal growth under microgravity conditions are presented. Tables 2, Figs 5, Refs 8.

  19. Electron correlations in semiconductors: Bulk cohesive properties and magnetic-field-induced Wigner crystal at heterojunctions

    SciTech Connect

    Louie, S.G.; Zhu, X.

    1992-08-01

    A correlated wavefunction variational quantum Monte Carlo approach to the studies of electron exchange and correlation effects in semiconductors is presented. Applications discussed include the cohesive and structural properties of bulk semiconductors, and the magnetic-field-induced Wigner electron crystal in two dimensions. Landau level mixing is shown to be important in determining the transition between the quantum Hall liquid and the Wigner crystal states in the regime of relevant experimental parameters.

  20. Effects of Gravity on ZBLAN Glass Crystallization

    NASA Technical Reports Server (NTRS)

    Tucker, Dennis S.; Ethridge, Edwin C.; Smith, G. A.; Workman, G.

    2003-01-01

    The effects of gravity on the crystallization of ZrF4-BaF2-LaF3-AlF3- NaF glasses have been studied utilizing NASA's KC135 and a sounding rocket, Fibers and cylinders of ZBLAN glass were heated to the crystallization temperature in unit and reduced gravity. When processed in unit gravity the glass crystallized, but when processed in reduced gravity, crystallization was suppressed. A possible explanation involving shear thinning is presented to explain these results.

  1. Field Stability of Piezoelectric Shear Properties in PIN-PMN-PT Crystals Under Large Drive Field

    PubMed Central

    Zhang, Shujun; Li, Fei; Luo, Jun; Xia, Ru; Hackenberger, Wesley; Shrout, Thomas R.

    2013-01-01

    The coercive fields (EC) of Pb(In0.5Nb0.5)O3-Pb(Mg1/3Nb2/3)O3-PbTiO3 (PIN-PMN-PT) ternary single crystals were found to be 5 kV/cm, double the value of binary Pb(Mg1/3Nb2/3)O3-PbTiO3 (PMNT) crystals, further increased to 6 to 9 kV/cm using Mn modifications. In addition to an increased EC, the acceptor modification resulted in the developed internal bias (Eint), on the order of ~1 kV/cm. The piezoelectric shear properties of unmodified and Mn-modified PIN-PMN-PT crystals with various domain configurations were investigated. The shear piezoelectric coefficients and electromechanical coupling factors for different domain configurations were found to be >2000 pC/N and >0.85, respectively, with slightly reduced properties observed in Mn-modified tetragonal crystals. Fatigue/cycling tests performed on shear-mode samples as a function of ac drive field level demonstrated that the allowable ac field levels (the maximum applied ac field before the occurrence of depolarization) were only ~2 kV/cm for unmodified crystals, less than half of their coercive field. Allowable ac drive levels were on the order of 4 to 6 kV/cm for Mn-modified crystals with rhombohedral/orthorhombic phase, further increased to 5 to 8 kV/cm in tetragonal crystals, because of their higher coercive fields. It is of particular interest that the allowable ac drive field level for Mn-modified crystals was found to be ≥60% of their coercive fields, because of the developed Eint, induced by the acceptor-oxygen vacancy defect dipoles. PMID:21342812

  2. Reorientation of single-wall carbon nanotubes in negative anisotropy liquid crystals by an electric field

    PubMed Central

    García-García, Amanda; Vergaz, Ricardo; Algorri, José F; Zito, Gianluigi; Cacace, Teresa; Marino, Antigone; Otón, José M

    2016-01-01

    Summary Single-wall carbon nanotubes (SWCNT) are anisotropic nanoparticles that can cause modifications in the electrical and electro-optical properties of liquid crystals. The control of the SWCNT concentration, distribution and reorientation in such self-organized fluids allows for the possibility of tuning the liquid crystal properties. The alignment and reorientation of CNTs are studied in a system where the liquid crystal orientation effect has been isolated. Complementary studies including Raman spectroscopy, microscopic inspection and impedance studies were carried out. The results reveal an ordered reorientation of the CNTs induced by an electric field, which does not alter the orientation of the liquid crystal molecules. Moreover, impedance spectroscopy suggests a nonnegligible anchoring force between the CNTs and the liquid crystal molecules. PMID:27547599

  3. Reorientation of single-wall carbon nanotubes in negative anisotropy liquid crystals by an electric field.

    PubMed

    García-García, Amanda; Vergaz, Ricardo; Algorri, José F; Zito, Gianluigi; Cacace, Teresa; Marino, Antigone; Otón, José M; Geday, Morten A

    2016-01-01

    Single-wall carbon nanotubes (SWCNT) are anisotropic nanoparticles that can cause modifications in the electrical and electro-optical properties of liquid crystals. The control of the SWCNT concentration, distribution and reorientation in such self-organized fluids allows for the possibility of tuning the liquid crystal properties. The alignment and reorientation of CNTs are studied in a system where the liquid crystal orientation effect has been isolated. Complementary studies including Raman spectroscopy, microscopic inspection and impedance studies were carried out. The results reveal an ordered reorientation of the CNTs induced by an electric field, which does not alter the orientation of the liquid crystal molecules. Moreover, impedance spectroscopy suggests a nonnegligible anchoring force between the CNTs and the liquid crystal molecules. PMID:27547599

  4. Lattice effects in YVO 3 single crystal

    NASA Astrophysics Data System (ADS)

    Marquina, C.; Sikora, M.; Ibarra, M. R.; Nugroho, A. A.; Palstra, T. T. M.

    2005-04-01

    In this paper we report on the lattice effects in the Mott insulator yttrium orthovanadate (YVO3). Linear thermal expansion and magnetostriction experiments have been performed on a single crystal, in the temperature range from 5 K to room temperature. The YVO3 orders antiferromagnetically at TN=116 K and orbital ordering was reported to appear below TOO=196 K. A first-order structural phase transition takes place at TS=77 K, accompanied by changes in the antiferromagnetic type of ordering as well as in the orbital-ordering type. Our results reveal that the thermal expansion measurement technique is a very powerful tool in order to clearly detect the existence of the above-mentioned transitions. The magnetostriction results point to the stability of the low-temperature-magnetic ground state under such high applied magnetic field.

  5. Effect of power arrangement on the crystal shape during the Kyropoulos sapphire crystal growth process

    NASA Astrophysics Data System (ADS)

    Chen, Chun-Hung; Chen, Jyh-Chen; Lu, Chung-Wei; Liu, Che-Ming

    2012-08-01

    The Kyropoulos (KY) method is commonly used to grow large sized sapphire single crystals. The shape of the sapphire crystal thus grown is determined by the heater arrangement and the power reduction history in the Kyropoulos furnace. In order to grow high-quality sapphire single crystal, the heater arrangement should allow different power inputs in different sections in order to control the thermal field in the melt during the growth process. In this study, a numerical computation is performed to investigate the effects of the heater arrangement on the thermal and flow transport, the shape of the crystal-melt interface, and the power requirements during the Kyropoulos sapphire crystal growth process in a resistance heated furnace. Four different power ratio arrangements in a three-zone heater are considered. The results show that for the power arrangements considered herein, the temperature gradients along the crystallization front do not exceed 0.05 K/mm, and that, after the growth of the crown, the crystal maintains an almost constant diameter. The remelting phenomenon may occur during growth when the input power of the upper side of the heater is higher than that of the lower side of the heater.

  6. Anisotropic local modification of crystal field levels in Pr-based pyrochlores: a muon-induced effect modeled using density functional theory.

    PubMed

    Foronda, F R; Lang, F; Möller, J S; Lancaster, T; Boothroyd, A T; Pratt, F L; Giblin, S R; Prabhakaran, D; Blundell, S J

    2015-01-01

    Although muon spin relaxation is commonly used to probe local magnetic order, spin freezing, and spin dynamics, we identify an experimental situation in which the measured response is dominated by an effect resulting from the muon-induced local distortion rather than the intrinsic behavior of the host compound. We demonstrate this effect in some quantum spin ice candidate materials Pr(2)B(2)O(7) (B=Sn, Zr, Hf), where we detect a static distribution of magnetic moments that appears to grow on cooling. Using density functional theory we show how this effect can be explained via a hyperfine enhancement arising from a splitting of the non-Kramers doublet ground states on Pr ions close to the muon, which itself causes a highly anisotropic distortion field. We provide a quantitative relationship between this effect and the measured temperature dependence of the muon relaxation and discuss the relevance of these observations to muon experiments in other magnetic materials. PMID:25615502

  7. A phase-field model coupled with lattice kinetics solver for modeling crystal growth in furnaces

    SciTech Connect

    Lin, Guang; Bao, Jie; Xu, Zhijie; Tartakovsky, Alexandre M.; Henager, Charles H.

    2014-02-02

    In this study, we present a new numerical model for crystal growth in a vertical solidification system. This model takes into account the buoyancy induced convective flow and its effect on the crystal growth process. The evolution of the crystal growth interface is simulated using the phase-field method. Two novel phase-field models are developed to model the crystal growth interface in vertical gradient furnaces with two temperature profile setups: 1) fixed wall temperature profile setup and 2) time-dependent temperature profile setup. A semi-implicit lattice kinetics solver based on the Boltzmann equation is employed to model the unsteady incompressible flow. This model is used to investigate the effect of furnace operational conditions on crystal growth interface profiles and growth velocities. For a simple case of macroscopic radial growth, the phase-field model is validated against an analytical solution. Crystal growth in vertical gradient furnaces with two temperature profile setups have been also investigated using the developed model. The numerical simulations reveal that for a certain set of temperature boundary conditions, the heat transport in the melt near the phase interface is diffusion dominant and advection is suppressed.

  8. Low-field susceptibility anisotropy of some biotite crystals

    NASA Astrophysics Data System (ADS)

    Zapletal, Karel

    1990-10-01

    The low-field magnetic susceptibility anisotropy (LMA) of weakly magnetic rocks is dominated by paramagnetic minerals among which micas, and mainly biotite, is important. For this reason, the LMA of biotite crystals was investigated in detail. Natural biotite crystals (from ten localities) having a wide range of iron concentration were also studied by other methods, including optical microscopy, X-ray microanalysis, Mössbauer spectroscopy and induced isothermal remanent magnetization. Ferromagnetic inclusions disturbing the magnetic properties of biotite were revealed in some crystals. The measured mean bulk susceptibility of pure crystals (four localities) ranges from 1.0 × 10 -3 to 1.8 × 10 -3 SI and agrees with the susceptibility calculated from the iron concentration (ranging from 12 to 20 wt.%) determined for each specimen. The susceptibility ellipsoid of pure biotite crystals is rotational about the minimum susceptibility direction parallel to the crystallographic c'-axis, and the anisotropy degree ranges from 1.34 to 1.36.

  9. Magnetic field controlled FZ single crystal growth of intermetallic compounds

    NASA Astrophysics Data System (ADS)

    Hermann, R.; Behr, G.; Gerbeth, G.; Priede, J.; Uhlemann, H.-J.; Fischer, F.; Schultz, L.

    2005-02-01

    Intermetallic rare-earth-transition-metal compounds with their coexistence of magnetic ordering and superconductivity are still of great scientific interest. The crystal growth of bulk single crystals is very often unsuccessful due to an unfavorable solid-liquid interface geometry enclosing concave fringes. The aim of the work is the contactless control of heat and material transport during floating-zone single crystal growth of intermetallic compounds. This control is provided by a tailored design of the electromagnetic field and the resulting electromagnetically driven convection. Numerical simulations for the determination of the electromagnetic field configuration induced by the RF heater coil and the solution of the coupled heat and hydrodynamic equations were done for the model substance Ni with and without additional magnetic field. As a result, an innovative magnetic two-phase stirrer system has been developed which enables the controlled influence on the melt ranging from intensive inwards/outwards flows to flows almost at rest. The selection of parameters necessary for the desired fluid flow is determined from numerical simulation. The basis for the calculations are the process-related fluid flow conditions which are determined by the mode of heating, heat radiation at the free surface and material parameters. This treatment of the problem leads to the customised magnetic field for the special intermetallic compound. The application of the new magnetic system leads to a distinct improvement of the solid-liquid interface validated on experiments with the model substance Nickel.

  10. 3D crack tip fields for FCC single crystals

    SciTech Connect

    Cuitino, A.M.; Ortiz, M.

    1995-12-31

    Cracks in single crystals are of concern in a number of structural and non-structural applications, ranging form single-crystal turbine blades and rotors to metal interconnect lines in microcircuits. In this paper we present 3D numerical simulations of the crack-tip fields of a Cu single crystal, including stress, strain and slip activity patterns. The orientation of the crack tip is along the crystallographic orientation (101), while the crack plane is (010). A material model based on dislocation mechanics is used in these simulations. This model correctly predicts the observed behavior of Cu, including the basic hardening characteristics of single crystals, orientation dependence and stage I-II-III structure of the stress-strain curves, the observed levels of latent hardening and their variation with orientation and deformation in the primary system and slip activities and dislocation densities. We use the FEM within the context of finite deformation plasticity. In the figure below, we show the finite element mesh composed by 12-noded tetrahedrons with 6-noded triangular faces. The model simulates half of a beam, which is subjected to a concentrated load at 1/8 of total length from the support. Detailed results of the stress, deformation and slip activity are presented at different radii from crack tip and at different depths from the surface. In general, the results show a strong difference in the slip activity pattern form the interior to the exterior, while smaller differences are encountered in the stress and strain fields.

  11. Self-Aligned Growth of Organic Semiconductor Single Crystals by Electric Field.

    PubMed

    Kotsuki, Kenji; Obata, Seiji; Saiki, Koichiro

    2016-01-19

    We proposed a novel but facile method for growing organic semiconductor single-crystals via solvent vapor annealing (SVA) under electric field. In the conventional SVA growth process, nuclei of crystals appeared anywhere on the substrate and their crystallographic axes were randomly distributed. We applied electric field during the SVA growth of 2,7-dioctyl[1]benzothieno[3,2-b][1]benzothiophene (C8-BTBT) on the SiO2/Si substrate on which a pair of electrodes had been deposited beforehand. Real-time observation of the SVA process revealed that rodlike single crystals grew with their long axes parallel to the electric field and bridged the prepatterned electrodes. As a result, C8-BTBT crystals automatically formed a field effect transistor (FET) structure and the mobility reached 1.9 cm(2)/(V s). Electric-field-assisted SVA proved a promising method for constructing high-mobility single-crystal FETs at the desired position by a low-cost solution process. PMID:26695105

  12. Field-induced phase transitions in chiral smectic liquid crystals studied by the constant current method

    NASA Astrophysics Data System (ADS)

    H, Dhaouadi; R, Zgueb; O, Riahi; F, Trabelsi; T, Othman

    2016-05-01

    In ferroelectric liquid crystals, phase transitions can be induced by an electric field. The current constant method allows these transition to be quickly localized and thus the (E,T) phase diagram of the studied product can be obtained. In this work, we make a slight modification to the measurement principles based on this method. This modification allows the characteristic parameters of ferroelectric liquid crystal to be quantitatively measured. The use of a current square signal highlights a phenomenon of ferroelectric hysteresis with remnant polarization at null field, which points out an effect of memory in this compound.

  13. Influence of electromagnetic field intensity on the metastable zone width of CaCO3 crystallization in circulating water

    NASA Astrophysics Data System (ADS)

    Wang, Jianguo; Liang, Yandong; Chen, Si

    2016-09-01

    In this study, changes in the metastable zone width of CaCO3 crystallization was determined through conductivity titration by altering electromagnetic field parameters applied to the circulating water system. The critical conductivity value and metastable zone curves of CaCO3 crystallization were determined under different solution concentrations and electromagnetic field intensities. Experimental results indicate that the effect of the electromagnetic field intensity on the critical conductivity value intensifies with the increase of solution concentration. Moreover, the metastable zone width of CaCO3 crystallization increases with the increase of electromagnetic field intensity within 200 Gs, thereby prolonging the induction period of nucleation.

  14. Low-frequency electromagnetic field in a Wigner crystal

    SciTech Connect

    Stupka, Anton

    2013-03-15

    Long-wave low-frequency oscillations are described in a Wigner crystal by generalization of the reverse continuum model for the case of electronic lattice. The internal self-consistent long-wave electromagnetic field is used to describe the collective motions in the system. The eigenvectors and eigenvalues of the obtained system of equations are derived. The velocities of longitudinal and transversal sound waves are found.

  15. Convection effects in protein crystal growth

    NASA Technical Reports Server (NTRS)

    Roberts, Glyn O.

    1988-01-01

    Protein crystals for X-ray diffraction study are usually grown resting on the bottom of a hanging drop of a saturated protein solution, with slow evaporation to the air in a small enclosed cell. The evaporation rate is controlled by hanging the drop above a reservoir of water, with its saturation vapor pressure decreased by a low concentration of a passive solute. The drop has a lower solute concentration, and its volume shrinks by evaporation until the molecular concentrations match. Protein crystals can also be grown from a seed crystal suspended or supported in the interior of a supersaturated solution. The main analysis of this report concerns this case because it is less complicated than hanging-drop growth. Convection effects have been suggested as the reason for the apparent cessation of growth at a certain rather small crystal size. It seeems that as the crystal grows, the number of dislocations increases to a point where further growth is hindered. Growth in the microgravity environment of an orbiting space vehicle has been proposed as a method for obtaining larger crystals. Experimental observations of convection effects during the growth of protein crystals have been reported.

  16. Plasticity and dislocation dynamics in a phase field crystal model.

    PubMed

    Chan, Pak Yuen; Tsekenis, Georgios; Dantzig, Jonathan; Dahmen, Karin A; Goldenfeld, Nigel

    2010-07-01

    The critical dynamics of dislocation avalanches in plastic flow is examined using a phase field crystal model. In the model, dislocations are naturally created, without any ad hoc creation rules, by applying a shearing force to the perfectly periodic ground state. These dislocations diffuse, interact and annihilate with one another, forming avalanche events. By data collapsing the event energy probability density function for different shearing rates, a connection to interface depinning dynamics is confirmed. The relevant critical exponents agree with mean field theory predictions. PMID:20867460

  17. Surface mediated nonlinear optic effects in liquid crystals

    NASA Astrophysics Data System (ADS)

    Merlin, Jessica M.

    Liquid crystals have become a significant part of technology, mainly through their use in the display industry. This is due in part to the fact that the optical properties of liquid crystals are easily manipulated electronically. It has been recognized that the optical properties liquid crystals may also be controlled using light. Because of this, there are other various applications being explored for liquid crystals in photorefraction, optical limiting and switching, and in spatial light modulators. Although, the photorefractive effect was reported in liquid crystals over 10 years ago, there is still controversy over the exact mechanism for the reorientation of the liquid crystal director. This difficulty may be due in part to the fact that it is difficult to characterize the effect using photorefractive measurements and figures of merit. The optical and electronic control of liquid crystals will be studied here using a Friedericksz transition measurement in a twist cell geometry. This type of apparatus was chosen because it leads to a more direct demonstration of the surface effect. Namely, by studying changes in the Friedericksz transition threshold in a twist cell, a more direct observation of changes in the internal field may be observed. First a brief introduction to liquid crystals and their role in technology will be presented. This will be followed by a more rigorous discussion of the physics of liquid crystals and a review of the important literature. The experimental apparatus and the materials and cell geometry used will be described followed by the results of those measurements. Finally, the results will be considered in terms of a model involving interfacial charge and discussed in the context of previous work.

  18. Effect of Interaction of the Temperature Field and Supersaturation on the Morphology of the Solid-Vapor Interface in Crystal Growth by Physical Vapor Transport

    NASA Technical Reports Server (NTRS)

    Grasza, K.; Palosz, W.; Curreri, Peter A. (Technical Monitor)

    2002-01-01

    An in-situ study of the morphology of the solid-vapor interface during iodine crystal growth was done. The conditions for terrace growth, flat faces formation and retraction, competition between sources of steps, formation of protrusions, surface roughening, and defect overgrowth are demonstrated and discussed.

  19. Crystal field parameters and energy levels scheme of trivalent chromium doped BSO

    SciTech Connect

    Petkova, P.; Andreici, E.-L.; Avram, N. M.

    2014-11-24

    The aim of this paper is to give an analysis of crystal field parameters and energy levels schemes for the above doped material, in order to give a reliable explanation for experimental data. The crystal field parameters have been modeled in the frame of Exchange Charge Model (ECM) of the crystal field theory, taken into account the geometry of systems, with actually site symmetry of the impurity ions. The effect of the charges of the ligands and covalence bonding between chromium cation and oxygen anions, in the cluster approach, also were taken into account. With the obtained values of the crystal field parameters we simulated the scheme of energy levels of chromium ions by diagonalizing the matrix of the Hamiltonian of the doped crystal. The obtained energy levels and estimated Racah parameters B and C were compared with the experimental spectroscopic data and discussed. Comparison with experiment shows that the results are quite satisfactory which justify the model and simulation scheme used for the title system.

  20. Crystal field parameters and energy levels scheme of trivalent chromium doped BSO

    NASA Astrophysics Data System (ADS)

    Petkova, P.; Andreici, E.-L.; Avram, N. M.

    2014-11-01

    The aim of this paper is to give an analysis of crystal field parameters and energy levels schemes for the above doped material, in order to give a reliable explanation for experimental data. The crystal field parameters have been modeled in the frame of Exchange Charge Model (ECM) of the crystal field theory, taken into account the geometry of systems, with actually site symmetry of the impurity ions. The effect of the charges of the ligands and covalence bonding between chromium cation and oxygen anions, in the cluster approach, also were taken into account. With the obtained values of the crystal field parameters we simulated the scheme of energy levels of chromium ions by diagonalizing the matrix of the Hamiltonian of the doped crystal. The obtained energy levels and estimated Racah parameters B and C were compared with the experimental spectroscopic data and discussed. Comparison with experiment shows that the results are quite satisfactory which justify the model and simulation scheme used for the title system.

  1. Discrete dislocation plasticity and crack tip fields in single crystals

    NASA Astrophysics Data System (ADS)

    Van der Giessen, E.; Deshpande, V. S.; Cleveringa, H. H. M.; Needleman, A.

    2001-09-01

    Small-scale yielding around a stationary plane strain mode I crack is analyzed using discrete dislocation plasticity. The dislocations are all of edge character, and are modeled as line singularities in a linear elastic material. Superposition is used to represent the solution in terms of analytical fields for edge dislocations in a half-space and a numerical image solution that enforces the boundary conditions. The description of the dislocation dynamics includes the lattice resistance to dislocation motion, dislocation nucleation, interaction with obstacles and annihilation. A model planar crystal with three slip systems is considered. Two slip system orientations are analyzed that differ by a 90° rotation. The non-hardening, single crystal plasticity continuum slip solution of Rice (Mech. Mater. 6 (1987) 317) for this model crystal predicts that slip and kink bands emerge for both crystal geometries, while Drugan (J. Mech. Phys. Solids 49 (2001) 2155) has obtained kink band free solutions. For a reference set of parameter values, kink band free solutions are found in one orientation while the emergence of kink bands is seen in the other orientation. However, lowering the dislocation source density suppresses the formation of kink bands in this orientation as well. In all calculations, the opening stress in the immediate vicinity of the crack tip is much larger than predicted by continuum slip theory.

  2. An optimized intermolecular force field for hydrogen-bonded organic molecular crystals using atomic multipole electrostatics.

    PubMed

    Pyzer-Knapp, Edward O; Thompson, Hugh P G; Day, Graeme M

    2016-08-01

    We present a re-parameterization of a popular intermolecular force field for describing intermolecular interactions in the organic solid state. Specifically we optimize the performance of the exp-6 force field when used in conjunction with atomic multipole electrostatics. We also parameterize force fields that are optimized for use with multipoles derived from polarized molecular electron densities, to account for induction effects in molecular crystals. Parameterization is performed against a set of 186 experimentally determined, low-temperature crystal structures and 53 measured sublimation enthalpies of hydrogen-bonding organic molecules. The resulting force fields are tested on a validation set of 129 crystal structures and show improved reproduction of the structures and lattice energies of a range of organic molecular crystals compared with the original force field with atomic partial charge electrostatics. Unit-cell dimensions of the validation set are typically reproduced to within 3% with the re-parameterized force fields. Lattice energies, which were all included during parameterization, are systematically underestimated when compared with measured sublimation enthalpies, with mean absolute errors of between 7.4 and 9.0%. PMID:27484370

  3. An optimized intermolecular force field for hydrogen-bonded organic molecular crystals using atomic multipole electrostatics

    PubMed Central

    Pyzer-Knapp, Edward O.; Thompson, Hugh P. G.; Day, Graeme M.

    2016-01-01

    We present a re-parameterization of a popular intermolecular force field for describing intermolecular interactions in the organic solid state. Specifically we optimize the performance of the exp-6 force field when used in conjunction with atomic multipole electrostatics. We also parameterize force fields that are optimized for use with multipoles derived from polarized molecular electron densities, to account for induction effects in molecular crystals. Parameterization is performed against a set of 186 experimentally determined, low-temperature crystal structures and 53 measured sublimation enthalpies of hydrogen-bonding organic molecules. The resulting force fields are tested on a validation set of 129 crystal structures and show improved reproduction of the structures and lattice energies of a range of organic molecular crystals compared with the original force field with atomic partial charge electrostatics. Unit-cell dimensions of the validation set are typically reproduced to within 3% with the re-parameterized force fields. Lattice energies, which were all included during parameterization, are systematically underestimated when compared with measured sublimation enthalpies, with mean absolute errors of between 7.4 and 9.0%. PMID:27484370

  4. Transverse magnetic field impact on waveguide modes of photonic crystals.

    PubMed

    Sylgacheva, Daria; Khokhlov, Nikolai; Kalish, Andrey; Dagesyan, Sarkis; Prokopov, Anatoly; Shaposhnikov, Alexandr; Berzhansky, Vladimir; Nur-E-Alam, Mohammad; Vasiliev, Mikhail; Alameh, Kamal; Belotelov, Vladimir

    2016-08-15

    This Letter presents a theoretical and experimental study of waveguide modes of one-dimensional magneto-photonic crystals magnetized in the in-plane direction. It is shown that the propagation constants of the TM waveguide modes are sensitive to the transverse magnetization and the spectrum of the transverse magneto-optical Kerr effect has resonant features at mode excitation frequencies. Two types of structures are considered: a non-magnetic photonic crystal with an additional magnetic layer on top and a magneto-photonic crystal with a magnetic layer within each period. We found that the magneto-optical non-reciprocity effect is greater in the first case: it has a magnitude of δ∼10-4, while the second structure type demonstrates δ∼10-5 only, due to the higher asymmetry of the claddings of the magnetic layer. Experimental observations show resonant features in the optical and magneto-optical Kerr effect spectra. The measured dispersion properties are in good agreement with the theoretical predictions. An amplitude of light intensity modulation of up to 2.5% was observed for waveguide mode excitation within the magnetic top layer of the non-magnetic photonic crystal structure. The presented theoretical approach may be utilized for the design of magneto-optical sensors and modulators requiring pre-determined spectral features. PMID:27519096

  5. Long-range orientational order, local-field anisotropy, and mean molecular polarizability in liquid crystals

    SciTech Connect

    Aver'yanov, E. M.

    2009-01-15

    The problems on the relation of the mean effective molecular polarizability {gamma}-bar to the long-range orientational order of molecules (the optical anisotropy of the medium) in uniaxial and biaxial liquid crystals, the local anisotropy on mesoscopic scales, and the anisotropy of the Lorentz tensor L and the local-field tensor f are formulated and solved. It is demonstrated that the presence of the long-range orientational order of molecules in liquid crystals imposes limitations from below on the molecular polarizability {gamma}-bar, which differs for uniaxial and biaxial liquid crystals. The relation between the local anisotropy and the molecular polarizability {gamma}-bar is investigated for calamitic and discotic uniaxial liquid crystals consisting of lath- and disk-shaped molecules. These liquid crystals with identical macroscopic symmetry differ in the local anisotropy and the relationships between the components L{sub parallel} < L{sub perpendicular} , f{sub parallel} < f{sub perpendicular} (calamitic) and L{sub parallel} > L{sub perpendicular} , f{sub parallel} > f{sub perpendicular} (discotic) for an electric field oriented parallel and perpendicular to the director. The limitations from below and above on the molecular polarizability {gamma}-bar due to the anisotropy of the tensors L and f are established for liquid crystals of both types. These limitations indicate that the molecular polarizability {gamma}-bar depends on the phase state and the temperature. The factors responsible for the nonphysical consequences of the local-field models based on the approximation {gamma}-bar = const are revealed. The theoretical inferences are confirmed by the experimental data for a number of calamitic nematic liquid crystals with different values of birefringence and the discotic liquid crystal Col{sub ho}.

  6. AOM reconciling of crystal field parameters for UCl sub 3 , UBr sub 3 , Ul sub 3 series

    SciTech Connect

    Gajek, Z.; Mulak, J. )

    1990-07-01

    Available inelastic neutron scattering interpretations of crystal field effect in the uranium trihalides have been verified in terms of Angular Overlap Model. For UCl{sub 3} a good reconciling of both INS and optical interpretations of crystal field effect has been obtained. On the contrary, the parameterizations for UBr{sub 3} and UI{sub 3} were found to be highly artificial and suggestion is given to experimentalists to reinterpret their INS spectra.

  7. Travelling magnetic fields applied to bulk crystal growth from the melt: The step from basic research to industrial scale

    NASA Astrophysics Data System (ADS)

    Rudolph, Peter

    2008-04-01

    After introduction of various types of magnetic fields in crystal growth, their main pros and cons for crystallization processes are discussed. It is shown that their further developments towards industrial maturity are bound up with the cardinal demands—increase of the process output, improvement of the crystal quality, and reduction of costs. In a further section, the advantages of travelling magnetic fields are presented. The central chapter is devoted to the target of the current KRISTMAG˜ project—the development of an internal heater-magnet module for coupled generation of temperature and a travelling magnetic field, suitable for incorporation into industrial Czochralski pullers and vertical gradient freeze equipments. Amplitude, frequency and phase shift of the three-phase current are all adjustable and are combined with a dc component to control the crystallization process effectively. Results of accompanying numeric modelling are presented. The current state of crystal growth experiments in travelling magnetic field and first encouraging results are given.

  8. An unforeseen polymorph of coronene by the application of magnetic fields during crystal growth

    PubMed Central

    Potticary, Jason; Terry, Lui R.; Bell, Christopher; Papanikolopoulos, Alexandros N.; Christianen, Peter C. M.; Engelkamp, Hans; Collins, Andrew M.; Fontanesi, Claudio; Kociok-Köhn, Gabriele; Crampin, Simon; Da Como, Enrico; Hall, Simon R.

    2016-01-01

    The continued development of novel drugs, proteins, and advanced materials strongly rely on our ability to self-assemble molecules in solids with the most suitable structure (polymorph) in order to exhibit desired functionalities. The search for new polymorphs remains a scientific challenge, that is at the core of crystal engineering and there has been a lack of effective solutions to this problem. Here we show that by crystallizing the polyaromatic hydrocarbon coronene in the presence of a magnetic field, a polymorph is formed in a β-herringbone structure instead of the ubiquitous γ-herringbone structure, with a decrease of 35° in the herringbone nearest neighbour angle. The β-herringbone polymorph is stable, preserves its structure under ambient conditions and as a result of the altered molecular packing of the crystals, exhibits significant changes to the optical and mechanical properties of the crystal. PMID:27161600

  9. An unforeseen polymorph of coronene by the application of magnetic fields during crystal growth

    NASA Astrophysics Data System (ADS)

    Potticary, Jason; Terry, Lui R.; Bell, Christopher; Papanikolopoulos, Alexandros N.; Christianen, Peter C. M.; Engelkamp, Hans; Collins, Andrew M.; Fontanesi, Claudio; Kociok-Köhn, Gabriele; Crampin, Simon; da Como, Enrico; Hall, Simon R.

    2016-05-01

    The continued development of novel drugs, proteins, and advanced materials strongly rely on our ability to self-assemble molecules in solids with the most suitable structure (polymorph) in order to exhibit desired functionalities. The search for new polymorphs remains a scientific challenge, that is at the core of crystal engineering and there has been a lack of effective solutions to this problem. Here we show that by crystallizing the polyaromatic hydrocarbon coronene in the presence of a magnetic field, a polymorph is formed in a β-herringbone structure instead of the ubiquitous γ-herringbone structure, with a decrease of 35° in the herringbone nearest neighbour angle. The β-herringbone polymorph is stable, preserves its structure under ambient conditions and as a result of the altered molecular packing of the crystals, exhibits significant changes to the optical and mechanical properties of the crystal.

  10. Entropy changes and caloric effects in RAl2 single crystals

    NASA Astrophysics Data System (ADS)

    Antunes de Oliveira, Nilson; Caro Patiño, Julieth; von Ranke, Pedro R.

    2015-03-01

    In this work we theoretically discuss the entropy changes and the caloric effects in RAl2 single crystals, which crystalize in the cubic symmetry and have large magneto crystalline anisotropy due to the crystal electric field. For this purpose, we use a model of interacting magnetic moments including a term to account for the crystal electric field. We apply the model to calculate the entropy changes and the magnetocaloric quantities in TmAl2 and NdAl2 by applying magnetic field variations in different crystallographic directions. Our calculations for the entropy changes in these compounds are in a reasonable agreement with the available experimental data for ΔB = 7 T. Further experimental data are necessary to compare with our theoretical predictions for the adiabatic temperature change. We also calculate the caloric quantities by fixing the magnitude of the magnetic field and rotating its direction. In this case, our calculations predict an anomaly (i.e. a change of sign) in the caloric quantities of TmAl2 when a magnetic field of 3 T rotates from < 100 > to < 110 > direction. A similar behavior is also observed in NdAl2. This very interesting fact, which is basically due to the magneto crystalline anisotropy, needs experimental data to be confirmed CNPq, CAPES, FAPERJ.

  11. Low-Temperature Band Transport and Impact of Contact Resistance in Organic Field-Effect Transistors Based on Single-Crystal Films of Ph-BTBT-C10

    NASA Astrophysics Data System (ADS)

    Cho, Joung-min; Mori, Takehiko

    2016-06-01

    Transistors based on single-crystal films of 2-decyl-7-phenyl-[1]benzothieno[3,2-b][1]benzothiophene (Ph-BTBT-10) fabricated using the blade-coating method are investigated by the four-probe method down to low temperatures. The four-probe mobility is as large as 18 cm2/V s at room temperature, and increases to 45 cm2/V s at 80 K. At 60 K the two-probe mobility drops abruptly by about 50%, but the mobility drop is mostly attributed to the increase of the source resistance. The carrier transport in the present single-crystal film is regarded as essentially bandlike down to 30 K.

  12. Portable piezoelectric crystal detector for field monitoring of environmental pollutants

    SciTech Connect

    Ho, M.H.; Guilbault, G.G.; Rietz, B.

    1983-09-01

    A portable field monitor was constructed by using a coated piezoelectric crystal for direct monitoring of toluene in a Danish printing plant. Toluene vapor was adsorbed onto the Pluronic F-68 coating on a quartz crystal and a decrease in frequency was observed. Various substances which could interfere with toluene determination were tested. No interference from CO, NH/sub 3/, SO/sub 2/, HCl at 100 ppm are expected. Water vapor interfered and was selectively removed using a Nafion permeation tube. The readings from the piezoelectric detector were compared to two accepted procedures for monitoring toluene, the photoionization detector and the Drager tube. Results indicate that the piezoelectric detector gave data consistent with both other methods and with better relative standard deviations than the other two. 8 references, 2 figures, 1 table.

  13. Bridgman Growth of Germanium Crystals in a Rotating Magnetic Field

    NASA Technical Reports Server (NTRS)

    Volz, M. P.; Szofran, F. R.; Cobb, S. D.; Schweizer, M.; Walker, J. S.

    2005-01-01

    A series of (100)-oriented gallium-doped germanium crystals has been grown by the vertical Bridgman method and under the influence of a rotating magnetic field (RMF). Time-dependent flow instabilities occur when the critical magnetic Taylor number (Tm(sup c)) is exceeded, and this can be observed by noting the appearance of striations in the grown crystals. Tm(sup c) decreases as the aspect ratio of the melt increases, and approaches the theoretical limit expected for an infinite cylinder. Intentional interface demarcations are introduced by pulsing the RMF on and off The RMF has a marked affect on the interface shape, changing it from concave to nearly flat as the RMF strength is increased.

  14. Bridgman Growth of Germanium Crystals in a Rotating Magnetic Field

    NASA Technical Reports Server (NTRS)

    Volz, M. P.; Walker, J. S.; Schweizer, M.; Cobb, S. D.; Szofran, F. R.

    2004-01-01

    A series of (100)-oriented gallium-doped germanium crystals have been grown by the Bridgman method and under the influence of a rotating magnetic field (RMF). Time-dependent flow instabilities occur when the critical magnetic Taylor number (Tm(sup c) is exceeded, and this can be observed by noting the appearance of striations in the grown crystals. The experimental data indicate that Tm(sup c) increases as the aspect ratio of the melt decreases. Modeling calculations predicting Tm(sup c) as a function of aspect ratio are in reasonable agreement with the experimental data. The RMF has a marked affect on the interface shape, changing it from concave to nearly flat as the RMF strength is increased. Also, by pulsing the RMF on and off, it is shown that intentional interface demarcations can be introduced.

  15. Study of Fluid Flow Control in Protein Crystallization using Strong Magnetic Fields

    NASA Technical Reports Server (NTRS)

    Ramachandran, Narayanan; Leslie, Fred; Ciszak, Ewa

    2002-01-01

    positioning the crystal growth cell so that the magnetic susceptibility force counteracts terrestrial gravity. The general objective is to test the hypothesis of convective control using a strong magnetic field and magnetic field gradient and to understand the nature of the various forces that come into play. Specifically we aim to delineate causative factors and to quantify them through experiments, analysis and numerical modeling. Once the basic understanding is obtained, the study will focus on testing the hypothesis on proteins of pyruvate dehydrogenase complex (PDC), proteins E1 and E3. Obtaining high crystal quality of these proteins is of great importance to structural biologists since their structures need to be determined. Specific goals for the investigation are: 1. To develop an understanding of convection control in diamagnetic fluids with concentration gradients through experimentation and numerical modeling. Specifically solutal buoyancy driven convection due to crystal growth will be considered. 2. To develop predictive measures for successful crystallization in a magnetic field using analyses and numerical modeling for use in future protein crystal growth experiments. This will establish criteria that can be used to estimate the efficacy of magnetic field flow damping on crystallization of candidate proteins. 3. To demonstrate the understanding of convection damping by high magnetic fields to a class of proteins that is of interest and whose structure is as yet not determined. 4. To compare quantitatively, the quality of the grown crystals with and without a magnetic field. X-ray diffraction techniques will be used for the comparative studies. In a preliminary set of experiments, we studied crystal dissolution effects in a 5 Tesla magnet available at NASA Marshall Space Flight Center (MSFC). Using a Schlieren setup, a 1mm crystal of Alum (Aluminum-Potassium Sulfate) was introduced in a 75% saturated solution and the resulting dissolution plume was observed

  16. Study of Fluid Flow Control in Protein Crystallization using Strong Magnetic Fields

    NASA Astrophysics Data System (ADS)

    Ramachandran, Narayanan; Leslie, Fred; Ciszak, Ewa

    2002-11-01

    positioning the crystal growth cell so that the magnetic susceptibility force counteracts terrestrial gravity. The general objective is to test the hypothesis of convective control using a strong magnetic field and magnetic field gradient and to understand the nature of the various forces that come into play. Specifically we aim to delineate causative factors and to quantify them through experiments, analysis and numerical modeling. Once the basic understanding is obtained, the study will focus on testing the hypothesis on proteins of pyruvate dehydrogenase complex (PDC), proteins E1 and E3. Obtaining high crystal quality of these proteins is of great importance to structural biologists since their structures need to be determined. Specific goals for the investigation are: 1. To develop an understanding of convection control in diamagnetic fluids with concentration gradients through experimentation and numerical modeling. Specifically solutal buoyancy driven convection due to crystal growth will be considered. 2. To develop predictive measures for successful crystallization in a magnetic field using analyses and numerical modeling for use in future protein crystal growth experiments. This will establish criteria that can be used to estimate the efficacy of magnetic field flow damping on crystallization of candidate proteins. 3. To demonstrate the understanding of convection damping by high magnetic fields to a class of proteins that is of interest and whose structure is as yet not determined. 4. To compare quantitatively, the quality of the grown crystals with and without a magnetic field. X-ray diffraction techniques will be used for the comparative studies. In a preliminary set of experiments, we studied crystal dissolution effects in a 5 Tesla magnet available at NASA Marshall Space Flight Center (MSFC). Using a Schlieren setup, a 1mm crystal of Alum (Aluminum-Potassium Sulfate) was introduced in a 75% saturated solution and the resulting dissolution plume was observed

  17. Statistical mechanics of the flexoelectric effect in nematic liquid crystals

    NASA Astrophysics Data System (ADS)

    Dhakal, Subas; Selinger, Jonathan V.

    2009-03-01

    Flexoelectricity is the phenomenon in which polarization is induced by imposed deformations of the director field in nematic liquid crystals. Recent experiments [1,2] have found that the flexoelectric effect is three orders of magnitude greater for bent-core liquid crystals than for conventional rod-like liquid crystals. To understand this experimental result, we develop a lattice model for the statistical mechanics of the flexoelectric effect. We perform Monte Carlo simulations and mean-field calculations to find the behavior as a function of interaction parameters, temperature, and applied electric field. The resulting phase diagram has four phases: isotropic, uniaxial nematic, biaxial nematic, and polar. In the uniaxial and biaxial nematic phases, there is a large splay or bend flexoelectric effect, which diverges as the system approaches the nematic-polar transition. This model may explain the large bend flexoelectric coefficient observed in bent-core liquid crystals, which have a tendency toward polar order. [1] J. Harden, B. Mbanga, N. Eber, K. Fodor-Csorba, S. Sprunt, J. T. Gleeson, and A. Jakli, Phys. Rev. Lett. 97,157802 (2006). [2] J. Harden, R. Teeling, J. T. Gleeson, S. Sprunt, and A.Jakli, Phys. Rev. E 78, 031702 (2008).

  18. A phase-field/Monte-Carlo model describing organic crystal growth from solution. Investigation of the diffusion-influenced growth of hydroquinone crystals

    NASA Astrophysics Data System (ADS)

    Kundin, J.; Yürüdü, C.; Ulrich, J.; Emmerich, H.

    2009-08-01

    In this paper work we present a phase-field/Monte-Carlo hybrid algorithm for the simulation of solutal growth of organic crystals. The algorithm is subsequently used for an investigation of diffusion effects on the growth mechanisms. This method combines a two-scale phase-field model of the liquid phase epitaxial growth and a Monte-Carlo algorithm of the 2D nucleation and thus is faster than previous purely Monte Carlo simulations of crystal growth. The inclusion of supersaturation and diffusion in the method allows the study of crystal growth under various growth conditions. Parameters used in the hybrid algorithm are bound to the energetic parameters of crystal faces, which can be estimated from a detailed study of the actual crystal structure based on a connected nets analysis, which allows the prediction of the shape and morphology of real crystals. The study of the diffusion effect is carried out based on an example of a hydroquinone crystal, which grows from the water solution at various supersaturations. The dependencies of the growth rate and the nucleation rate on the supersaturation indicate the change of the growth mechanism from spiral growth to 2D nucleation. The difference in the growth rate for various faces is in agreement with the crystal morphologies derived from the attachment energy method and observed experimentally. The main result of the simulation is the evaluation of engineering limits for choosing appropriate external process conditions.

  19. Large area mode field photonic crystal fiber design

    NASA Astrophysics Data System (ADS)

    Guo, Shuqin; An, Wensheng; Wang, Kang; Zhu, Guangxin; Le, Zichun

    2005-11-01

    A novel design method about photonic crystal fiber (PCF) with large area model field (LAMF) is demonstrated. Different from ordinarily design that the core of PCF formed by missing one air holes in the center of section, many air holes distributed in heartland all together come into being the core region. Air holes are arranged regularly in core region and outer cladding regions according to different periodical character, respectively. The effective refractive index (n eff ) of core region should be higher than cladding region because of total internal reflection (TIR) requirement. In this paper, two kinds of typical scheme are offered to realize LAMF-PCF. First, Λ, the spacing of neighboring air holes in whole section is fixed, once the radius of air holes in the core region r c is smaller than the cladding air holes r cla, LAMF-PCF will be formed. The modal area only lessens a little as r c is reduced. Especially, optimal size of r c can nearly make MFA insensitive to wavelength. On the contrary, dispersion parameter of PCF will take place visible change along with r c reduced, and ultra-flattened dispersion character can be realized when r c is optimized. Another method of designing LAMF-PCF is keeping all air holes uniform in the whole section of PCF, but the space of neighboring air holes in the core region Λ c is longer than the cladding region Λ cla, so n eff of core region is higher than the cladding region and TIR can take place.

  20. Electric-field-induced weakly chaotic transients in ferroelectric liquid crystals.

    PubMed

    Śliwa, I; Jeżewski, W; Kuczyński, W

    2016-01-01

    Nonlinear dynamics induced in surface stabilized ferroelectric liquid crystals by strong alternating external electric fields is studied both theoretically and experimentally. As has already been shown, molecular reorientations induced by sufficiently strong fields of high-enough frequencies can reveal a long transient behavior that has a weakly chaotic character. The resulting complex dynamics of ferroelectric liquid crystals can be considered not only as a consequence of irregular motions of particular molecules but also as a repercussion of a surface-enforced partial decorrelation of nonlinear molecular motions within smectic layers. To achieve more insight into the nature of this phenomenon and to show that the underlying complex field-induced behavior of smectic liquid crystals is not exceptional, ranges of system parameters for which the chaotic behavior occurs are determined. It is proved that there exists a large enough set of initial phase trajectory points, for which weakly chaotic long-time transitory phenomena occur, and, thereby, it is demonstrated that such a chaotic behavior can be regarded as being typical for strongly field-driven thin liquid crystal systems. Additionally, the influence of low-amplitude random noise on the duration of the transient processes is numerically studied. The strongly nonlinear contribution to the electro-optic response, experimentally determined for liquid crystal samples at frequencies lower than the actual field frequency, is also analyzed for long-time signal sequences. Using a statistical approach to distinguish numerically response signals of samples from noise generated by measuring devices, it is shown that the distribution of sample signals distinctly differs from the device noise. This evidently corroborates the occurrence of the nonlinear low-frequency effect, found earlier for different surface stabilized liquid crystal samples. PMID:26871130

  1. Vibronic spectra of U4 in octahedral crystal fields

    NASA Astrophysics Data System (ADS)

    Flint, C. D.; Tanner, P. A.

    The absorption spectra of UCl2-6 diluted into the cubic lattices Cs2ZrCl6 and Cs2SnCl6, and of UBr2-6 diluted into Cs2ZrBr6 have been measured at liquid helium temperatures. The derived energy levels, together with earlier luminescence measurements have been used to evaluate the crystal-field, spinorbit coupling, inter-electron repulsion and Trees correction parameters and the corresponding eigenvalues. Several of the states are derived from an almost equal admixture of two or more Russell-Saunders terms. Some magnetic properties are also computed and discussed.

  2. Faceting transitions in crystal growth and heteroepitaxial growth in the anisotropic phase-field crystal model

    NASA Astrophysics Data System (ADS)

    Chen, Cheng; Chen, Zheng; Zhang, Jing; Yang, Tao; Du, Xiu-Juan

    2012-11-01

    We modify the anisotropic phase-field crystal model (APFC), and present a semi-implicit spectral method to numerically solve the dynamic equation of the APFC model. The process results in the acceleration of computations by orders of magnitude relative to the conventional explicit finite-difference scheme, thereby, allowing us to work on a large system and for a long time. The faceting transitions introduced by the increasing anisotropy in crystal growth are then discussed. In particular, we investigate the morphological evolution in heteroepitaxial growth of our model. A new formation mechanism of misfit dislocations caused by vacancy trapping is found. The regular array of misfit dislocations produces a small-angle grain boundary under the right conditions, and it could significantly change the growth orientation of epitaxial layers.

  3. Phase-field-crystal methodology for modeling of structural transformations.

    PubMed

    Greenwood, Michael; Rottler, Jörg; Provatas, Nikolas

    2011-03-01

    We introduce and characterize free-energy functionals for modeling of solids with different crystallographic symmetries within the phase-field-crystal methodology. The excess free energy responsible for the emergence of periodic phases is inspired by classical density-functional theory, but uses only a minimal description for the modes of the direct correlation function to preserve computational efficiency. We provide a detailed prescription for controlling the crystal structure and introduce parameters for changing temperature and surface energies, so that phase transformations between body-centered-cubic (bcc), face-centered-cubic (fcc), hexagonal-close-packed (hcp), and simple-cubic (sc) lattices can be studied. To illustrate the versatility of our free-energy functional, we compute the phase diagram for fcc-bcc-liquid coexistence in the temperature-density plane. We also demonstrate that our model can be extended to include hcp symmetry by dynamically simulating hcp-liquid coexistence from a seeded crystal nucleus. We further quantify the dependence of the elastic constants on the model control parameters in two and three dimensions, showing how the degree of elastic anisotropy can be tuned from the shape of the direct correlation functions. PMID:21517507

  4. Subsurface Stress Fields in Single Crystal (Anisotropic) Contacts

    NASA Technical Reports Server (NTRS)

    Arakere, Nagaraj K.

    2003-01-01

    Single crystal superalloy turbine blades used in high pressure turbomachinery are subject to conditions of high temperature, triaxial steady and fatigue stresses, fretting stresses in the blade attachment and damper contact locations, and exposure to high-pressure hydrogen. The blades are also subjected to extreme variations in temperature during start-up and shutdown transients. The most prevalent HCF failure modes observed in these blades during operation include crystallographic crack initiation/propagation on octahedral planes, and noncrystallographic initiation with crystallographic growth. Numerous cases of crack initiation and crack propagation at the blade leading edge tip, blade attachment regions, and damper contact locations have been documented. Understanding crack initiation/propagation under mixed-mode loading conditions is critical for establishing a systematic procedure for evaluating HCF life of single crystal turbine blades. Techniques for evaluating two and three dimensional subsurface stress fields in anisotropic contacts are presented in this report. Figure 1 shows typical damper contact locations in a turbine blade. The subsurface stress results are used for evaluating contact fatigue life at damper contacts and dovetail attachment regions in single crystal nickel-base superalloy turbine blades.

  5. Crystal Field Studies on MgGa2O4:Ni2+

    NASA Astrophysics Data System (ADS)

    Andreici, L.; Stanciu, M.; Avram, N. M.

    2010-08-01

    The energy levels scheme of octahedrally coordinated Ni2+ ion in single crystal, powder nano-single crystal, ceramics and glass-ceramics of MgGa2O4 host matrix, has been calculated in the exchange charge model of crystal field. The parameters of the crystal field acting on the Ni2+ ion are calculated from the crystal structure data, after optimization of the geometry of the system. The energy level schemes have been calculated by diagonalization of the crystal field Hamiltonian of this system. The obtained results were compared with experimental data; a good agreement were demonstrated, which confirm the validity of the model and used method.

  6. Modeling aligning effect of polymer network in polymer stabilized nematic liquid crystals

    NASA Astrophysics Data System (ADS)

    Yang, Deng-Ke; Cui, Yue; Nemati, Hossein; Zhou, Xiaochen; Moheghi, Alireza

    2013-12-01

    We developed a phenomenological theory to describe the aligning field of polymer networks in polymer stabilized liquid crystals where sub-micron size polymer networks are phase separated from the liquid crystal in dispersion. The polymer networks are anisotropic and anchor the liquid crystals in their longitudinal direction. They inhibit the liquid crystals reorientation when external stimuli, such as electric field and temperature, are applied and reduce the relaxation time from distorted states. We model the effects produced by the polymer networks as an effective aligning field. We calculate the effective field as a function of the polymer network volume fraction and the lateral size of the network. The theory is compared with experimental results and good agreements were obtained. It is very useful in predicting how much polymer networks change the driving voltage and response time of liquid crystal devices.

  7. Convection patterns and temperature fields of ammonothermal GaN bulk crystal growth process

    NASA Astrophysics Data System (ADS)

    Masuda, Yoshio; Sato, Osamu; Tomida, Daisuke; Yokoyama, Chiaki

    2016-05-01

    The natural convection heat transfer in an ammonothermal process for growing GaN bulk single crystals has been examined numerically. We consider only one crystal to simplify the calculation and discuss the relationship between convection patterns and temperature fields. Two types of convection patterns are observed owing to the difference in the crystal radius. When the convection pattern is transformed, the crystal surface temperature decreases as the crystal radius increases.

  8. Photorefractive effect at 775 nm in doped lithium niobate crystals

    SciTech Connect

    Nava, G.; Minzioni, P.; Cristiani, I.; Degiorgio, V.; Argiolas, N.; Bazzan, M.; Ciampolillo, M. V.; Pozza, G.; Sada, C.

    2013-07-15

    The photorefractive effect induced by 775-nm laser light on doped lithium niobate crystals is investigated by the direct observation in the far field of the transmitted-beam distortion as a function of time. Measurements performed at various Zr-doping concentrations and different light intensities show that the 775-nm light beam induces a steady-state photorefractive effect comparable to that of 532-nm light, but the observed build-up time of the photovoltaic field is longer by three-orders of magnitude. The 775-nm photorefractivity of lithium niobate crystals doped with 3 mol. % ZrO{sub 2} or with 5.5 mol. % MgO is found to be negligible.

  9. Cyano-substituted oligo(p-phenylene vinylene) single-crystal with balanced hole and electron injection and transport for ambipolar field-effect transistors.

    PubMed

    Deng, Jian; Tang, Jia; Xu, Yuanxiang; Liu, Liqun; Wang, Yan; Xie, Zengqi; Ma, Yuguang

    2015-02-01

    High and balanced hole and electron mobilities were achieved in OFETs based on the high photoluminescence of a 1,4-bis(2-cyano-2-phenylethenyl)benzene single-crystal with symmetric electrodes. For electron and hole, the operation voltage in the OFETs based on symmetric gold electrodes was 30 and -20 V, respectively. The accumulation threshold voltage is low enough for the OFETs to operate in an ambipolar model with the source/drain voltage (Vds) around 50 V despite the high injection barrier. The highest electron and hole mobility was 0.745 cm(2) V(-1) s(-1) and 0.239 cm(2) V(-1) s(-1), and the current density reached 90.7 and 27.4 A cm(-2), respectively with an assumed 10 nm accumulation layer. The high mobility comes from the strong π-π interactions. In addition, the highly ordered hydrogen bonding matrix may create an efficient route to pump the charge to the inner layer which can improve the injection ability. PMID:25530541

  10. Holographic effective field theories

    NASA Astrophysics Data System (ADS)

    Martucci, Luca; Zaffaroni, Alberto

    2016-06-01

    We derive the four-dimensional low-energy effective field theory governing the moduli space of strongly coupled superconformal quiver gauge theories associated with D3-branes at Calabi-Yau conical singularities in the holographic regime of validity. We use the dual supergravity description provided by warped resolved conical geometries with mobile D3-branes. Information on the baryonic directions of the moduli space is also obtained by using wrapped Euclidean D3-branes. We illustrate our general results by discussing in detail their application to the Klebanov-Witten model.

  11. Density change effects on crystal growth from the melt

    NASA Astrophysics Data System (ADS)

    Conti, Massimo

    2001-11-01

    When a crystal grows from its undercooled melt the local density changes, driving a convective flow in the liquid phase. Then, the purely diffusional description of the process ceases to be satisfactory. Moreover, the dynamic pressure associated with the flow field may affect the melting temperature (and the effective undercooling) of the system. Both these effects have been addressed in recent experimental work. In the present study we derive a thermodynamically consistent phase-field model that accounts for the density change effects in the solidification of a pure substance. Starting from a thermodynamic potential that includes squared gradient terms for both the order parameter and the density, the field equations are derived assuming positive local entropy production. The model is numerically solved in one dimension to show deviations from the classic phase-field description of the same phenomenon.

  12. Accurate Full-Field Thermochromic Liquid Crystal Thermography for the Study of Instantaneous Turbulent Heat Transfer

    NASA Astrophysics Data System (ADS)

    Sabatino, D. R.; Praisner, T. J.; Smith, C. R.

    1998-11-01

    The color change of thermochromic liquid crystals with temperature can be effectively utilized as full-field surface temperature sensors to investigate the fundamental structure of wall turbulence. In order to accurately quantify turbulent heat transfer behavior, a new technique has been developed for the calibration of wide-band micro-encapsulated thermochromic liquid crystals. Lighting/viewing arrangements are described and evaluated for ease of implementation and accuracy of the displayed color. This new technique employs images recorded in-situ with the test surface systematically exposed to a series of uniform temperature conditions spanning the bandwidth of the liquid crystals. This sequence of images is used to generate point-wise color/temperature calibration curves for the entire surface. Experimental results will be presented illustrating the application of the technique for assessment of spatial/temporal surface heat transfer behavior due to selected turbulent flows in a water channel

  13. Effect of 6H-SiC crystal growth shapes on thermo-elastic stress in the growing crystal

    NASA Astrophysics Data System (ADS)

    Shi, Yong-gui; Dai, Pei-yun; Yang, Jian-feng; Jin, Zhi-hao; Liu, Hu-lin

    2012-07-01

    The effect of 6H-SiC crystal growth shapes on the thermo-elastic stress distribution in the growing crystal was systematically investigated by using a finite element method. The thermo-elastic stress distribution in the crystal with a flat growth shape was more homogeneous than that in the crystals with concave and convex growth shapes, and the value of thermo-elasticity in the crystal with a flat growth shape was also smaller than that in the two other types of crystals. The maximum values of thermo-elastic stress appeared at interfaces between the crystal and the graphite lid. If the lid was of the same properties as 6H-SiC, the thermo-elastic stress would decrease in two orders of magnitude. Thus, to grow 6H-SiC single crystals of high quality, a transition layer of SiC formed by deposition or reaction is suggested; meanwhile the thermal field in the growth chamber should be adjusted to maintain the crystals with flat growth shapes.

  14. Electric Field-Induced Skyrmion Crystals via Charged Monopoles in Insulating Helimagets

    NASA Astrophysics Data System (ADS)

    Watanabe, Haruki; Vishwanath, Ashvin

    2016-06-01

    Electrons propagating in a magnetically ordered medium experience an additional gauge field associated with the Berry phase of their spin following the local magnetic texture. In contrast to the usual electromagnetic field, this gauge field admits monopole excitations, corresponding to hedgehog defects of the magnetic order. In an insulator, these hedgehogs carry a well-defined electric charge allowing for them to be controlled by electric fields. One particularly robust mechanism that contributes to the charge is the orbital magnetoelectric effect, captured by a θ angle, which leads to a charge of eθ/2π on hedgehogs. This is a direct consequence of the Witten effect for magnetic monopoles in a θ medium. A physical consequence is that external electric fields can induce skyrmion crystal phases in insulating helimagnets.

  15. Microwave field effect transistor

    NASA Technical Reports Server (NTRS)

    Huang, Ho-Chung (Inventor)

    1989-01-01

    Electrodes of a high power, microwave field effect transistor are substantially matched to external input and output networks. The field effect transistor includes a metal ground plane layer, a dielectric layer on the ground plane layer, a gallium arsenide active region on the dielectric layer, and substantially coplanar spaced source, gate, and drain electrodes having active segments covering the active region. The active segment of the gate electrode is located between edges of the active segments of the source and drain electrodes. The gate and drain electrodes include inactive pads remote from the active segments. The pads are connected directly to the input and output networks. The source electrode is connected to the ground plane layer. The space between the electrodes and the geometry of the electrodes extablish parasitic shunt capacitances and series inductances that provide substantial matches between the input network and the gate electrode and between the output network and the drain electrode. Many of the devices are connected in parallel and share a common active region, so that each pair of adjacent devices shares the same source electrodes and each pair of adjacent devices shares the same drain electrodes. The gate electrodes for the parallel devices are formed by a continuous stripe that extends between adjacent devices and is connected at different points to the common gate pad.

  16. Light scattering from liquid crystal director fluctuations in steady magnetic fields up to 25 tesla

    NASA Astrophysics Data System (ADS)

    Challa, Pavan K.; Curtiss, O.; Williams, J. C.; Twieg, R.; Toth, J.; McGill, S.; Jákli, A.; Gleeson, J. T.; Sprunt, S. N.

    2012-07-01

    We report on homodyne dynamic light scattering measurements of orientational fluctuation modes in both calamitic and bent-core nematic liquid crystals, carried out in the new split-helix resistive magnet at the National High Magnetic Field Laboratory. The relaxation rate and inverse scattered intensity of director fluctuations exhibit a linear dependence on field-squared up to 25 tesla, which is consistent with strictly lowest order coupling of the tensor order parameter Q to field (QαβBαBβ) in the nematic free energy. However, we also observe evidence of field dependence of certain nematic material parameters, an effect which may be expected from the mean field scaling of these quantities with the magnitude of Q and the predicted variation of Q with field.

  17. Light scattering from liquid crystal director fluctuations in steady magnetic fields up to 25 tesla.

    PubMed

    Challa, Pavan K; Curtiss, O; Williams, J C; Twieg, R; Toth, J; McGill, S; Jákli, A; Gleeson, J T; Sprunt, S N

    2012-07-01

    We report on homodyne dynamic light scattering measurements of orientational fluctuation modes in both calamitic and bent-core nematic liquid crystals, carried out in the new split-helix resistive magnet at the National High Magnetic Field Laboratory. The relaxation rate and inverse scattered intensity of director fluctuations exhibit a linear dependence on field-squared up to 25 tesla, which is consistent with strictly lowest order coupling of the tensor order parameter Q to field (Q(αβ)B(α)B(β)) in the nematic free energy. However, we also observe evidence of field dependence of certain nematic material parameters, an effect which may be expected from the mean field scaling of these quantities with the magnitude of Q and the predicted variation of Q with field. PMID:23005438

  18. Magnetic-field tunable multichannel filter in a plasma photonic crystal at microwave frequencies.

    PubMed

    Chang, Tsung-Wen; Chien, Jia-Ren Chang; Wu, Chien-Jang

    2016-02-01

    The microwave magnetic-field tunable filtering properties in a multichannel filter based on use of a one-dimensional finite magnetized plasma photonic crystal (PPC) are theoretically investigated. The considered PPC has a structure of air/(AB)N/air, where A is a dielectric layer, B is a plasma layer, and N is the stack number. First, in the absence of an externally applied magnetic field, the structure can work as a multichannel filter whose channel number is equal to N-1 for N>1. Next, in the presence of an externally applied field, the filtering properties become tunable, i.e., the channel frequencies can be shifted as a function of the applied magnetic field. We find that the effect of the magnetic field will cause the channel frequencies to be blue-shifted or red-shifted depending on the orientation of the applied magnetic field. PMID:26836104

  19. Fiber optic dynamic electric field sensor based on nematic liquid crystal Fabry-Perot etalon

    NASA Astrophysics Data System (ADS)

    Ko, Myeong Ock; Kim, Sung-Jo; Kim, Jong-Hyun; Jeon, Min Yong

    2014-05-01

    We propose a fiber-optic dynamic electric field sensor using a nematic liquid crystal (NLC) Fabry-Perot etalon and a wavelength-swept laser. The transmission wavelength of the NLC Fabry-Perot etalon depends on the applied electric field intensity. The change in the effective refractive index of the NLC is measured while changing the applied electric field intensity. It decreases from 1.67 to 1.51 as the applied the electric field intensity is increased. Additionally, we successfully measure the dynamic variation of the electric field using the high-speed wavelength-swept laser. By measuring the modulation frequency of the transmission peaks in the temporal domain, the frequency of the modulated electric field can be estimated.

  20. Effect of dislocations on the acoustic properties of TGS crystals near the phase transition

    NASA Astrophysics Data System (ADS)

    Rakhimov, I.; Charnaia, E. V.; Shuvalov, L. A.; Shutilov, V. A.

    1985-09-01

    The effect of dislocations on the acoustic properties of triglycine sulfate (TGS) crystals is investigated experimentally near the phase transition during the imposition of a static external electric field. Results of the measurements of the temperature dependences of the sound velocity and of the ultrasonic absorption clearly show field-induced effects related to the presence of dislocations. The effect of dislocations on the acoustic properties of TGS is particularly pronounced in pure crystals containing a minimum number of point defects.

  1. Magnonic Hall effect and topological magnonic crystals (Presentation Recording)

    NASA Astrophysics Data System (ADS)

    Murakami, Shuichi

    2015-09-01

    In electronic systems it is well established that when there is a magnetic field or spontaneous magnetization, the Hall effect, and in some cases the quantum Hall effect appears. We theoretically pursue analogs of these phenomena in magnons (spin waves) and plasmons. In the case of magnons in ferromagnets, the Hall effect or quantum Hall effect requires some kind of a spin-orbit coupling (similar to electronic systems), and we show that the dipolar interaction, as well as the Dyaloshinskii-Moriya interaction, plays the role. By calculating the Berry curvature from the wavefunction, we can calculate thermal Hall effect for magnons in ferromagnets with dipolar interaction. We found that only the magnetostatic forward volume-wave mode exhibits the thermal Hall effect while the backward mode and the surface mode do not. In addition, by introducing some artificial spatial periodicity into the magnet, for example by fabricating nanostructures with two different magnets in a periodic structure or by making a periodic array of nanomagnets, we theoretically find appearance of quantum Hall effect in a certain range of the magnetic field. There appear chiral edge states which propagate along the edge of the magnet in one way. We call this a topological magnonic crystal. In the plasmon case, we should begin with constructing a fundamental band theory, and we theoretically show that on a metal surface with corrugations forming a triangular lattice under the magnetic field, the quantum Hall effect appears. It can be called a topological plasmonic crystal.

  2. Angular effects on thermochromic liquid crystal thermography

    NASA Astrophysics Data System (ADS)

    Kodzwa, Paul M.; Eaton, John K.

    2007-12-01

    This paper directly discusses the effects of lighting and viewing angles on liquid crystal thermography. This is because although thermochromic liquid crystals (TLCs) are a widely-used and accepted tool in heat transfer research, little effort has been directed to analytically describing these effects. Such insight is invaluable for the development of effective mitigation strategies. Using analytical relationships that describe the perceived color shift, a systematic manner of improving the performance of a TLC system is presented. This is particularly relevant for applications where significant variations in lighting and/or viewing angles are expected (such as a highly curved surface). This discussion includes an examination of the importance of the definition of the hue angle used to calibrate the color of a TLC-painted surface. The theoretical basis of the validated high-accuracy calibration approach reported by Kodzwa et al. (Exp Fluids s00348-007-0310-6, 2007) is presented.

  3. Hyperspectral optical near-field imaging: Looking graded photonic crystals and photonic metamaterials in color

    NASA Astrophysics Data System (ADS)

    Dellinger, Jean; Van Do, K.; Le Roux, Xavier; de Fornel, Frédérique; Cassan, Eric; Cluzel, Benoît

    2012-10-01

    Using a scanning near-field optical microscope operating with a hyperspectral detection scheme, we report the direct observation of the mirage effect within an on-chip integrated artificial material made of a two dimensional graded photonic crystal. The light rainbow due to the material dispersion is quantified experimentally and quantitatively compared to three dimensional plane wave assisted Hamiltonian optics predictions of light propagation.

  4. Dislocation dynamics, plasticity and avalanche statistics using the phase-field crystal model

    NASA Astrophysics Data System (ADS)

    Angheluta, Luiza

    2013-03-01

    The plastic deformation of stressed crystalline materials is characterized by intermittency and scaling behavior. The sudden strain bursts arise from collective interactions between depinned crystal defects such as dislocations. Recent experiments on sheared nanocrystals provide insights into the connection between the crystal plasticity and the mean field theory of the depinning transition, based on the similar power-law statistics of avalanche events. However, a complete theoretical formulation of this connection is still lacking, as are high quality numerical data. Phase field crystal modelling provides an efficient numerical approach to simulating the dynamics of dislocations in plastic flows at finite temperature. Dislocations are naturally created as defects in a periodic ground state that is being sheared, without any ad hoc creation and annihilation rules. These crystal defects interact and annihilate with one another, generating a collective effect of avalanches in the global plastic strain rate. We examine the statistics of plastic avalanches both at finite and zero temperatures, and find good agreement with the predictions of the mean field interface depinning theory. Moreover, we predict universal scaling forms for the extreme statistics of avalanches and universal relations between the power-law exponents of avalanche duration, size and extreme value. These results account for the observed power-law distribution of the maximum amplitudes in acoustic emission experiments of crystal plasticity, but are also broadly applicable to other systems in the mean-field interface depinning universality class, ranging from magnets to earthquakes. The work reported here was performed in collaboration with: Georgios Tsekenis, Michael LeBlanc, Patrick Y Chan, Jon Dantzig, Karin Dahmen, and Nigel Goldenfeld. The work was supported by the Center for Physics of Geological Processes (Norway) through a post-doctoral grant, the National Science Foundation through grant NSF

  5. Effects of electric field on acoustic properties of 0.83Pb(Mg1/3Nb2/3) -0.17PbTiO3 single crystals studied by Brillouin light scattering

    NASA Astrophysics Data System (ADS)

    Kim, Tae Hyun; Ko, Jae-Hyeon; Kojima, Seiji

    2013-03-01

    Relaxor-based ferroelectric Pb[(Mg1/3Nb2/3)1-x Tix]O3 (PMN-xPT) single crystals have attracted great attention because of their exceptionally strong piezoelectric properties. This peculiar characteristic was attributed to the rotation of polarization directions and structural complexity. In this study, the phase transition behaviors of PMN-17PT single crystals have been investigated under an electric field applied along [001] by micro-Brillouin scattering. PMN-17PT single crystals were grown by the modified Bridgeman method. The two (001) surfaces were Au-coated to apply the electric field, and the coating was thin enough to allow the incident beam to transmit without much loss. The electric field of different values was applied to the sample along the [001] direction, and the Brillouin scattering spectrum was measured under both field-heating (FH) and field-cooling (FC) conditions. The electric field of 1kV/cm induced a new longitudinal acoustic (LA) mode component along with a broad Brillouin peak evolving continuously from the paraelectric phase during both FC and FH processes. This was attributed to the remnant polar nanoregions that were not aligned under the electric field due to quenched random fields. However, the splitting of the LA mode did not appear when the electric field was over 2kV/cm indicating a clear structural phase transition. This research was supported in part by the Marubun Research Promotion Foundation and Basic Science Research Program through the National Research Foundation of Korea (NRF) funded by the Ministry of Education, Science and Technology (2010-0010497).

  6. Electric field effect of relaxor ferroelectric (1 ‑ x)Pb(Mg1/3Nb2/3)O3–xPbTiO3 crystals near morphotropic phase boundary composition probed by Brillouin scattering

    NASA Astrophysics Data System (ADS)

    Aftabuzzaman, Md; Kojima, Seiji

    2016-07-01

    The relaxor ferroelectric (1 ‑ x)Pb(Mg1/3Nb2/3)O3–xPbTiO3 (x = 0.30, PMN–30PT) single crystal was studied under the zero field and the externally applied dc electric field by using micro-Brillouin scattering and dielectric spectroscopies over a wide temperature range of 303–773 K. The noticeable thermal hysteresis of longitudinal acoustic (LA) shift (νB) was observed between zero field heating and zero field cooling processes. Under the electric field of 0.5 kV/cm along the [001] axis, the LA mode splitting was observed in νB due to the coexistence of ferroelectric macrodomain and nanodomain states caused by the random field, and in dielectric measurements the monoclinic (M) and tetragonal phases were appeared between rhombohedral and cubic phases. The LA mode splitting and M phase disappeared under the field of 1.0 kV/cm. The electric field dependence of LA velocity was studied at 304 K. The critical end point of the PMN–30PT single crystal was investigated.

  7. Rheology of Pure Glasses and Crystal Bearing Melts: from the Newtonian Field to the Brittle Onset

    NASA Astrophysics Data System (ADS)

    Cordonnier, B.; Caricchi, L.; Pistone, M.; Castro, J. M.; Hess, K.; Dingwell, D. B.

    2010-12-01

    The brittle-ductile transition remains a central question of modern geology. If rocks can be perceived as a granular flow on geological time-scale, their behavior is brittle in dynamic areas. Understanding rock failure conditions is the main parameter in mitigating geological risks, more specifically the eruptive style transitions from effusive to explosive. If numerical simulations are the only way to fully understanding the physical processes involved, we are in a strong need of an experimental validation of the proposed models. here we present results obtained under torsion and uni-axial compression on both pure glasses and crystal bearing melts. We characterized the brittle onset of two phases magmas from 0 to 65% crystals. The strain-rates span a 5 orders magnitude range, from the Newtonian flow to the Brittle field (10-5 - 100 s-1). We particularly emphasize the time dependency of the measured rheology. The materials tested are a borosilicate glass from the National Bureau of Standards, a natural sample from Mt Unzen volcano and a synthetic sample. The lattest is an HPG8 melt with 7% sodium mole excess. The particles are quasi-isometric corundum crystalschosen for their shape and integrity under the stress range investigated. The crystal fraction ranges from 0 to 0.65. Concerning pure magmas, we recently demonstrated that the material passes from a Newtonian to a non-Nemtonian behavior with increasing strain-rate. This onset can mostly be explained by viscous-heating effects. However, for even greater strain-rates, the material cracks and finally fail. The brittle onset is here explained with the visco-elastic theory and corresponds to a Deborah number greater than 10-2. Concerning crystal bearing melts the departure from the Newtonian state is characterized by two effects: a shear-thinning and a time weakening effect. The first one is instantaneous and loading-unloading cyclic tests suggest an elastic contribution of the crystal network. The second one

  8. Crystal-field levels in UBr 3 determined by neutron spectroscopy

    NASA Astrophysics Data System (ADS)

    Murasik, A.; Furrer, A.; Szczepaniak, W.

    1980-03-01

    Inelastic neutron scattering experiments have been performed in UBr 3 in order to determine the crystal-field levels. Four transitions between the ground state and all excited states have been observed, thus the crystal-field level scheme could be unambigously assigned. The Russell-Saunders coupling scheme has been used to derive the crystal-field parameters which cannot be accounted for by a simple point charge calculation.

  9. Inelastic neutron scattering investigation of crystal-field splittings in UBr 3

    NASA Astrophysics Data System (ADS)

    Murasik, A.; Furrer, A.

    1980-10-01

    An inelastic neutron scattering technique was used to measure the crystal-field splittings in UBr 3 at various temperatures and momentum transfers. In the interpretation of the observed energy spectra it turns out that the Russell-Saunders coupling scheme is a reasonable approximation. The crystal-field level scheme could be unambiguously assigned. The detailed nature of the crystal-field transition from the ground state to the first-excited state is not yet fully understood.

  10. Peak effect phenomena, surface superconductivity and paramagnetic Meissner effect in a spherical single crystal of niobium

    NASA Astrophysics Data System (ADS)

    Das, Pradip; Tomy, C. V.; Takeya, H.; Ramakrishnan, S.; Grover, A. K.

    2009-03-01

    We have explored the vortex phase diagram in a spherical single crystal of niobium (Tc ~ 9.3 K) via isothermal and temperature dependent dc magnetization and ac-susceptibility measurements. The crystal has extremely weak pinning that can be inferred from the reversibility of M - H loops below Tc. However, one can visualize the peak effect (PE) feature in the isothermal M - H loops up to T = 8 K. The PE is also prominent in isothermal ac-susceptibility data for H > 750 Oe. An interesting observation in the present study is the prominent fingerprints of surface superconductivity, starting just above the collapse of pinning at the peak position of the PE and ending at the surface critical field (Hc3). We have also observed the paramagnetic Meissner effect in field-cooled magnetization data recorded at relatively large fields in this crystal. A vortex phase diagram is constructed by marking the peak positions of the PE (Hp), the upper critical field (Hc2) and the surface critical field (Hc3). Unlike a previous report which shows the existence of a multi-critical point in the phase diagram of a Nb crystal, where Hp, Hc2 and Hc3 lines meet, we do not observe a multi-critical point in our weak pinning crystal.

  11. Polymorphism, crystal nucleation and growth in the phase-field crystal model in 2D and 3D.

    PubMed

    Tóth, Gyula I; Tegze, György; Pusztai, Tamás; Tóth, Gergely; Gránásy, László

    2010-09-15

    We apply a simple dynamical density functional theory, the phase-field crystal (PFC) model of overdamped conservative dynamics, to address polymorphism, crystal nucleation, and crystal growth in the diffusion-controlled limit. We refine the phase diagram for 3D, and determine the line free energy in 2D and the height of the nucleation barrier in 2D and 3D for homogeneous and heterogeneous nucleation by solving the respective Euler-Lagrange (EL) equations. We demonstrate that, in the PFC model, the body-centered cubic (bcc), the face-centered cubic (fcc), and the hexagonal close-packed structures (hcp) compete, while the simple cubic structure is unstable, and that phase preference can be tuned by changing the model parameters: close to the critical point the bcc structure is stable, while far from the critical point the fcc prevails, with an hcp stability domain in between. We note that with increasing distance from the critical point the equilibrium shapes vary from the sphere to specific faceted shapes: rhombic dodecahedron (bcc), truncated octahedron (fcc), and hexagonal prism (hcp). Solving the equation of motion of the PFC model supplied with conserved noise, solidification starts with the nucleation of an amorphous precursor phase, into which the stable crystalline phase nucleates. The growth rate is found to be time dependent and anisotropic; this anisotropy depends on the driving force. We show that due to the diffusion-controlled growth mechanism, which is especially relevant for crystal aggregation in colloidal systems, dendritic growth structures evolve in large-scale isothermal single-component PFC simulations. An oscillatory effective pair potential resembling those for model glass formers has been evaluated from structural data of the amorphous phase obtained by instantaneous quenching. Finally, we present results for eutectic solidification in a binary PFC model. PMID:21386517

  12. Polymorphism, crystal nucleation and growth in the phase-field crystal model in 2D and 3D

    NASA Astrophysics Data System (ADS)

    Tóth, Gyula I.; Tegze, György; Pusztai, Tamás; Tóth, Gergely; Gránásy, László

    2010-09-01

    We apply a simple dynamical density functional theory, the phase-field crystal (PFC) model of overdamped conservative dynamics, to address polymorphism, crystal nucleation, and crystal growth in the diffusion-controlled limit. We refine the phase diagram for 3D, and determine the line free energy in 2D and the height of the nucleation barrier in 2D and 3D for homogeneous and heterogeneous nucleation by solving the respective Euler-Lagrange (EL) equations. We demonstrate that, in the PFC model, the body-centered cubic (bcc), the face-centered cubic (fcc), and the hexagonal close-packed structures (hcp) compete, while the simple cubic structure is unstable, and that phase preference can be tuned by changing the model parameters: close to the critical point the bcc structure is stable, while far from the critical point the fcc prevails, with an hcp stability domain in between. We note that with increasing distance from the critical point the equilibrium shapes vary from the sphere to specific faceted shapes: rhombic dodecahedron (bcc), truncated octahedron (fcc), and hexagonal prism (hcp). Solving the equation of motion of the PFC model supplied with conserved noise, solidification starts with the nucleation of an amorphous precursor phase, into which the stable crystalline phase nucleates. The growth rate is found to be time dependent and anisotropic; this anisotropy depends on the driving force. We show that due to the diffusion-controlled growth mechanism, which is especially relevant for crystal aggregation in colloidal systems, dendritic growth structures evolve in large-scale isothermal single-component PFC simulations. An oscillatory effective pair potential resembling those for model glass formers has been evaluated from structural data of the amorphous phase obtained by instantaneous quenching. Finally, we present results for eutectic solidification in a binary PFC model.

  13. Study of Effects of Gravity on Crystallization

    NASA Technical Reports Server (NTRS)

    Smith, Guy A.; Workman, Gary L.; OBrian, Susan

    1996-01-01

    The effect of gravity on the crystallization behavior of fluoride fibers is being investigated by performing fiber annealing experiments on NASA's KC-135 using commercial grade fibers donated by industrial partners. The successful observations of reduced formation of microcrystallites in reduced gravity of the parabolic flights will be repeated to confirm earlier results. The design and implementation of an automated sting assembly for use in space fiber drawing experiments will also be emphasized in this study.

  14. High-resolution X-ray absorption spectroscopy as a probe of crystal-field and covalency effects in actinide compounds.

    PubMed

    Butorin, Sergei M; Kvashnina, Kristina O; Vegelius, Johan R; Meyer, Daniel; Shuh, David K

    2016-07-19

    Applying the high-energy resolution fluorescence-detection (HERFD) mode of X-ray absorption spectroscopy (XAS), we were able to probe, for the first time to our knowledge, the crystalline electric field (CEF) splittings of the [Formula: see text] shell directly in the HERFD-XAS spectra of actinides. Using ThO2 as an example, data measured at the Th 3d edge were interpreted within the framework of the Anderson impurity model. Because the charge-transfer satellites were also resolved in the HERFD-XAS spectra, the analysis of these satellites revealed that ThO2 is not an ionic compound as previously believed. The Th [Formula: see text] occupancy in the ground state was estimated to be twice that of the Th [Formula: see text] states. We demonstrate that HERFD-XAS allows for characterization of the CEF interaction and degree of covalency in the ground state of actinide compounds as it is extensively done for 3d transition metal systems. PMID:27370799

  15. Spectral and polarization structure of field-induced photonic bands in cholesteric liquid crystals

    NASA Astrophysics Data System (ADS)

    Palto, S. P.; Barnik, M. I.; Geivandov, A. R.; Kasyanova, I. V.; Palto, V. S.

    2015-09-01

    Transmission of planar layers of cholesteric liquid crystals is studied in pulsed electric fields perpendicular to the helix axis at normal incidence of both linearly polarized and unpolarized light. Spectral and light polarization properties of the primary photonic band and the field-induced bands up to fourth order of Bragg selective reflection are studied in detail. In our experiments we have achieved an electric field strength several times higher than the theoretical values corresponding to the critical field of full helix unwinding. However, the experiments show that despite the high strength of the electric field applied the helix does not unwind, but strongly deforms, keeping its initial spatial period. Strong helix deformation results in distinct spectral band splitting, as well as very high field-induced selective reflectance that can be applied in lasers and other optoelectronic devices. Peculiarities of inducing and splitting the bands are discussed in terms of the scattering coefficient approach. All observed effects are confirmed by numerical simulations. The simulations also show that liquid crystal surface anchoring is not the factor that prevents the helix unwinding. Thus, the currently acknowledged concept of continuous helix unwinding in the electric field should be reconsidered.

  16. Imprint electric field controlled electronic transport in TlGaSe2 crystals

    NASA Astrophysics Data System (ADS)

    Seyidov, MirHasan Yu; Suleymanov, Rauf A.; Balaban, Ertan; Şale, Yasin

    2013-09-01

    The effect of built-in electric field onto the dc electrical conductivity, photoconductivity, and electrical switching phenomenon were investigated in TlGaSe2 layered semiconductor within the temperature range of 77-300 K. We have used different types of electrodes for different TlGaSe2 samples in both parallel and perpendicular directions to the plane of layers. The effect of electric field was investigated by cooling the samples from the room temperature under the electric field and then removing it at ˜80 K. After the procedure, it was found that a built-in internal electric field which strongly affects transport properties appears in TlGaSe2 crystals. Substantial increasing of both dark currents and photo-conductivities were observed predominantly at low temperatures, where hopping was the main conductivity mechanism. The anomalous decrease of the activation energy in the low temperature region and the switching effect are also the main experimental findings of the present work. Such behavior can be understood by assuming that the built-in electric field greatly increases the contribution of the hopping conductivity at low temperatures. Obtained results are discussed on the basis of the models widely used for disordered semiconductors. It was shown that TlGaSe2 crystal demonstrates the peculiar behavior that is typical to such type of semiconductors.

  17. Optical electric-field sensor based on angular optical bias using single β-BaB2O4 crystal.

    PubMed

    Li, Changsheng; Shen, Xiaoli; Zeng, Rong

    2013-11-01

    A novel optical electric-field sensor is proposed and demonstrated in experiment by use of a single beta barium borate (β-BaB2O4, BBO) crystal. The optical sensing unit is only composed of one BBO crystal and two polarizers. An optical phase bias of 0.5π is provided by using natural birefringence in the BBO crystal itself. A small angle (e.g., 0.6°) between the sensing light beam and principal axis of the crystal is required in order to produce the above optical bias. Thus the BBO crystal is used as the electric-field-sensing element and quarter waveplate. The ac electric field in the range of (1.4-703.2) kV/m has been measured with measurement sensitivity of 1.39 mV/(kV/m) and nonlinear error of 0.6%. Compared with lithium niobate crystal used as an electric-field sensor, main advantages of the BBO crystal include higher measurement sensitivity, compact configuration, and no ferroelectric ringing effect. PMID:24216661

  18. Glassy phases and driven response of the phase-field-crystal model with random pinning.

    PubMed

    Granato, E; Ramos, J A P; Achim, C V; Lehikoinen, J; Ying, S C; Ala-Nissila, T; Elder, K R

    2011-09-01

    We study the structural correlations and the nonlinear response to a driving force of a two-dimensional phase-field-crystal model with random pinning. The model provides an effective continuous description of lattice systems in the presence of disordered external pinning centers, allowing for both elastic and plastic deformations. We find that the phase-field crystal with disorder assumes an amorphous glassy ground state, with only short-ranged positional and orientational correlations, even in the limit of weak disorder. Under increasing driving force, the pinned amorphous-glass phase evolves into a moving plastic-flow phase and then, finally, a moving smectic phase. The transverse response of the moving smectic phase shows a vanishing transverse critical force for increasing system sizes. PMID:22060323

  19. Phase field crystal study of nano-crack growth and branch in materials

    NASA Astrophysics Data System (ADS)

    Yingjun, Gao; Zhirong, Luo; Lilin, Huang; Hong, Mao; Chuanggao, Huang; Kui, Lin

    2016-06-01

    The phase field crystal (PFC) method is a new multiscale method, which can reproduce physical phenomena on an atomic level and on a diffusion time scale for the microstructure evolution of materials. The morphology of microcrack propagation and the branch of single crystal materials under tensile strain with a fixed grip condition are simulated by using PFC coupling with an external field method. The results show that microcrack propagation depends a lot on the applied strain. The crack starts to grow and branch when the strain reaches a critical value for biaxial tension. The temperature parameter may also have an effect on crack propagation and the branch. In order to indicate the connection between the PFC results and materials behavior, the energy balance approach is used to analyze the mechanism of crack extension, and also the critical value of the strain for crack extension is obtained. The simulated results are in good agreement with other simulation results and experimental results.

  20. Interfacial free energy adjustable phase field crystal model for homogeneous nucleation.

    PubMed

    Guo, Can; Wang, Jincheng; Wang, Zhijun; Li, Junjie; Guo, Yaolin; Huang, Yunhao

    2016-05-18

    To describe the homogeneous nucleation process, an interfacial free energy adjustable phase-field crystal model (IPFC) was proposed by reconstructing the energy functional of the original phase field crystal (PFC) methodology. Compared with the original PFC model, the additional interface term in the IPFC model effectively can adjust the magnitude of the interfacial free energy, but does not affect the equilibrium phase diagram and the interfacial energy anisotropy. The IPFC model overcame the limitation that the interfacial free energy of the original PFC model is much less than the theoretical results. Using the IPFC model, we investigated some basic issues in homogeneous nucleation. From the viewpoint of simulation, we proceeded with an in situ observation of the process of cluster fluctuation and obtained quite similar snapshots to colloidal crystallization experiments. We also counted the size distribution of crystal-like clusters and the nucleation rate. Our simulations show that the size distribution is independent of the evolution time, and the nucleation rate remains constant after a period of relaxation, which are consistent with experimental observations. The linear relation between logarithmic nucleation rate and reciprocal driving force also conforms to the steady state nucleation theory. PMID:27117814

  1. Faraday isolator based on a TSAG single crystal with compensation of thermally induced depolarization inside magnetic field

    NASA Astrophysics Data System (ADS)

    Snetkov, Ilya; Palashov, Oleg

    2015-04-01

    A Faraday isolator based on a terbium scandium aluminum garnet (TSAG) single crystal with compensation of thermally induced depolarization inside magnetic field was demonstrated. An isolation ratio of 32 dB at 350 W cw laser radiation power was achieved. Thermally induced depolarization and thermal lens were studied and compared with similar thermal effects arising in the widely used terbium gallium garnet crystal (TGG) for the first time.

  2. Change in the microhardness of nonmagnetic crystals after their exposure to the Earth's magnetic field and AC pump field in the EPR scheme

    NASA Astrophysics Data System (ADS)

    Alshits, V. I.; Darinskaya, E. V.; Koldaeva, M. V.; Petrzhik, E. A.

    2012-02-01

    Changes in the microhardness of ZnO, triglycine sulfate (TGS), and potassium acid phthalate (KAP) crystals after their exposure to crossed ultralow magnetic fields, i.e., the Earth's field B Earth ≈ 50 μT and the alternating-current field tilde B ≈ 3 μ T orthogonal to it, have been revealed. In ZnO crystals, the microhardness increases, whereas in TGS and KAP, it decreases. A maximum change (10-15%) is reached within 1-3 h after magnetic treatment; then, the microhardness gradually recovers to its initial value for the first day. After a sufficient pause, the effect is completely reproduced under the same conditions. The resonant frequency of the pump field tilde B corresponds to the EPR condition with a g-factor close to two. The magnetic memory exhibits a strong anisotropy: for each of the crystals, a direction is found, which, being coincident with the Earth's magnetic field vector B Earth, causes complete or partial suppression of the effect. In ZnO and TGS crystals, these are symmetry axes 6 and 2, respectively. In the KAP crystal, it is the direction in the cleavage plane orthogonal the 2 axis. Possible physical mechanisms of the observed phenomena have been discussed.

  3. Electric-field-assisted position and orientation control of organic single crystals.

    PubMed

    Kotsuki, Kenji; Obata, Seiji; Saiki, Koichiro

    2014-12-01

    We have investigated the motion of growing pentacene single crystals in solution under various electric fields. The pentacene single crystals in 1,2,4-trichlorobenzene responded to the electric field as if they were positively charged. By optimizing the strength and frequency of an alternating electric field, the pentacene crystals automatically bridged the electrodes on SiO2. The pentacene crystal with a large aspect ratio tended to direct the [1̅10] orientation parallel to the conduction direction, which will be suitable from a viewpoint of anisotropy in mobility. The present result shows a possibility of controlling the position and orientation of organic single crystals by the use of an electric field, which leads to high throughput and low cost industrial manufacturing of the single crystal array from solution. PMID:25360544

  4. Fabrication of Crystals and Devices for Studies of Field Induced Superconductivity

    NASA Astrophysics Data System (ADS)

    Kloc, Christian

    2002-03-01

    It was demonstrated that injection of electrons or holes into materials using field effect transistor can transform the surface layer into a metal or at low enough temperatures even into a superconductor. Which substances could exhibit electric field induced superconductivity is currently not well know. Superconductivity has been successfully induced in single crystals of arenes, (pentacene Tc = 2 K, tetracene Tc = 2.7K, anthracene Tc = 4 K) oligophenylenevinylenes (trimer Tc =4.2K , tetramer Tc=2.9 K and pentamer, Tc= 2 K) sexithiophene, polymer thin film (regioregular polythiophene, Tc = 2.35 K) and single crystals of pure and intercalated fullerenes (hole and electron doped C60 Tc = 52 and 11K, C70, Tc = 7K and substituted C60, Tc = up to 117 K). Additional, Schon et al. have reported the observation of field induced superconductivity in copper oxide compounds. Despite of relative simple device structures, they consist of semiconducting single crystals or well oriented thin films, metal source and drain electrodes, an aluminum oxide dielectric layer and a conducting gate electrode, the fabrication is onerous and the significance of particular technological steps to functionality of a whole device is not well explored. In this presentation I would like to discuss these technological procedures leading to superconducting devices and further developments in search for high temperature superconducting organics.

  5. Determination of forced convection parameters by interferometric imaging of the concentration field during growth of KDP crystals

    NASA Astrophysics Data System (ADS)

    Verma, Sunil; Muralidhar, K.

    2011-07-01

    Growth of a potassium dihydrogen phosphate (KDP) crystal from its aqueous solution has been considered under forced convection conditions. The KDP crystal is grown in a conventional top hanging geometry. Forced convection conditions are created by rotating the crystal about a vertical axis. The rotational RPM is varied in a cycle, creating an accelerated rotation (AR) paradigm. The effect of varying the rotational RPM on the concentration field around the crystal was investigated. Mach-Zehnder interferometry was adopted as an optical technique to image the evolving concentration fields. Six different experiments were performed to obtain the specific set of time periods and rotation rates of the acceleration cycle that result in a uniform concentration field around the growing crystal. The Reynolds number, an index of the strength of forced convection, was optimized through the experiments. The optimized parameters of the accelerated rotation cycle were found to be as follows: maximum rotation rate of 32 RPM, spin up period=40 s, spin down period=40 s, steady period=40 s, and stationary period=40 s. The parametric study further revealed that concentration was highly sensitive to the maximum rotation rate adopted during the AR cycle. It did not depend crucially on the time periods that could be varied by as much as ±25% around the respective average values. Finally, a KDP crystal was grown using the optimized forced convection parameters and the crystal quality was found to be good.

  6. A three-dimensional phase field model coupled with lattice kinetics solver for modeling crystal growth in furnaces with accelerated crucible rotation and traveling magnetic field

    SciTech Connect

    Lin, Guang; Bao, Jie; Xu, Zhijie

    2014-11-01

    In this study, which builds on other related work, we present a new three-dimensional numerical model for crystal growth in a vertical solidification system. This model accounts for buoyancy, accelerated crucible rotation technique (ACRT), and traveling magnetic field (TMF) induced convective flow and their effect on crystal growth and the chemical component's transport process. The evolution of the crystal growth interface is simulated using the phase field method. A semi-implicit lattice kinetics solver based on the Boltzmann equation is employed to model the unsteady incompressible flow. A one-way coupled concentration transport model is used to simulate the component fraction variation in both the liquid and solid phases, which can be used to check the quality of the crystal growth.

  7. Crystal-field calculations for transition-metal ions by application of an opposing potential

    DOE PAGESBeta

    Zhou, Fei; Aberg, Daniel

    2016-02-16

    We propose a fully ab initio method, the opposing crystal potential (OCP), to calculate the crystal-field parameters of transition-metal impurities in insulator hosts. Through constrained density functional calculations, OCP obtains the constraining Lagrange multipliers, which act as a cancellation potential against the crystal field and lead to spherical d-electron distribution. Furthermore, the method is applied to several insulators doped with Mn4+ and Mn2+ ions and shown to be in good agreement with experiment.

  8. Superconducting Field-Effect Transistors

    NASA Technical Reports Server (NTRS)

    Bhasin, Kul; Romanofsky, Robert R.; Tabib-Azar, Massood

    1995-01-01

    Devices offer switching speeds greater than semiconducting counterparts. High-Tc superconducting field-effect transistors (SUPEFETs) investigated for use as electronic switches in delay-line-type microwave phase shifters. Resemble semiconductor field-effect transistors in some respects, but their operation based on different principle; namely, electric-field control of transition between superconductivity and normal conductivity.

  9. Synthesis and superconducting properties of FeTe1-xSe Single Crystals under high magnetic fields

    NASA Astrophysics Data System (ADS)

    Gebre, Tesfaye; Li, G.; Whalen, J.; Conner, B.; Kostov, M.; Siegrist, T.; Balicas, L.

    2011-03-01

    Single crystals of superconductor FeTe 1-x Se x (0.1 <= x <= 0.5) were synthesized using optical floating zone, Bridgeman technique, and solid stat reaction. The samples were synthesized under various temperature gradients and cooling rates. Crystals were characterized via EDX, X-ray scattering, magnetization and transport measurements. Upper critical fields Hc 2 as estimated through the Werthamer-Hohenberg-Helfand (WHH) formalism indicate that these materials strongly surpass the weak coupling Pauli limiting field indicating that the shape of their phase diagram under field is essentially controlled by the Pauli effect. Annealing, leads to a metallic temperature dependence of the resistivity, and to sharper superconducting transitions. Despite the relatively small increase in single crystallinity, as quantified by single crystal x-ray diffraction measurements, we observe a different phase diagram under high magnetic fields when compared to non-annealed samples.

  10. Tunable Lamb wave band gaps in two-dimensional magnetoelastic phononic crystal slabs by an applied external magnetostatic field.

    PubMed

    Zhou, Changjiang; Sai, Yi; Chen, Jiujiu

    2016-09-01

    This paper theoretically investigates the band gaps of Lamb mode waves in two-dimensional magnetoelastic phononic crystal slabs by an applied external magnetostatic field. With the assumption of uniformly oriented magnetization, an equivalent piezomagnetic material model is used. The effects of magnetostatic field on phononic crystals are considered carefully in this model. The numerical results indicate that the width of the first band gap is significantly changed by applying the external magnetic field with different amplitude, and the ratio between the maximum and minimum gap widths reaches 228%. Further calculations demonstrate that the orientation of the magnetic field obviously affects the width and location of the first band gap. The contactless tunability of the proposed phononic crystal slabs shows many potential applications of vibration isolation in engineering. PMID:27281285

  11. Magnetic Field Tunable Small-scale Mechanical Properties of Nickel Single Crystals Measured by Nanoindentation Technique

    PubMed Central

    Zhou, Hao; Pei, Yongmao; Fang, Daining

    2014-01-01

    Nano- and micromagnetic materials have been extensively employed in micro-functional devices. However, measuring small-scale mechanical and magnetomechanical properties is challenging, which restricts the design of new products and the performance of smart devices. A new magnetomechanical nanoindentation technique is developed and tested on a nickel single crystal in the absence and presence of a saturated magnetic field. Small-scale parameters such as Young's modulus, indentation hardness, and plastic index are dependent on the applied magnetic field, which differ greatly from their macroscale counterparts. Possible mechanisms that induced 31% increase in modulus and 7% reduction in hardness (i.e., the flexomagnetic effect and the interaction between dislocations and magnetic field, respectively) are analyzed and discussed. Results could be useful in the microminiaturization of applications, such as tunable mechanical resonators and magnetic field sensors. PMID:24695002

  12. Crystal-field transitions in f-electron oxides

    NASA Astrophysics Data System (ADS)

    Kern, S.; Loong, C.-K.; Lander, G. H.

    1985-09-01

    Neutron inelastic scattering has been used to measure for the first time the ground- to excited-state crystal-field transitions in PrO2 (130 meV), BaPrO3 (255 meV), and UO2 (~160 meV). Details of these neutron experiments using the epithermal neutrons from the Argonne National Laboratory spallation source are given. From the observed transitions the following values of V4=A4 are deduced: PrO2 (-66 meV), BaPrO3 (119 meV), and UO2 (-385 meV). Comparisons are made with V4 values deduced for metallic systems and those determined by optical techniques for dilute lanthanides in transparent hosts. In the case of UO2, two peaks are seen, one at 155 meV and the other at 172 meV. This structure exists both below and above the Néel temperature TN (30.8 K) and is discussed in terms of mechanisms that might exist in UO2. Several further neutron experiments are suggested now that energy transfers above ~100 meV may be measured at small (i.e., <~5 Å-1) values of the momentum transfer.

  13. Molecular simulation of model liquid crystals in a strong aligning field

    NASA Astrophysics Data System (ADS)

    de Miguel, Enrique; Blas, Felipe J.; Martín Del Río, Elvira

    We report a computer simulation study of systems of perfectly aligned molecules interacting through the Gay-Berne (GB) potential model for two different values of the molecular anisotropy parameter κ, namely 3 and 4.4. The models are appropriate to gauge the effects of strong aligning fields on the thermodynamics and structural properties of thermotropic liquid crystals. According to our results, one of the main effects of the external field is to increase the range of stability of the smectic A phase, which indicates the existence of a strong coupling between orientational and translational order. For the κ = 3 GB model the smectic phase, which is not stable in the absence of the field, is promoted when the molecules are constrained to be parallel. According to the simulation results, the smectic A-nematic transition is, in general, continuous; however, this transition appears to be first order at low pressure for the κ = 4.4 GB fluid model.

  14. Electric Field Effects in RUS Measurements

    SciTech Connect

    Darling, Timothy W; Ten Cate, James A; Allured, Bradley; Carpenter, Michael A

    2009-09-21

    Much of the power of the Resonant Ultrasound Spectroscopy (RUS) technique is the ability to make mechanical resonance measurements while the environment of the sample is changed. Temperature and magnetic field are important examples. Due to the common use of piezoelectric transducers near the sample, applied electric fields introduce complications, but many materials have technologically interesting responses to applied static and RF electric fields. Non-contact optical, buffered, or shielded transducers permit the application of charge and externally applied electric fields while making RUS measurements. For conducting samples, in vacuum, charging produces a small negative pressure in the volume of the material - a state rarely explored. At very high charges we influence the electron density near the surface so the propagation of surface waves and their resonances may give us a handle on the relationship of electron density to bond strength and elasticity. Our preliminary results indicate a charge sign dependent effect, but we are studying a number of possible other effects induced by charging. In dielectric materials, external electric fields influence the strain response, particularly in ferroelectrics. Experiments to study this connection at phase transformations are planned. The fact that many geological samples contain single crystal quartz suggests a possible use of the piezoelectric response to drive vibrations using applied RF fields. In polycrystals, averaging of strains in randomly oriented crystals implies using the 'statistical residual' strain as the drive. The ability to excite vibrations in quartzite polycrystals and arenites is explored. We present results of experimental and theoretical approaches to electric field effects using RUS methods.

  15. Electric field effects in RUS measurements.

    PubMed

    Darling, Timothy W; Allured, Bradley; Tencate, James A; Carpenter, Michael A

    2010-02-01

    Much of the power of the Resonant Ultrasound Spectroscopy (RUS) technique is the ability to make mechanical resonance measurements while the environment of the sample is changed. Temperature and magnetic field are important examples. Due to the common use of piezoelectric transducers near the sample, applied electric fields introduce complications, but many materials have technologically interesting responses to applied static and RF electric fields. Non-contact optical, buffered, or shielded transducers permit the application of charge and externally applied electric fields while making RUS measurements. For conducting samples, in vacuum, charging produces a small negative pressure in the volume of the material--a state rarely explored. At very high charges we influence the electron density near the surface so the propagation of surface waves and their resonances may give us a handle on the relationship of electron density to bond strength and elasticity. Our preliminary results indicate a charge sign dependent effect, but we are studying a number of possible other effects induced by charging. In dielectric materials, external electric fields influence the strain response, particularly in ferroelectrics. Experiments to study this connection at phase transformations are planned. The fact that many geological samples contain single crystal quartz suggests a possible use of the piezoelectric response to drive vibrations using applied RF fields. In polycrystals, averaging of strains in randomly oriented crystals implies using the "statistical residual" strain as the drive. The ability to excite vibrations in quartzite polycrystals and arenites is explored. We present results of experimental and theoretical approaches to electric field effects using RUS methods. PMID:19850314

  16. Which charge definition for describing the crystal polarizing field and the χ((1)) and χ((2)) of organic crystals?

    PubMed

    Seidler, Tomasz; Champagne, Benoît

    2015-07-15

    The impact of atomic charge definition for describing the crystal polarizing electric field has been assessed in view of predicting the linear and nonlinear optical susceptibilities of molecular crystals. In this approach, the chromophores are embedded in the electric field of its own point charges, which are evaluated through a self-consistent procedure including charge scaling to account for the screening of the dielectric. Once the crystal field is determined, dressed molecular polarizabilities and hyperpolarizabilities are calculated and used as input of an electrostatic interaction scheme to evaluate the crystal linear and nonlinear optical responses. It is observed that many charge definitions (i) based on partitioning the electron density (QTAIM), (ii) obtained by analyzing the quantum-chemical wavefunction (Mulliken, MBS, and NBO), and (iii) derived by fitting to the electrostatic potential (MK, CHelpG, and HLYGAt) give very consistent results and are equally valid whereas Hirshfeld partitioning and CM5 charge parametrizations underestimate the refractive indices and second-order nonlinear optical susceptibilities. An alternative approach omitting charge scaling is demonstrated to overestimate the different crystal optical properties. On the other hand, the molecule embedding approach provides results in close agreement with those calculated with a charge field obtained from periodic boundary condition calculations. PMID:26144533

  17. DDA Computations of Porous Aggregates with Forsterite Crystals: Effects of Crystal Shape and Crystal Mass Fraction

    NASA Technical Reports Server (NTRS)

    Wooden, Diane H.; Lindsay, Sean S.; Harker, David; Woodward, Charles; Kelley, Michael S.; Kolokolova, Ludmilla

    2015-01-01

    Porous aggregate grains are commonly found in cometary dust samples and are needed to model cometary IR spectral energy distributions (SEDs). Models for thermal emissions from comets require two forms of silicates: amorphous and crystalline. The dominant crystal resonances observed in comet SEDs are from Forsterite (Mg2SiO4). The mass fractions that are crystalline span a large range from 0.0 < or = fcrystal < or = 0.74. Radial transport models that predict the enrichment of the outer disk (>25 AU at 1E6 yr) by inner disk materials (crystals) are challenged to yield the highend-range of cometary crystal mass fractions. However, in current thermal models, Forsterite crystals are not incorporated into larger aggregate grains but instead only are considered as discrete crystals. A complicating factor is that Forsterite crystals with rectangular shapes better fit the observed spectral resonances in wavelength (11.0-11.15 microns, 16, 19, 23.5, 27, and 33 microns), feature asymmetry and relative height (Lindley et al. 2013) than spherically or elliptically shaped crystals. We present DDA-DDSCAT computations of IR absorptivities (Qabs) of 3 micron-radii porous aggregates with 0.13 < or = fcrystal < or = 0.35 and with polyhedral-shaped Forsterite crystals. We can produce crystal resonances with similar appearance to the observed resonances of comet Hale- Bopp. Also, a lower mass fraction of crystals in aggregates can produce the same spectral contrast as a higher mass fraction of discrete crystals; the 11micron and 23 micron crystalline resonances appear amplified when crystals are incorporated into aggregates composed otherwise of spherically shaped amorphous Fe-Mg olivines and pyroxenes. We show that the optical properties of a porous aggregate is not linear combination of its monomers, so aggregates need to be computed. We discuss the consequence of lowering comet crystal mass fractions by modeling IR SEDs with aggregates with crystals, and the implications for radial

  18. Neutron study of crystal field excitations in single crystal CeCu2Ge2

    NASA Astrophysics Data System (ADS)

    Loewenhaupt, Michael; Faulhaber, Enrico; Schneidewind, Astrid; Deppe, Micha; Hradil, Klaudia

    2010-03-01

    CeCu2Ge2 is the counterpart of the heavy-fermion superconductor CeCu2Si2. CeCu2Ge2 is a magnetically ordering (TN= 4.1 K) Kondo lattice with a moderate Sommerfeld coefficient of 140 mJ/molK^2 [1]. Inelastic neutron measurements on a polycrystalline sample revealed a doublet ground state and a quasi-quartet at 16.5 meV [1] though a splitting of the 4f^1 (J=5/2) ground state multiplet into 3 doublets is expected from the point symmetry of the Ce^3+ ions. We performed detailed inelastic neutron scattering experiments on the thermal triple-axis spectrometer PUMA at FRM II at temperatures between 10 K and 300 K and for different crystallographic directions from low to high momentum transfers. In this way we obtained a reliable separation of magnetic and phonon contributions. From our results we infer that the quasi-quartet consists in fact of two doublets at 17 and 18 meV which exhibit a strong directional dependence of their transition matrix elements to the ground state doublet. Finally we will present a new set of crystal field parameters and their implications on other magnetic properties. [1] G. Knopp et al., Z. Physik B 77 (1989) 95

  19. Spatial Distribution of -Crystals in Metallocene-Made Isotactic Polypropylene Crystallized under Combined Thermal and Flow Fields

    SciTech Connect

    Wang, Y.; Pan, J; Mao, Y; Li, Z; Li, L; Hsiao, B

    2010-01-01

    The present Article reports the relationships between molecular orientation, formation, and spatial distribution of {gamma}-crystals in metallocene-made isotactic polypropylene (m-iPP) samples prepared by two industrial processes: conventional injection molding (CIM) and oscillatory shear injection molding (OSIM), in which combined thermal and flow fields typically exist. In particular, spatial distributions of crystallinity, fraction of {gamma}-crystal (f{gamma}) with respect to {alpha}-crystal, and lamella-branched shish-kebab structure in the shaped samples were characterized by synchrotron two-dimensional (2D) wide-angle X-ray diffraction (WAXD) and small-angle X-ray scattering (SAXS) techniques. The results showed that the crystallinity in any given region of OSIM samples was always higher than that of CIM samples. The value of f{gamma} increased monotonously from skin to core in CIM samples, whereas the corresponding f{gamma} increased nonmonotonically in OSIM samples. The spatial distribution of {gamma}-crystal in OSIM samples can be explained by the epitaxial arrangement between {gamma}- and {alpha}-crystal in a lamella-branched shish-kebab structure. In the proposed model, the parent lamellae of {alpha}-crystal provide secondary nucleation sites for daughter lamellae of {alpha}-crystal and {gamma}-crystal, and the different content of parent lamellae results in varying amounts of {gamma}-crystal. In OSIM samples, the smallest parent-daughter ratio ([R] = 1.38) in the core region led to the lowest fraction of {gamma}-crystal (0.57), but relatively higher {gamma}-crystal content (0.69) at 600 and 1200 {micro}m depth of the samples (corresponding to [R] of 4.5 and 5.8, respectively). This is consistent with the proposed model where more parent lamellae provide more nucleation sites for crystallization, thus resulting in higher content of {gamma}-crystal. The melting behavior of CIM and OSIM samples was studied by differential scanning calorimetery (DSC). The

  20. Magnetic field sensor based on selectively magnetic fluid infiltrated dual-core photonic crystal fiber

    NASA Astrophysics Data System (ADS)

    Gangwar, Rahul Kumar; Bhardwaj, Vanita; Singh, Vinod Kumar

    2016-02-01

    We reported the modeling result of selectively magnetic fluid infiltrated dual-core photonic crystal fiber based magnetic field sensor. Inside the cross-section of the designed photonic crystal fiber, the two fiber cores filled with magnetic fluid (Fe3O4) form two independent waveguides with mode coupling. The mode coupling under different magnetic field strengths is investigated theoretically. The sensitivity of the sensor as a function of the structural parameters of the photonic crystal fiber is calculated. The result shows that the proposed sensing device with 1 cm photonic crystal fiber length has a large sensitivity of 305.8 pm/Oe.

  1. Electric field effect in ultrathin black phosphorus

    SciTech Connect

    Koenig, Steven P.; Schmidt, Hennrik; Doganov, Rostislav A.; Castro Neto, A. H.; Özyilmaz, Barbaros

    2014-03-10

    Black phosphorus exhibits a layered structure similar to graphene, allowing mechanical exfoliation of ultrathin single crystals. Here, we demonstrate few-layer black phosphorus field effect devices on Si/SiO{sub 2} and measure charge carrier mobility in a four-probe configuration as well as drain current modulation in a two-point configuration. We find room-temperature mobilities of up to 300 cm{sup 2}/Vs and drain current modulation of over 10{sup 3}. At low temperatures, the on-off ratio exceeds 10{sup 5}, and the device exhibits both electron and hole conduction. Using atomic force microscopy, we observe significant surface roughening of thin black phosphorus crystals over the course of 1 h after exfoliation.

  2. Pressure dependence of upper critical fields in FeSe single crystals

    NASA Astrophysics Data System (ADS)

    Kang, Ji-Hoon; Jung, Soon-Gil; Lee, Sangyun; Park, Eunsung; Lin, Jiunn-Yuan; Chareev, Dmitriy A.; Vasiliev, Alexander N.; Park, Tuson

    2016-03-01

    We investigate the pressure dependence of the upper critical fields (μ 0 H c2) for FeSe single crystals with pressure up to 2.57 GPa. The superconducting (SC) properties show a disparate behavior across a critical pressure where the pressure-induced antiferromagnetic phase coexists with superconductivity. The magnetoresistance for H//ab and H//c is very different: for H//c, magnetic field induces and enhances a hump in the resistivity close to the T c for pressures higher than 1.2 GPa, while it is absent for H//ab. Since the measured μ 0 H c2 for FeSe samples is smaller than the orbital limited upper critical field ({{{H}}{{orb}}}{{c}2}) estimated by the Werthamer, Helfand and Hohenberg model, the Maki parameter (α) related to Pauli spin-paramagnetic effects is additionally considered to describe the temperature dependence of μ 0 H c2(T). Interestingly, the α value is hardly affected by pressure for H//ab, while it strongly increases with pressure for H//c. The pressure evolution of the μ 0 H c2(0) for the FeSe single crystals is found to be almost similar to that of T c(P), suggesting that the pressure-induced magnetic order adversely affects the upper critical fields as well as the SC transition temperature.

  3. Wide-field imaging of birefringent synovial fluid crystals using lens-free polarized microscopy for gout diagnosis

    PubMed Central

    Zhang, Yibo; Lee, Seung Yoon Celine; Zhang, Yun; Furst, Daniel; Fitzgerald, John; Ozcan, Aydogan

    2016-01-01

    Gout is a form of crystal arthropathy where monosodium urate (MSU) crystals deposit and elicit inflammation in a joint. Diagnosis of gout relies on identification of MSU crystals under a compensated polarized light microscope (CPLM) in synovial fluid aspirated from the patient’s joint. The detection of MSU crystals by optical microscopy is enhanced by their birefringent properties. However, CPLM partially suffers from the high-cost and bulkiness of conventional lens-based microscopy, and its relatively small field-of-view (FOV) limits the efficiency and accuracy of gout diagnosis. Here we present a lens-free polarized microscope which adopts a novel differential and angle-mismatched polarizing optical design achieving wide-field and high-resolution holographic imaging of birefringent objects with a color contrast similar to that of a standard CPLM. The performance of this computational polarization microscope is validated by imaging MSU crystals made from a gout patient’s tophus and steroid crystals used as negative control. This lens-free polarized microscope, with its wide FOV (>20 mm2), cost-effectiveness and field-portability, can significantly improve the efficiency and accuracy of gout diagnosis, reduce costs, and can be deployed even at the point-of-care and in resource-limited clinical settings. PMID:27356625

  4. Wide-field imaging of birefringent synovial fluid crystals using lens-free polarized microscopy for gout diagnosis

    NASA Astrophysics Data System (ADS)

    Zhang, Yibo; Lee, Seung Yoon Celine; Zhang, Yun; Furst, Daniel; Fitzgerald, John; Ozcan, Aydogan

    2016-06-01

    Gout is a form of crystal arthropathy where monosodium urate (MSU) crystals deposit and elicit inflammation in a joint. Diagnosis of gout relies on identification of MSU crystals under a compensated polarized light microscope (CPLM) in synovial fluid aspirated from the patient’s joint. The detection of MSU crystals by optical microscopy is enhanced by their birefringent properties. However, CPLM partially suffers from the high-cost and bulkiness of conventional lens-based microscopy, and its relatively small field-of-view (FOV) limits the efficiency and accuracy of gout diagnosis. Here we present a lens-free polarized microscope which adopts a novel differential and angle-mismatched polarizing optical design achieving wide-field and high-resolution holographic imaging of birefringent objects with a color contrast similar to that of a standard CPLM. The performance of this computational polarization microscope is validated by imaging MSU crystals made from a gout patient’s tophus and steroid crystals used as negative control. This lens-free polarized microscope, with its wide FOV (>20 mm2), cost-effectiveness and field-portability, can significantly improve the efficiency and accuracy of gout diagnosis, reduce costs, and can be deployed even at the point-of-care and in resource-limited clinical settings.

  5. Wide-field imaging of birefringent synovial fluid crystals using lens-free polarized microscopy for gout diagnosis.

    PubMed

    Zhang, Yibo; Lee, Seung Yoon Celine; Zhang, Yun; Furst, Daniel; Fitzgerald, John; Ozcan, Aydogan

    2016-01-01

    Gout is a form of crystal arthropathy where monosodium urate (MSU) crystals deposit and elicit inflammation in a joint. Diagnosis of gout relies on identification of MSU crystals under a compensated polarized light microscope (CPLM) in synovial fluid aspirated from the patient's joint. The detection of MSU crystals by optical microscopy is enhanced by their birefringent properties. However, CPLM partially suffers from the high-cost and bulkiness of conventional lens-based microscopy, and its relatively small field-of-view (FOV) limits the efficiency and accuracy of gout diagnosis. Here we present a lens-free polarized microscope which adopts a novel differential and angle-mismatched polarizing optical design achieving wide-field and high-resolution holographic imaging of birefringent objects with a color contrast similar to that of a standard CPLM. The performance of this computational polarization microscope is validated by imaging MSU crystals made from a gout patient's tophus and steroid crystals used as negative control. This lens-free polarized microscope, with its wide FOV (>20 mm(2)), cost-effectiveness and field-portability, can significantly improve the efficiency and accuracy of gout diagnosis, reduce costs, and can be deployed even at the point-of-care and in resource-limited clinical settings. PMID:27356625

  6. Patterns driven by combined ac and dc electric fields in nematic liquid crystals.

    PubMed

    Krekhov, Alexei; Decker, Werner; Pesch, Werner; Eber, Nándor; Salamon, Péter; Fekete, Balázs; Buka, Agnes

    2014-05-01

    The effect of superimposed ac and dc electric fields on the formation of electroconvection and flexoelectric patterns in nematic liquid crystals was studied. For selected ac frequencies, an extended standard model of the electrohydrodynamic instabilities was used to characterize the onset of pattern formation in the two-dimensional parameter space of the magnitudes of the ac and dc electric field components. Numerical as well as approximate analytical calculations demonstrate that depending on the type of patterns and on the ac frequency, the combined action of ac and dc fields may either enhance or suppress the formation of patterns. The theoretical predictions are qualitatively confirmed by experiments in most cases. Some discrepancies, however, seem to indicate the need to extend the theoretical description. PMID:25353815

  7. Field-induced periodic distortions in a nematic liquid crystal: deuterium NMR study and theoretical analysis.

    PubMed

    Sugimura, A; Zakharov, A V

    2011-08-01

    The peculiarities in the dynamic of the director reorientation in a liquid crystal (LC) film under the influence of the electric E field directed at an angle α to the magnetic B field have been investigated both experimentally and theoretically. Time-resolved deuterium NMR spectroscopy is employed to investigate the field-induced director dynamics. Analysis of the experimental results, based on the predictions of hydrodynamic theory including both the director motion and fluid flow, provides an evidence for the appearance of the spatially periodic patterns in 4-n-pentyl-4'-cyanobiphenyl LC film, at the angles α>60∘, in response to the suddenly applied E. These periodic distortions produce a lower effective rotational viscosity. This gives a faster response of the director rotation than for a uniform mode, as observed in our NMR experiment. PMID:21929001

  8. Melt Motion Due to Peltier Marking During Bridgman Crystal Growth with an Axial Magnetic Field

    NASA Technical Reports Server (NTRS)

    Sellers, C. C.; Walker, John S.; Szofran, Frank R.; Motakef, Shariar

    2000-01-01

    This paper treats a liquid-metal flow inside an electrically insulating cylinder with electrically conducting solids above and below the liquid region. There is a uniform axial magnetic field, and there is an electric current through the liquid and both solids. Since the lower liquid-solid interface is concave into the solid and since the liquid is a better electrical conductor than the adjacent solid, the electric current is locally concentrated near the centerline. The return to a uniform current distribution involves a radial electric current which interacts with the axial magnetic field to drive an azimuthal flow. The axial variation of the centrifugal force due to the azimuthal velocity drives a meridional circulation with radial and axial velocities. This problem models the effects of Peltier marking during the vertical Bridgman growth of semiconductor crystals with an externally applied magnetic field, where the meridional circulation due to the Peltier Current may produce important mixing in the molten semiconductor.

  9. Molecular simulations elucidate electric field actuation in swollen liquid crystal elastomers

    PubMed Central

    Skačej, Gregor; Zannoni, Claudio

    2012-01-01

    Swollen elastomer liquid crystals undergo significant deformations by application of an electric field perpendicular to their alignment axis, as shown in experiments by Urayama et al. [Urayama K, Honda S, Takigawa T (2006) Macromolecules 39:1943–1949]. Here we clarify this surprising effect at the molecular level using large-scale Monte Carlo simulations of an off-lattice model based on a soft Gay–Berne potential. We provide the internal change of molecular organization, as well as the key observables during the actuation cycle. PMID:22679288

  10. Molecular simulations elucidate electric field actuation in swollen liquid crystal elastomers.

    PubMed

    Skačej, Gregor; Zannoni, Claudio

    2012-06-26

    Swollen elastomer liquid crystals undergo significant deformations by application of an electric field perpendicular to their alignment axis, as shown in experiments by Urayama et al. [Urayama K, Honda S, Takigawa T (2006) Macromolecules 39:1943-1949]. Here we clarify this surprising effect at the molecular level using large-scale Monte Carlo simulations of an off-lattice model based on a soft Gay-Berne potential. We provide the internal change of molecular organization, as well as the key observables during the actuation cycle. PMID:22679288

  11. Complete polarization conversion using one crystal with dual transverse Pockels effect.

    PubMed

    Li, Changsheng

    2008-05-01

    Based on dual transverse Pockels effect, complete polarization conversion can be achieved by using only one electro-optic crystal and its two externally applied voltages. The electro-optic phase retardation and the azimuth angle of the field-induced principal dielectric axes of the crystal can be independently and linearly controlled by the amplitude and direction of the applied electric field, and the formulas for this correlation are deduced for arbitrary input and output polarization states. The candidate crystals mainly include the uniaxial crystals of 3 m, 62 m, and 32 symmetry groups, and the cubic crystals of 43 m and 23 symmetry groups. Theoretical analysis demonstrates that one crystal exhibiting both dual transverse Pockels effect and optical activity can also be used for complete polarization converter. The continuous polarization rotation of a linearly polarized light from 0 degrees to 180 degrees has been performed experimentally by use of single lithium niobate crystal with four lateral electrodes. In addition the light beam position-dependent polarization conversion by using a bulk electro-optic crystal is also measured in the experiment. This new type of polarization converter will have potential applications in many fields due to its simple configuration, explicit control logic of polarization conversion, and lower power consumption. PMID:18449288

  12. Combining a rotating magnetic field and crystal rotation in the floating-zone process with a needle-eye induction coil

    NASA Astrophysics Data System (ADS)

    Ma, N.; Walker, J. S.; Lüdge, A.; Riemann, H.

    2001-08-01

    This paper presents numerical solutions for the steady, axisymmetric melt motions in a simplified model of the floating-zone process with a needle-eye induction coil. With only buoyant and thermocapillary convections, there are two meridional circulations, and the stronger, outer circulation involves an undesirable radially inward flow near the crystal-melt interface. Adding crystal rotation alone can only decrease the magnitudes of the meridional circulations. Adding a rotating magnetic field alone has the undesirable effect of increasing the magnitude and extent of the radially inward flow near the crystal-melt interface. Combining a rotating magnetic field in one azimuthal direction with crystal rotation in the opposite azimuthal direction overwhelms the buoyant and thermocapillary convections and produces the desired radially outward flow over the entire crystal-melt interface. The magnitude of this radially outward flow is easily controlled by changing either the angular velocity of the crystal rotation or the strength of the rotating magnetic field.

  13. Thermal fluctuation effects on the magnetization above and below the superconducting transition in Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8} crystals in the weak magnetic field limit

    SciTech Connect

    Mosqueira, J.; Miramontes, E.G.; Torron, C.; Campa, J.A.; Rasines, I.; Vidal, F.

    1996-06-01

    We present detailed experimental data of the magnetization, {ital M}{sub {ital ab}}({ital T},{ital H}), of Bi{sub 2}Sr{sub 2}CaCu{sub 2}O{sub 8} crystals on both sides of the superconducting transition, for magnetic fields, {ital H}, applied perpendicularly to the {ital ab} (CuO{sub 2}) planes and for amplitudes up to {mu}{sub 0}{ital H}=5 T, which not too close to the superconducting transition correspond to the weak magnetic field amplitude limit. These data are analyzed in terms of thermal fluctuations in this weak {ital H} limit: In the reversible mixed state below the transition, by taking into account the fluctuations of the vortex lines positions, as first proposed by Bulaevskii, Ledvij, and Kogan. Above the transition, by taking into account the Cooper pairs created by thermal fluctuations, through a generalization of multilayered superconductors of the Schmidt-like approach. These simultaneous, quantitative and consistent analyses of {ital M}{sub {ital ab}}({ital T},{ital H}) above and below the transition allow us to estimate the effective number of independent fluctuating superconducting CuO{sub 2} planes in the periodicity length {ital s}={ital c}/2, {ital c} being the unit-cell length, and to separate for the first time the in-plane correlation length amplitude, {xi}{sub {ital ab}}(0), and the parameter related to the vortex structure, {eta}. We found {xi}{sub {ital ab}}(0)=(0.8{plus_minus}0.1) nm and {eta}=0.15{plus_minus}0.05, this last value being well within the one calculated by Fetter by applying the London model to a triangular vortex lattice. For the in-plane magnetic penetration depth, we found a temperature behavior compatible with the clean BCS weak coupling limit, and an amplitude (at {ital T}=0 K) of {lambda}{sub {ital ab}}(0)=(180{plus_minus}20) nm. {copyright} {ital 1996 The American Physical Society.}

  14. The Structure, Thermodynamics and Solubility of Organic Crystals from Simulation with a Polarizable Force Field

    PubMed Central

    Schnieders, Michael J.; Baltrusaitis, Jonas; Shi, Yue; Chattree, Gaurav; Zheng, Lianqing; Yang, Wei; Ren, Pengyu

    2012-01-01

    An important unsolved problem in materials science is prediction of the thermodynamic stability of organic crystals and their solubility from first principles. Solubility can be defined as the saturating concentration of a molecule within a liquid solvent, where the physical picture is of solvated molecules in equilibrium with their solid phase. Despite the importance of solubility in determining the oral bioavailability of pharmaceuticals, prediction tools are currently limited to quantitative structure–property relationships that are fit to experimental solubility measurements. For the first time, we describe a consistent procedure for the prediction of the structure, thermodynamic stability and solubility of organic crystals from molecular dynamics simulations using the polarizable multipole AMOEBA force field. Our approach is based on a thermodynamic cycle that decomposes standard state solubility into the sum of solid-vapor sublimation and vapor-liquid solvation free energies ΔGsolubilityo=ΔGsubo+ΔGsolvo, which are computed via the orthogonal space random walk (OSRW) sampling strategy. Application to the n-alkylamides series from aeetamide through octanamide was selected due to the dependence of their solubility on both amide hydrogen bonding and the hydrophobic effect, which are each fundamental to protein structure and solubility. On average, the calculated absolute standard state solubility free energies are accurate to within 1.1 kcal/mol. The experimental trend of decreasing solubility as a function of n-alkylamide chain length is recapitulated by the increasing stability of the crystalline state and to a lesser degree by decreasing favorability of solvation (i.e. the hydrophobic effect). Our results suggest that coupling the polarizable AMOEBA force field with an orthogonal space based free energy algorithm, as implemented in the program Force Field X, is a consistent procedure for predicting the structure, thermodynamic stability and solubility of

  15. Polymer crystallization in a temperature gradient field with controlled crystal growth rate

    NASA Technical Reports Server (NTRS)

    Hansen, D.; Taskar, A. N.; Casale, O.

    1971-01-01

    A method is described for studying the influence of a temperature gradient on the crystallization of quiescent polymer melts. The apparatus used consists of two brass plates with embedded electrical resistance heaters and cooling coils. The crystallizations experiments were conducted by placing polymer specimens between the paltes, and manually adjusting heaters and cooling fluids for temperature control. Linear polyethylene, isotactic polyprophylene, and a high density polyethylene were used. It is concluded that the role of a temperature gradient in producing oriented crystallization is in producing conditions which lead the spherulitic growth pattern to proceed primarily in one direction. Steep gradients diminish the penetration of supercooling and favors oriented growth.

  16. Static magnetic susceptibility, crystal field and exchange interactions in rare earth titanate pyrochlores.

    PubMed

    Malkin, B Z; Lummen, T T A; van Loosdrecht, P H M; Dhalenne, G; Zakirov, A R

    2010-07-14

    The experimental temperature dependence (T = 2-300 K) of single crystal bulk and site susceptibilities of rare earth titanate pyrochlores R(2)Ti(2)O(7) (R = Sm, Eu, Gd, Tb, Dy, Ho, Er, Yb) is analyzed in the framework of crystal field theory and a mean field approximation. Analytical expressions for the site and bulk susceptibilities of the pyrochlore lattice are derived taking into account long range dipole-dipole interactions and anisotropic exchange interactions between the nearest neighbor rare earth ions. The sets of crystal field parameters and anisotropic exchange coupling constants have been determined and their variations along the lanthanide series are discussed. PMID:21399269

  17. DDA Computations of Porous Aggregates with Forsterite Crystals: Effects of Crystal Shape and Crystal Mass Fraction

    NASA Astrophysics Data System (ADS)

    Wooden, Diane H.; Lindsay, Sean S.; Harker, David; Woodward, Charles; Kelley, Michael S. P.; Kolokolova, Ludmilla

    2015-08-01

    Porous aggregate grains are commonly found in cometary dust samples and are needed to model cometary IR spectral energy distributions (SEDs). Models for thermal emissions from comets require two forms of silicates: amorphous and crystalline. The dominant crystal resonances observed in comet SEDs are from Forsterite (Mg2SiO4). The mass fractions that are crystalline span a large range from 0.0 ≤ fcrystal ≤ 0.74. Radial transport models that predict the enrichment of the outer disk (>25 AU at 1E6 yr) by inner disk materials (crystals) are challenged to yield the highend-range of cometary crystal mass fractions. However, in current thermal models, Forsterite crystals are not incorporated into larger aggregate grains but instead only are considered as discrete crystals. A complicating factor is that Forsterite crystals with rectangular shapes better fit the observed spectral resonances in wavelength (11.0-11.15 μm, 16, 19, 23.5, 27, and 33 μm), feature asymmetry and relative height (Lindley et al. 2013) than spherically or elliptically shaped crystals. We present DDA-DDSCAT computations of IR absorptivities (Qabs) of 3 μm-radii porous aggregates with 0.13 ≤ fcrystal ≤ 0.35 and with polyhedral-shaped Forsterite crystals. We can produce crystal resonances with similar appearance to the observed resonances of comet Hale-Bopp. Also, a lower mass fraction of crystals in aggregates can produce the same spectral contrast as a higher mass fraction of discrete crystals; the 11µm and 23 µm crystalline resonances appear amplified when crystals are incorporated into aggregates composed otherwise of spherically shaped amorphous Fe-Mg olivines and pyroxenes. We show that the optical properties of a porous aggregate is not linear combination of its monomers, so aggregates need to be computed. We discuss the consequence of lowering comet crystal mass fractions by modeling IR SEDs with aggregates with crystals, and the implications for radial transport models of our

  18. Anisotropy effect on the caloric properties of NdAl2 single crystal

    NASA Astrophysics Data System (ADS)

    Caro Patiño, J.; de Oliveira, N. A.; von Ranke, P. J.

    2015-11-01

    In this paper we theoretically discuss the effect of anisotropy on the magnetocaloric properties of NdAl2 single crystal. To this end, we use a model Hamiltonian of interacting magnetic moments under the influence of the crystal electric field. The magnetocaloric quantity, ΔSiso, calculated for 7 T magnetic field variation is in a reasonable agreement with the available experimental data. Moreover, we predict the existence of anomalies in the magnetocaloric effect when the magnetic field of constant intensity rotates from < 100 > to < 110 > direction.

  19. An optical analog of the Borrmann effect in photonic crystals

    SciTech Connect

    Bogdanova, M. V. Lozovik, Yu. E.; Eiderman, S. L.

    2010-04-15

    Numerical simulation using the layered Korringa-Kohn-Rostoker (LKKR) method is applied to calculate the reflection and absorption spectra of an s-polarized electromagnetic wave incident on a faced-centered cubic photonic crystal (PC) with opal structure whose sites are occupied by two-layer metal-dielectric spheres. The reflection and absorption coefficients of the PC are analyzed as a function of the angle of incidence of the electromagnetic wave on the crystal surface. A range of wavelengths {lambda} and angles of inclination {theta} to the normal is found in which the absorption experiences a sharp change under small variations of the above parameters. The appearance of peaks in the absorption spectrum of the PC is analyzed, and the spectrum is compared with the behavior of the reduced density of states. By the finite difference time domain (FDTD) method applied to the Maxwell equations, the spatial distribution of the energy density of electromagnetic field inside each of five layers of the PC is obtained at angles of incidence of 23{sup o} and 30{sup o} for a wave-length of 455 nm. It is demonstrated that the sharp maxima of the density of electromagnetic-field energy that are localized on the surfaces of absorbing metal spheres correspond to the absorption maximum. At the same time, at the absorption minimum, the maxima of the field energy density in each of the five layers are localized mainly between the lattice sites of the PC. An analogy between this phenomenon and the Borrmann effect, which is known in X-ray spectroscopy of ordinary crystals, is analyzed.

  20. REVIEW ARTICLE: Effects of light on molecular orientation of liquid crystals

    NASA Astrophysics Data System (ADS)

    Simoni, F.; Francescangeli, O.

    1999-10-01

    A review of basic physical phenomena underlying the light-induced molecular reorientation in nematic liquid crystals is presented. A detailed description of the mechanisms of direct optical torque, photoisomerization and photorefractivity and of their effect on the macroscopic order of liquid crystals is reported. The first part of the article deals with the study of reorientation effects in transparent liquid crystalline materials. Here, the effects of photo-induced molecular reorientation are fully interpreted within the framework of classical electrodynamics and standard continuum theory of liquid crystals. We investigate the peculiar properties related to the macroscopic anisotropy and the collective behaviour of liquid crystals that result in extraordinarily large nonlinear optical response. Afterwards, the behaviour of liquid crystals in the presence of light absorption is considered and the related reorientation effects are discussed. We give a review of the wide phenomenology which is met in liquid crystals when doped with absorbing azo-dye molecules. The photoisomerization process that in this case drives the evolution of the dye-liquid crystal mixture consequent to the interaction with the light is discussed in detail. Finally, the relatively new field of photorefractivity in liquid crystals as a source of molecular reorientation is considered. We describe the different mechanisms contributing to the creation of a space-charge field such as conductivity anisotropy, dielectric anisotropy and photocharge production. A theoretical discussion of the fundamental mechanisms regulating the dc-field-assisted optically induced space-charge fields and the optical molecular reorientation in nematic liquid crystal films is also given.

  1. Formation of temperature fields in doped anisotropic crystals under spatially inhomogeneous light beams passing through them

    SciTech Connect

    Zaitseva, E. V.; Markelov, A. S.; Trushin, V. N. Chuprunov, E. V.

    2013-12-15

    The features of formation of thermal fields in potassium dihydrophosphate crystal doped with potassium permanganate under a 532-nm laser beam passing through it have been investigated. Data on the influence of birefringence on the temperature distribution in an anisotropic crystal whose surface is illuminated by a spatially modulated light beam are presented.

  2. Dynamic control over the heat field during LBO crystal growth by High temperature solution method

    NASA Astrophysics Data System (ADS)

    Kokh, A.; Vlezko, V.; Kokh, K.; Kononova, N.; Villeval, Ph.; Lupinski, D.

    2012-12-01

    The paper presents LiB3O5 crystal growth under oscillating temperature regime provided by sequential switching of the heaters placed around the crucible. First results have demonstrated the ability to grow high-quality crystals under dynamicaly changed (rotating) heat field confirming the possibility to control over heat-mass-transfer processes by proposed contact free method.

  3. Formation of temperature fields in doped anisotropic crystals under spatially inhomogeneous light beams passing through them

    NASA Astrophysics Data System (ADS)

    Zaitseva, E. V.; Markelov, A. S.; Trushin, V. N.; Chuprunov, E. V.

    2013-12-01

    The features of formation of thermal fields in potassium dihydrophosphate crystal doped with potassium permanganate under a 532-nm laser beam passing through it have been investigated. Data on the influence of birefringence on the temperature distribution in an anisotropic crystal whose surface is illuminated by a spatially modulated light beam are presented.

  4. The Fano-type transmission and field enhancement in heterostructures composed of epsilon-near-zero materials and truncated photonic crystals

    SciTech Connect

    Zhang, Zhi-fang; Jiang, Hai-tao E-mail: jiang-haitao@tongji.edu.cn; Li, Yun-hui; Chen, Hong; Xue, Chun-hua E-mail: jiang-haitao@tongji.edu.cn; Lu, Hai

    2013-11-11

    The Fano-type interference effect is studied in the heterostructure composed of an epsilon-near-zero (ENZ) material and a truncated photonic crystal for transverse magnetic polarized light. In the Fano-type interference effect, the ENZ material provides narrow reflection pathway and the photonic crystal provides broadband reflection pathway. The boundary condition across the ENZ interface and the confinement effect provided by the photonic crystal can enhance the electric fields in the ENZ material greatly. The field enhancements, together with the asymmetric property of Fano-type spectrum, possess potential applications for significantly lowering the threshold of nonlinear processes such as optical switching and bistability.

  5. Dynamics of three-dimensional convection in microgravity crystal growth: g-jitter with steady magnetic fields

    NASA Astrophysics Data System (ADS)

    Yeckel, Andrew; Derby, Jeffrey J.

    2004-03-01

    We present results from three-dimensional simulations of the flow induced by transient acceleration (g-jitter) in microgravity crystal growth. Transient accelerations in both axial and transverse directions are considered for a simple prototype of a vertical Bridgman crystal growth system. We also consider the effects of applying a steady magnetic field in axial or transverse directions to suppress the flow. In most cases, application of a magnetic field suppresses flow oscillations, but for transverse jitter at intermediate frequencies, flow oscillations are increased. This counter-intuitive effect is a dynamic one, in which boundary layer formation under the influence of a magnetic field shortens the time scale of momentum transfer, allowing the flow to respond more quickly to the time variation of acceleration. The effect of the magnetic field on an enclosed flow with electrically insulating boundary conditions is to preferentially suppress the velocity component tangential to the magnetic field. The ability to filter a single velocity component by application of a specified magnetic field could be useful for simultaneously improving both axial and radial segregation in semiconductor crystal growth.

  6. Flow-induced Crystallization of Long Chain Aliphatic Polyamides under a Complex Flow Field

    NASA Astrophysics Data System (ADS)

    Dong, Xia; Gao, Yunyun; Wang, Lili; Wang, Dujin

    The present work deals with the flow-induced multiple orientations and crystallization structure of polymer melts under a complex flow field. This complex flow field is characteristic of the consistent coupling of extensional ``pulse'' and closely followed shear flow in a narrow channel. Utilizing an ingenious combination of an advanced micro-injection device and long chain aliphatic polyamides, the flow-induced crystallization morphology was well preserved for ex-situ synchrotron micro-focused wide angle X-ray scattering as well as small angle X-ray scattering. The experimental results clearly indicate that the effect of extensional pulse on the polymer melt is restrained and further diminished due to either the transverse tumble of fountain flow or the rapid retraction of stretched high molecular weight tails. However, the residual shish-kebab structures in the core layer of the far-end of channel suggest that the effect of extensional pulse should be considered in the small-scaled geometries or under the high strain rate condition. The authors thank the financial support from MOST (2013BAE02B02, 2014CB643600) and NSFC(21574140).

  7. Imposed Orientation of Dye Molecules by Liquid Crystals and an Electric Field.

    ERIC Educational Resources Information Center

    Sadlej-Sosnowska, Nina

    1980-01-01

    Describes experiments using dye solutions in liquid crystals in which polar molecules are oriented in an electrical field and devices are constructed to change their color in response to an electric signal. (CS)

  8. Self-consistent-field studies of core-level shifts in ionic crystals: LiF

    SciTech Connect

    Broughton, J.Q.; Bagus, P.S.

    1984-10-15

    Restricted-Hartree-Fock, self-consistent-field calculations have been performed for the ground and ionic states of clusters of lithium and fluorine atoms. These clusters are appropriately charged to represent an Li/sup +/F/sup -/ ionic crystal and point charges are used to represent the Madelung field due to ions not explicitly included in the cluster. Factors giving rise to core- and valence-level binding-energy shifts have been examined and separated into compressional, relaxational, and effective Madelung contributions. Many tests of ionicity are shown to be well satisfied, although this is often caused by fortuitous cancellations. Extra-ionic relaxation energies on both the cation and anion are shown to be small, and shakeup probabilities are calculated.

  9. Method of bonding single crystal quartz by field-assisted bonding

    DOEpatents

    Curlee, R.M.; Tuthill, C.D.; Watkins, R.D.

    1991-04-23

    The method of producing a hermetic stable structural bond between quartz crystals includes providing first and second quartz crystals and depositing thin films of borosilicate glass and silicon on portions of the first and second crystals, respectively. The portions of the first and second crystals are then juxtaposed in a surface contact relationship and heated to a temperature for a period sufficient to cause the glass and silicon films to become electrically conductive. An electrical potential is then applied across the first and second crystals for creating an electrostatic field between the adjoining surfaces and causing the juxtaposed portions to be attracted into an intimate contact and form a bond for joining the adjoining surfaces of the crystals. 2 figures.

  10. Method of bonding single crystal quartz by field-assisted bonding

    DOEpatents

    Curlee, Richard M.; Tuthill, Clinton D.; Watkins, Randall D.

    1991-01-01

    The method of producing a hermetic stable structural bond between quartz crystals includes providing first and second quartz crystals and depositing thin films of borosilicate glass and silicon on portions of the first and second crystals, respectively. The portions of the first and second crystals are then juxtaposed in a surface contact relationship and heated to a temperature for a period sufficient to cause the glass and silicon films to become electrically conductive. An electrical potential is then applied across the first and second crystals for creating an electrostatic field between the adjoining surfaces and causing the juxtaposed portions to be attracted into an intimate contact and form a bond for joining the adjoining surfaces of the crystals.

  11. Directional growth by low electric-field-controlled crystallization of bulk amorphous lithium tetraborate

    NASA Astrophysics Data System (ADS)

    Kim, S. J.; Kim, J. E.; Yang, Y. S.

    2004-12-01

    Highly oriented rod-shaped crystals were grown during crystallization of bulk amorphous Li2B4O7 under a low ac electric field of ˜5V/mm. The crystal c axis that is the long direction of rods and perpendicular to the flat surface of the sample is parallel to the applied electric-field direction. The oriented crystals, with an alignment within a declined angle of ˜15°, are so long along the c direction compared with those of other directions that the geometrical structure of each rod is quasi-one-dimensional. The measured electromechanical coupling coefficient of kt=0.47 is comparable to that of single-crystal Li2B4O7.

  12. A test of improved force field parameters for urea: molecular-dynamics simulations of urea crystals.

    PubMed

    Özpınar, Gül Altınbaş; Beierlein, Frank R; Peukert, Wolfgang; Zahn, Dirk; Clark, Timothy

    2012-08-01

    Molecular-dynamics (MD) simulations of urea crystals of different shapes (cubic, rectangular prismatic, and sheet) have been performed using our previously published force field for urea. This force field has been validated by calculating values for the cohesive energy, sublimation temperature, and melting point from the MD data. The cohesive energies computed from simulations of cubic and rectangular prismatic urea crystals in vacuo at 300 K agreed very well with the experimental sublimation enthalpies reported at 298 K. We also found very good agreement between the melting points as observed experimentally and from simulations. Annealing the crystals just below the melting point leads to reconstruction to form crystal faces that are consistent with experimental observations. The simulations reveal a melting mechanism that involves surface (corner/edge) melting well below the melting point, and rotational disordering of the urea molecules in the corner/edge regions of the crystal, which then facilitates the translational motion of these molecules. PMID:22281810

  13. Field localization and enhancement near the Dirac point of a finite defectless photonic crystal

    NASA Astrophysics Data System (ADS)

    D'Aguanno, Giuseppe; Mattiucci, Nadia; Conti, Claudio; Bloemer, Mark J.

    2013-02-01

    We use a rigorous electromagnetic approach to show the existence of strongly localized modes in the stop band of a linear, two-dimensional, finite photonic crystal near its Dirac point. At normal incidence, the crystal exhibits a Dirac point with 100% transmission. At angles slightly off the normal, where the crystal is 100% reflective, instead of exponentially decaying fields as in a photonic stop band, the field becomes strongly localized and enhanced inside the crystal. We explain that this anomalous localization is due to guided mode resonances that are the foundation of the Dirac point itself and also shape its adjacent band gap. Besides shedding new light on the physical origin of Dirac points in finite photonic crystals, our results could have applications in many nonlinear light-matter interaction phenomena in which it is crucial to achieve a high degree of light localization.

  14. Models of Mass Transport During Microgravity Crystal Growth of Alloyed Semiconductors in a Magnetic Field

    NASA Technical Reports Server (NTRS)

    Ma, Nancy

    2003-01-01

    Alloyed semiconductor crystals, such as germanium-silicon (GeSi) and various II-VI alloyed crystals, are extremely important for optoelectronic devices. Currently, high-quality crystals of GeSi and of II-VI alloys can be grown by epitaxial processes, but the time required to grow a certain amount of single crystal is roughly 1,000 times longer than the time required for Bridgman growth from a melt. Recent rapid advances in optoelectronics have led to a great demand for more and larger crystals with fewer dislocations and other microdefects and with more uniform and controllable compositions. Currently, alloyed crystals grown by bulk methods have unacceptable levels of segregation in the composition of the crystal. Alloyed crystals are being grown by the Bridgman process in space in order to develop successful bulk-growth methods, with the hope that the technology will be equally successful on earth. Unfortunately some crystals grown in space still have unacceptable segregation, for example, due to residual accelerations. The application of a weak magnetic field during crystal growth in space may eliminate the undesirable segregation. Understanding and improving the bulk growth of alloyed semiconductors in microgravity is critically important. The purpose of this grant to to develop models of the unsteady species transport during the bulk growth of alloyed semiconductor crystals in the presence of a magnetic field in microgravity. The research supports experiments being conducted in the High Magnetic Field Solidification Facility at Marshall Space Flight Center (MSFC) and future experiments on the International Space Station.

  15. Imaging of director fields in liquid crystals using stimulated Raman scattering microscopy.

    PubMed

    Lee, Taewoo; Mundoor, Haridas; Gann, Derek G; Callahan, Timothy J; Smalyukh, Ivan I

    2013-05-20

    We demonstrate an approach for background-free three-dimensional imaging of director fields in liquid crystals using stimulated Raman scattering microscopy. This imaging technique is implemented using a single femtosecond pulsed laser and a photonic crystal fiber, providing Stokes and pump frequencies needed to access Raman shifts of different chemical bonds of molecules and allowing for chemically selective and broadband imaging of both pristine liquid crystals and composite materials. Using examples of model three-dimensional structures of director fields, we show that the described technique is a powerful tool for mapping of long-range molecular orientation patterns in soft matter via polarized chemical-selective imaging. PMID:23736433

  16. A Navier-Stokes phase-field crystal model for colloidal suspensions.

    PubMed

    Praetorius, Simon; Voigt, Axel

    2015-04-21

    We develop a fully continuous model for colloidal suspensions with hydrodynamic interactions. The Navier-Stokes Phase-Field Crystal model combines ideas of dynamic density functional theory with particulate flow approaches and is derived in detail and related to other dynamic density functional theory approaches with hydrodynamic interactions. The derived system is numerically solved using adaptive finite elements and is used to analyze colloidal crystallization in flowing environments demonstrating a strong coupling in both directions between the crystal shape and the flow field. We further validate the model against other computational approaches for particulate flow systems for various colloidal sedimentation problems. PMID:25903907

  17. Influence of Acoustic Field Structure on Polarization Characteristics of Acousto-optic Interaction in Crystals

    NASA Astrophysics Data System (ADS)

    Muromets, A. V.; Trushin, A. S.

    Influence of acoustic field structure on polarization characteristics of acousto-optic interaction is investigated. It is shown that inhomogeneity of acoustic field and mechanism of ultrasound excitation causes changes in values of acousto-optic figure of merit for ordinary and extraordinary light beams in comparison with theoretic values. The theoretic values were derived under assumption that acoustic wave is homogeneous. Experimental analysis was carried out in acousto-optic cell based on lithium niobate crystal where the acoustic wave propagates at the angle 13 degrees to Z axis of the crystal. We used three different methods of ultrasound generation in the crystal: by means of external piezotransducer, by interdigital transducer and by two sets of electrodes placed on top of the crystal surface. In the latter case, the first pair of the electrodes was directed along X crystal axis, while the second pair of the electrodes was directed orthogonally to X crystal axis and the direction of ultrasound. Obtained values for diffraction efficiencies for ordinary and extraordinary polarized optical beams were qualitatively different which may be caused by spatial inhomogeneity of the generated acoustic waves in the crystal. Structure of acoustic field generated by these sets of electrodes was examined by laser probing. We performed the analysis of the acoustic field intensity using acousto-optic method. A relation of diffraction efficiencies for ordinary and extraordinary light waves was measured during each iteration of the laser probing.

  18. Effect of Crystal Orientation on Fatigue Failure of Single Crystal Nickel Base Turbine Blade Superalloys

    NASA Technical Reports Server (NTRS)

    Arakere, N. K.; Swanson, G.

    2002-01-01

    High cycle fatigue (HCF) induced failures in aircraft gas turbine and rocket engine turbopump blades is a pervasive problem. Single crystal nickel turbine blades are being utilized in rocket engine turbopumps and jet engines throughout industry because of their superior creep, stress rupture, melt resistance, and thermomechanical fatigue capabilities over polycrystalline alloys. Currently the most widely used single crystal turbine blade superalloys are PWA 1480/1493, PWA 1484, RENE' N-5 and CMSX-4. These alloys play an important role in commercial, military and space propulsion systems. Single crystal materials have highly orthotropic properties making the position of the crystal lattice relative to the part geometry a significant factor in the overall analysis. The failure modes of single crystal turbine blades are complicated to predict due to the material orthotropy and variations in crystal orientations. Fatigue life estimation of single crystal turbine blades represents an important aspect of durability assessment. It is therefore of practical interest to develop effective fatigue failure criteria for single crystal nickel alloys and to investigate the effects of variation of primary and secondary crystal orientation on fatigue life. A fatigue failure criterion based on the maximum shear stress amplitude /Delta(sub tau)(sub max))] on the 24 octahedral and 6 cube slip systems, is presented for single crystal nickel superalloys (FCC crystal). This criterion reduces the scatter in uniaxial LCF test data considerably for PWA 1493 at 1200 F in air. Additionally, single crystal turbine blades used in the alternate advanced high-pressure fuel turbopump (AHPFTP/AT) are modeled using a large-scale three-dimensional finite element model. This finite element model is capable of accounting for material orthotrophy and variation in primary and secondary crystal orientation. Effects of variation in crystal orientation on blade stress response are studied based on 297

  19. Near-field studies of microwave three-dimensional photonic crystals with waveguides.

    PubMed

    Liu, Rong-Juan; Li, Zhi-Yuan; Zhou, Fei; Zhang, Dao-Zhong

    2007-11-12

    By utilizing a vector network analyzer, the field distributions on the surface of a three-dimensional woodpile photonic crystal with a straight waveguide or a bend waveguide buried under the surface were measured in the microwave regime. The information of field profile and propagation characteristics of the guided modes can be successfully extracted from the surface near-field measurement. This work indicates that the near-field detection can become a promising means for experimental characterization of three-dimensional photonic crystal devices in supplement to the usual transmission spectrum measurement. PMID:19550839

  20. Large electrocaloric effects in single-crystal ammonium sulfate.

    PubMed

    Crossley, S; Li, W; Moya, X; Mathur, N D

    2016-08-13

    Electrocaloric (EC) effects are typically studied near phase transitions in ceramic and polymer materials. Here, we investigate EC effects in an inorganic salt, namely ammonium sulfate (NH4)2SO4, with an order-disorder transition whose onset occurs at 223 K on cooling. For a single crystal thinned to 50 μm, we use a Maxwell relation to find a large isothermal entropy change of 30 J K(-1) kg(-1) in response to a field change of 400 kV cm(-1) The Clausius-Clapeyron equation implies a corresponding adiabatic temperature change of 4.5 K.This article is part of the themed issue 'Taking the temperature of phase transitions in cool materials'. PMID:27402930

  1. Effect of Co2+ doping on solubility, crystal growth and properties of ADP crystals

    NASA Astrophysics Data System (ADS)

    Ganesh, V.; Shkir, Mohd.; AlFaify, S.; Yahia, I. S.

    2016-09-01

    Bulk size crystal growth of ADP with different concentrations doping of cobalt (Co2+) has been done by low cost slow evaporation technique at ambient conditions. The solubility measurement was carried out on pure and doped crystals and found that the solubility is decreasing with doping concentrations. The presence of Co2+ ion in crystalline matrix of ADP has been confirmed by structural, vibrational and elemental analyses. Scanning electron microscopic study reveals that the doping has strong effect on the quality of the crystals. The optical absorbance and transmission confirms the enhancement of quality of ADP crystals due to Co2+ doping and so the optical band gap. Further the dislocation, photoluminescence, dielectric and mechanical studies confirms that the properties of grown crystals with Co2+ doping has been enriched and propose it as a better candidate for optoelectronic applications.

  2. Modified phase-field-crystal model for solid-liquid phase transitions

    NASA Astrophysics Data System (ADS)

    Guo, Can; Wang, Jincheng; Wang, Zhijun; Li, Junjie; Guo, Yaolin; Tang, Sai

    2015-07-01

    A modified phase-field-crystal (PFC) model is proposed to describe solid-liquid phase transitions by reconstructing the correlation function. The effects of fitting parameters of our modified PFC model on the bcc-liquid phase diagram, numerical stability, and solid-liquid interface properties during planar interface growth are examined carefully. The results indicate that the increase of the correlation function peak width at k =km will enhance the stability of the ordered phase, while the increase of peak height at k =0 will narrow the two-phase coexistence region. The third-order term in the free-energy function and the short wave-length of the correlation function have significant influences on the numerical stability of the PFC model. During planar interface growth, the increase of peak width at k =km will decrease the interface width and the velocity coefficient C , but increase the anisotropy of C and the interface free energy. Finally, the feasibility of the modified phase-field-crystal model is demonstrated with a numerical example of three-dimensional dendritic growth of a body-centered-cubic structure.

  3. Modified phase-field-crystal model for solid-liquid phase transitions.

    PubMed

    Guo, Can; Wang, Jincheng; Wang, Zhijun; Li, Junjie; Guo, Yaolin; Tang, Sai

    2015-07-01

    A modified phase-field-crystal (PFC) model is proposed to describe solid-liquid phase transitions by reconstructing the correlation function. The effects of fitting parameters of our modified PFC model on the bcc-liquid phase diagram, numerical stability, and solid-liquid interface properties during planar interface growth are examined carefully. The results indicate that the increase of the correlation function peak width at k=k(m) will enhance the stability of the ordered phase, while the increase of peak height at k=0 will narrow the two-phase coexistence region. The third-order term in the free-energy function and the short wave-length of the correlation function have significant influences on the numerical stability of the PFC model. During planar interface growth, the increase of peak width at k=k(m) will decrease the interface width and the velocity coefficient C, but increase the anisotropy of C and the interface free energy. Finally, the feasibility of the modified phase-field-crystal model is demonstrated with a numerical example of three-dimensional dendritic growth of a body-centered-cubic structure. PMID:26274309

  4. Field-driven dynamics of microcapillaries filled with nematic liquid crystal

    NASA Astrophysics Data System (ADS)

    Fu, Fred; Khayyatzadeh, Pouya; Abukhdeir, Nasser M.

    Polymer-dispersed liquid crystal (PDLC) composites have long been a focus of study for their unique electro-optical properties and the feasibility of manufacturing them on a large scale, resulting in applications such as switchable windows. LC domains within PDLCs are typically spheroidal, as opposed to rectangular in LCD technology, and thus exhibit substantially different behaviour in the presence of an external field. In this work, continuum simulations were performed in order to capture the complex formation and electric field-driven switching dynamics of approximations of PDLC domains. A simplified elliptic cylinder (microcapillary) geometry is used and the effects of varying aspect ratio, surface anchoring, and external field strength were studied using the Landau-de Gennes model. The observed nematic formation and reorientation dynamics were found to be governed by the presence and motion of defects within the domain. Aspect ratio was found to strongly influence domain texture by providing regions of high curvature to which defects are attracted. Simulations also predict the presence of a geometry-controlled transition from nematic order enhanced by an external field (low aspect ratio) to nematic order frustrated by an external field (high aspect ratio). This work was made possible by the Natural Sciences and Engineering Research Council of Canada and Compute Ontario.

  5. Competition between local disordering and global ordering fields in nematic liquid crystals

    PubMed Central

    Ambrožič, Milan; Kralj, Samo

    2010-01-01

    Summary We study the influence of external electric or magnetic field B on orientational ordering of nematic liquid crystals or of other rod-like objects (e.g. nanotubes immersed in a liquid) in the presence of random anisotropy field type of disorder. The Lebwohl–Lasher lattice type of semi-microscopic approach is used at zero temperature. Therefore, results are valid well below the transition into the isotropic phase. We calculate the correlation function of systems as a function of B, concentration p of impurities imposing random anisotropy field disorder, the disorder strength W and system dimensionality (2D and 3D systems). In order to probe memory effects we calculate correlation length ξ for random and homogeneous initial configurations. We determine the crossover fields B c(p) separating roughly the ordered and disordered regime. Memory effects are apparent only in the latter case, i.e. for B < B c. PACS numbers: 47.51.+a, 47.54.-r, 07.05.Tp, 61.30.-v PMID:20502609

  6. Phase diagrams of mixtures of a polymer and a cholesteric liquid crystal under an external field

    SciTech Connect

    Matsuyama, Akihiko

    2014-11-14

    We present a mean field theory to describe phase behaviors in mixtures of a polymer and a cholesteric liquid crystal under an external magnetic or electric field. Taking into account a chiral coupling between a polymer and a liquid crystal under the external field, we examine twist-untwist phase transitions and phase separations in the mixtures. It is found that a cholesteric-nematic phase transition can be induced by not only the external field but also concentration and temperature. Depending on the strength of the external field, we predict cholesteric-paranematic (Ch+pN), nematic-paranematic (N+pN), cholesteric-nematic (Ch+N) phase separations, etc., on the temperature-concentration plane. We also discuss mixtures of a non-chiral nematic liquid crystal and a chiral dopant.

  7. Terahertz field enhancement via coherent superposition of the pulse sequences after a single optical-rectification crystal

    SciTech Connect

    Sajadi, Mohsen Wolf, Martin; Kampfrath, Tobias

    2014-03-03

    Terahertz electromagnetic pulses are frequently generated by optical rectification of femtosecond laser pulses. In many cases, the efficiency of this process is known to saturate with increasing intensity of the generation beam because of two-photon absorption. Here, we demonstrate two routes to reduce this effect in ZnTe(110) crystals and enhance efficiency, namely, by (i) recycling the generation pulses and by (ii) splitting each generation pulse into two pulses before pumping the crystal. In both methods, the second pulse arrives ∼1 ns after the first one, sufficiently long for optically generated carriers to relax. Enhancement is achieved by coherently superimposing the two resulting terahertz fields.

  8. Ground-state zero-field splitting of Mn 2+ ions in ZnO and CdSe crystals

    NASA Astrophysics Data System (ADS)

    Kuang, Xiao-Yu

    1996-02-01

    ZnO and CdSe crystals have similar hexagonal wurtzite structures with a contraction along the c-axis of the crystal, but contrary electronic fine structures for ZnO:Mn 2+ ( D < 0) and CdSe:Mn 2+ ( D > 0) have been found in EPR experiments. We demonstrate that the ground-state splitting in ZnO:Mn 2+ is due to a trigonal ligand field, whereas the main physical mechanism of the splitting in CdSe:Mn 2+ can be attributed to the combined effect of a slight trigonal distortion and a covalence spin-orbit coupling interaction.

  9. Effect of alignment on a liquid crystal/split-ring resonator metasurface.

    PubMed

    Atorf, Bernhard; Mühlenbernd, Holger; Muldarisnur, Mulda; Zentgraf, Thomas; Kitzerow, Heinz

    2014-05-19

    A metasurface comprising a two-dimensional array of split-ring resonators with resonance frequencies in the near-infrared region is fabricated and embedded in a uniformly aligned liquid crystal. The change of the dielectric permittivity in proximity to the plasmonic structure by the replacement of air with the liquid crystal results in a decrease in resonance frequencies. The resonance shift can be attributed to the interaction of the evanescent field of the excited resonant plasmon modes with the liquid crystal. This shift in resonance frequency is found to depend on the liquid-crystal alignment and to vary for different modes. Also, the resulting effects of changes in temperature or applied external electric field on the metasurface depend on the liquid-crystal alignment and may differ from mode to mode. These observations indicate that the characteristic frequencies of the resonant split-ring resonator modes may depend on different evanescent field components interacting with the liquid crystal. Consequently, certain design rules should be taken into account for the development of tunable metasurfaces based on liquid crystals. PMID:24481628

  10. Magnetic field controlled single crystal growth and surface modification of titanium alloys exposed for biocompatibility

    NASA Astrophysics Data System (ADS)

    Hermann, Regina; Uhlemann, Margitta; Wendrock, Horst; Gerbeth, Gunter; Büchner, Bernd

    2011-03-01

    The aim of this work is growth and characterisation of Ti55Nb45 (wt%) single crystals by floating-zone single crystal growth of intermetallic compounds using two-phase radio-frequency (RF) electromagnetic heating. Thereby, the process and, in particular, the flow field in the molten zone is influenced by additional magnetic fields. The growth of massive intermetallic single crystals is very often unsuccessful due to an unfavourable solid-liquid interface geometry enclosing concave fringes. It is generally known that the crystallization process stability is enhanced if the crystallization interface is convex. For this, a tailored magnetic two-phase stirrer system has been developed, which enables a controlled influence on the melt ranging from intensive inwards to outwards flows. Since Ti is favourably light, strong and biocompatible, it is one of the few materials that naturally match the requirements for implantation in the human body. Therefore, the magnetic system was applied to crystal growth of Ti alloys. The grown crystals were oriented and cut to cubes with the desired crystallographic orientations [1 0 0] and [1 0 1] normally on a plane. The electron backscatter diffraction (EBSD) technique was applied to clearly determine crystal orientation and to localize grain boundaries. The formation of oxidic nanotubes on Ti surfaces in dependence of the grain orientation was investigated, performed electrochemically by anodic oxidation from fluoride containing electrolyte.

  11. Changes in crystal structure and physicochemical properties of potato starch treated by induced electric field.

    PubMed

    Li, Dandan; Yang, Na; Jin, Yamei; Zhou, Yuyi; Xie, Zhengjun; Jin, Zhengyu; Xu, Xueming

    2016-11-20

    The effects of induced electric field (IEF) on the crystal structure and physicochemical properties of potato starch were investigated by subjecting identically treated control and electrically-modified samples to the same temperature history. Additionally, a method of combining IEF with heating for efficient modification of native polymer was also proposed. Results showed that the application of IEF at an electric voltage of 75V has a statistically significant effect on starch gelatinization and pasting properties, especially when combined with heating at 50°C. After treatment by the combination method for 96h, the gelatinization temperatures increased, which can be explained by the slight increase in the ratio of 1044/1015cm(-1) and relative crystallinity. Furthermore, IEF reduced granular swelling and therefore contributed to decreasing the peak, breakdown, and setback viscosity of potato starch. This study explores the potential of IEF as innovative technology for starch modification. PMID:27561526

  12. Effects of Convective Transport of Solute and Impurities on Defect-Causing Kinetics Instabilities in Protein Crystallization

    NASA Technical Reports Server (NTRS)

    Vekilov, Peter G.

    2003-01-01

    Insight into the crystallization processes of biological macromolecules into crystals or aggregates can provide valuable guidelines in many fundamental and applied fields. Such insight will prompt new means to regulate protein phase transitions in-vivo, e.g., polymerization of hemoglobin S in the red cells, crystallization of crystallins in the eye lens, etc. Understanding of protein crystal nucleation will help achieve narrow crystallite size distributions, needed for sustained release of pharmaceutical protein preparations such as insulin or interferon. Traditionally, protein crystallization studies have been related to the pursuit of crystal perfection needed to improve the structure details provided by x-ray, electron or neutron diffraction methods. Crystallization trials for the purposes of structural biology carried out in space have posed an intriguing question related to the inconsistency of the effects of the microgravity growth on the quality of the crystals.

  13. Three-dimensional electric field visualization utilizing electric-field-induced second-harmonic generation in nematic liquid crystals

    NASA Astrophysics Data System (ADS)

    Chen, I.-Hsiu; Chu, Shi-Wei; Bresson, Francois; Tien, Ming-Chun; Shi, Jin-Wei; Sun, Chi-Kuang

    2003-08-01

    An electric-field-induced second-harmonic-generation signal in a nematic liquid crystal is used to map the electric field in an integrated-circuit-like sample. Since the electric-field-induced second-harmonic-generation signal intensity exhibits a strong dependence on the polarization of the incident laser beam, both the amplitude and the orientation of the electric field vectors can be measured. Combined with scanning second-harmonic-generation microscopy, three-dimensional electric field distribution can be easily visualized with high spatial resolution of the order of 1 μm.

  14. Clausius-Mossotti Lorentz-Lorenz relations and retardation effects for two-dimensional crystals

    NASA Astrophysics Data System (ADS)

    Dell'Anna, Luca; Merano, Michele

    2016-05-01

    The macroscopic surface electric susceptibility determines the linear optical properties of an insulating single-layer two-dimensional atomic crystal and can be expressed in terms of the microscopic polarizability of the atoms. We compute the local electric field acting on a single atom, for both the static and the dynamic case, as the superposition of the external applied electric field and the fields generated by the induced dipoles in the crystal. We find that, in the dynamic case, retardation effects dephase the local electric field with respect to the incident one. This explains why the Fresnel coefficients of a single-layer two-dimensional atomic crystal are intrinsically complex quantities, even when a null macroscopic surface conductivity is assumed.

  15. Effect of microgravity on crystallization of ZBLAN fibers

    NASA Technical Reports Server (NTRS)

    Tucker, Dennis S.

    1994-01-01

    ZrF4-BaF2-LaF3-AIF3-NaF (ZBLAN) optical fiber was flown on board the NASA's KC-135 microgravity aircraft to determine the effects of microgravity on crystal growth in this material. Fiber samples were placed in evacuated quartz ampoules and heated to the crystallization temperature in 0g, 1g, and 2g. The 1g and 2g samples were observed to slump and crystallize. The 0g samples showed no evidence of crystallization.

  16. Memory effect in composites of liquid crystal and silica aerosil

    SciTech Connect

    Relaix, Sabrina; Leheny, Robert L.; Reven, Linda; Sutton, Mark

    2012-02-07

    Aerosil silica nanoparticles dispersed in a liquid crystal (LC) possess the interesting property of keeping memory of an electric- or magnetic-field-induced orientation. Two types of memory have been identified: thermally erasable memory arising from the pinning of defect lines versus a 'permanent' memory where the orientation persists even after thermal cycling the samples up to the isotropic phase. To address the source of the latter type of memory, solid-state nuclear magnetic resonance spectroscopy and conventional x-ray diffraction (XRD) were first combined to characterize the LC orientational order as a function of multiple in-field temperature cycles. Microbeam XRD was then performed on aligned gels of different concentrations to gain knowledge of the structural properties at the origin of the memory effect. No detectable anisotropy of the gel or significant breaking of silica strands with heating ruled out the formation of an anisotropic silica network as the source of the permanent memory as previously proposed. Instead, support for a role of the surface memory effect, well known for planar substrates, in stabilizing the permanent memory was deduced from 'training' of the composites, that is, optimizing the orientational order through the thermal in-field cycling. The ability to train the composites is inversely proportional to the strength of the random-field disorder. The portion of thermally erasable memory also decreases as the silica density increases. We propose that the permanent memory originates from the surface memory effect operating at points of intersection in the silica network. These areas, where the LC is strongly confined with conflicted surface interactions, are trained to achieve an optimized orientation and subsequently act as sites from which the LC orientational order regrows after zero-field thermal cycling up to the isotropic phase.

  17. Effect of medicinal plants on the crystallization of cholesterol

    NASA Astrophysics Data System (ADS)

    Saraswathi, N. T.; Gnanam, F. D.

    1997-08-01

    One of the least desirable calcifications in the human body is the mineral deposition in atherosclerosis plaques. These plaques principally consist of lipids such as cholesterol, cholesteryl esters, phospholipids and triglycerides. Chemical analysis of advanced plaques have shown the presence of considerable amounts of free cholesterol identified as cholesterol monohydrate crystals. Cholesterol has been crystallized in vitro. The extracts of some of the Indian medicinal plants detailed below were used as additives to study their effect on the crystallization behaviour of cholesterol. It has been found that many of the herbs have inhibitory effect on the crystallization such as nucleation, crystal size and habit modification. The inhibitory effect of the plants are graded as Commiphora mughul > Aegle marmeleos > Cynoden dactylon > Musa paradisiaca > Polygala javana > Alphinia officinarum > Solanum trilobatum > Enicostemma lyssopifolium.

  18. Dynamically Induced Frustration as a Route to a Quantum Spin Ice State in Tb2Ti2O7 via Virtual Crystal Field Excitations and Quantum Many-Body Effects

    NASA Astrophysics Data System (ADS)

    Molavian, Hamid R.; Gingras, Michel J. P.; Canals, Benjamin

    2007-04-01

    The Tb2Ti2O7 pyrochlore magnetic material is attracting much attention for its spin liquid state, failing to develop long-range order down to 50 mK despite a Curie-Weiss temperature θCW˜-14K. In this Letter we reinvestigate the theoretical description of this material by considering a quantum model of independent tetrahedra to describe its low-temperature properties. The naturally tuned proximity of this system near a Néel to spin ice phase boundary allows for a resurgence of quantum fluctuation effects that lead to an important renormalization of its effective low-energy spin Hamiltonian. As a result, Tb2Ti2O7 is argued to be a quantum spin ice. We put forward an experimental test of this proposal using neutron scattering on a single crystal.

  19. Convective flow effects on protein crystal growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz; Monaco, Lisa A.

    1994-01-01

    The long-term stability of the interferometric setup for the monitoring of protein morphologies has been improved. Growth or dissolution of a crystal on a 100 A scale can now be clearly distinguished from dimensional changes occurring within the optical path of the interferometer. This capability of simultaneously monitoring the local interfacial displacement at several widely-spaced positions on the crystal surface with high local depth resolution, has already yielded novel results. We found with lysozyme that (1) the normal growth rate is oscillatory, and (2) the mean growth step density is greater at the periphery of a facet than in its center. The repartitioning of Na(+) and Cl(-) ions between lysozyme solutions and crystals was studied for a wide range of crystallization conditions. A nucleation-growth-repartitioning model was developed to interpret the large body of data in a unified way. The results strongly suggests that (1) the ion to lysozyme ratio in the crystal depends mostly on kinetic rather than crystallographic parameters, and (2) lysozyme crystals possess a salt-rich core with a diameter on the order of 10 microns. The computational model for diffusive-convective transport in protein crystallization (see the First Report) has been applied to a realistic growth cell geometry, taking into account the findings of the above repartitioning studies. These results show that some elements of a moving boundary problem must be incorporated into the model in order to obtain a more realistic description. Our experimental setup for light scattering investigations of aggregation and nucleation in protein solutions has been extensively tested. Scattering intensity measurements with a true Rayleigh scatterer produced systematically increased forward scattering, indicating problems with glare. These have been resolved. Preliminary measurements with supersaturated lysozyme solutions revealed that the scatterers grow with time. Work has begun on a computer program

  20. Study of Fluid Flow Control In Protein Crystallization Using Strong Magnetic Fields

    NASA Technical Reports Server (NTRS)

    Ramachandran, N.; Leslie, F.; Ciszak, E.; Curreri, Peter A. (Technical Monitor)

    2002-01-01

    An important component in biotechnology, particularly in the area of protein engineering and rational drug design is the knowledge of the precise three-dimensional molecular structure of proteins. The quality of structural information obtained from X-ray diffraction methods is directly dependent on the degree of perfection of the protein crystals. As a consequence, the growth of high quality macromolecular crystals for diffraction analyses has been the central focus for biochemists, biologists, and bioengineers. Macromolecular crystals are obtained from solutions that contain the crystallizing species in equilibrium with higher aggregates, ions, precipitants, other possible phases of the protein, foreign particles, the walls of the container, and a likely host of other impurities. By changing transport modes in general, i.e., reduction of convection and sedimentation, as is achieved in 'microgravity', researchers have been able to dramatically affect the movement and distribution of macromolecules in the fluid, and thus their transport, formation of crystal nuclei, and adsorption to the crystal surface. While a limited number of high quality crystals from space flights have been obtained, as the recent National Research Council (NRC) review of the NASA microgravity crystallization program pointed out, the scientific approach and research in crystallization of proteins has been mainly empirical yielding inconclusive results. We postulate that we can reduce convection in ground-based experiments and we can understand the different aspects of convection control through the use of strong magnetic fields and field gradients. Whether this limited convection in a magnetic field will provide the environment for the growth of high quality crystals is still a matter of conjecture that our research will address. The approach exploits the variation of fluid magnetic susceptibility with concentration for this purpose and the convective damping is realized by appropriately

  1. Phase field modelling of strain induced crystal growth in an elastic matrix.

    PubMed

    Laghmach, Rabia; Candau, Nicolas; Chazeau, Laurent; Munch, Etienne; Biben, Thierry

    2015-06-28

    When a crystal phase grows in an amorphous matrix, such as a crystallisable elastomer, containing cross-links and/or entanglements, these "topological constraints" need to be pushed away from the crystal phase to allow further crystallization. The accumulation of these topological constraints in the vicinity of the crystal interface may store elastic energy and affect the phase transition. To evaluate the consequences of such mechanism, we introduce a phase field model based on the Flory theory of entropic elasticity. We show that the growth process is indeed sensibly affected, in particular, an exponential increase of the surface energy with the displacement of the interface is induced. This explains the formation of stable nano-crystallites as it is observed in the Strain Induced Crystallization (SIC) of natural rubber. Although simple, the model developed here is able to account for many interesting features of SIC, for instance, the crystallite shapes and their sizes which depend on the applied deformation. PMID:26133455

  2. Phase field modelling of strain induced crystal growth in an elastic matrix

    NASA Astrophysics Data System (ADS)

    Laghmach, Rabia; Candau, Nicolas; Chazeau, Laurent; Munch, Etienne; Biben, Thierry

    2015-06-01

    When a crystal phase grows in an amorphous matrix, such as a crystallisable elastomer, containing cross-links and/or entanglements, these "topological constraints" need to be pushed away from the crystal phase to allow further crystallization. The accumulation of these topological constraints in the vicinity of the crystal interface may store elastic energy and affect the phase transition. To evaluate the consequences of such mechanism, we introduce a phase field model based on the Flory theory of entropic elasticity. We show that the growth process is indeed sensibly affected, in particular, an exponential increase of the surface energy with the displacement of the interface is induced. This explains the formation of stable nano-crystallites as it is observed in the Strain Induced Crystallization (SIC) of natural rubber. Although simple, the model developed here is able to account for many interesting features of SIC, for instance, the crystallite shapes and their sizes which depend on the applied deformation.

  3. Effect of the Surface Affinity of Liquid Crystals and Monomers on the Orientation of Polymer-Dispersed Liquid Crystal

    NASA Astrophysics Data System (ADS)

    Lee, Ji-Hoon; Yoon, Tae-Hoon

    2013-09-01

    We investigated the effect of the surface affinity of liquid crystals and reactive monomers on liquid crystal orientation. Liquid crystals and monomers having different contact angles with the vertical alignment polyimide were mixed and photo-polymerized using a UV light. Liquid crystals with smaller contact angles and reactive monomers with greater contact angles promoted a uniform vertical orientation of liquid crystals with a vertical polymer morphology. On the other hand, liquid crystals with greater contact angles and monomers with smaller contact angles resulted in a deformed liquid crystal orientation with an elliptical polymer structure.

  4. Appearance of singularities of optical fields under torsion of crystals containing threefold symmetry axes.

    PubMed

    Skab, Ihor; Vasylkiv, Yurij; Zapeka, Bohdan; Savaryn, Viktoriya; Vlokh, Rostyslav

    2011-07-01

    We present an analysis of the effect of torsion stresses on the spatial distribution of optical birefringence in crystals of different point symmetry groups. The symmetry requirements needed so that the optical beam carries dislocations of the phase front are evaluated for the case when the crystals are twisted and the beam closely corresponds to a plane wave. It is shown that the torsion stresses can produce screw-edge, pure screw, or pure edge dislocations of the phase front in the crystals belonging to cubic and trigonal systems. The conditions for appearance of canonical and noncanonical vortices in the conditions of crystal torsion are analyzed. PMID:21734730

  5. Multilayer thin film growth on crystalline and quasicrystalline surfaces: A phase-field crystal study

    NASA Astrophysics Data System (ADS)

    Muralidharan, Srevatsan; Khodadad, Raika; Sullivan, Ethan; Haataja, Mikko

    2012-06-01

    In this paper, we explore the effects of misfit strain fields on both heterogeneous nucleation behavior and anisotropic growth of islands at submonolayer coverages and compositional patterning at complete monolayer coverage via simulations of a phase-field crystal model. In particular, deposition on top of a herringbone structure and quasicrystalline (QC) substrate are considered, the former representing a system with spatially periodic misfit strain fields arising from the presence of surface dislocations, and the latter representing a system which inherently possesses a wide range of local, aperiodic misfit patterns. In the case of single-component systems, we demonstrate that misfit strain fields lead to heterogeneous nucleation behavior and anisotropic island growth. In the case of QC substrate, a wide range of morphologies, such as coexistence of locally hexagonally ordered atomic clusters within a larger scale arrangement with overall QC symmetry and so-called “starfish” aggregates, is observed in a pure system at submonolayer coverages when the adlayer-substrate interaction strength and lattice mismatch are tuned. In the case of bulk-immiscible binary systems at complete monolayer coverage, strain-stabilized compositional domains emerge at low line tension values for both substrates. Interestingly, the compositional domains on the QC substrate inherit their symmetries at sufficiently low line tension values, while at larger line tension values, the domain structure begins to resemble the classical spinodal microstructure. Such domain structures should be readily observable in colloidal systems in which attractive interparticle and particle-substrate interactions can be tuned.

  6. Magnetic behavior and crystal field of Dy(BrO3)3.9H2O

    NASA Astrophysics Data System (ADS)

    Neogy, D.; Purohit, T.

    1987-04-01

    Magnetic susceptibility measurements have been made on dysprosium bromate enneahydrate crystals from room temperature down to 90 K. An analysis of our observed data and the magnetic measurements on the crystal below liquid-He temperatures by Simizu, Bellesis, and Friedberg [in 2 Proceedings of the 17th International Conference on Low Temperature Physics, Karlsruhe, Germany, 1984, edited by U. Eckern, A. Schmid, W. Weber, and H. Wühl (North-Holland, Amsterdam, 1984), p.187; J. Appl. Phys. 55, 2333 (1984)] using a superconducting quantum-interference device magnetometer, was undertaken for the first time invoking an effective electrostatic interaction of the Dy3+ ion with its diamagnetic neighbors. Expressions giving magnetic susceptibilities between 300 and 1 K were obtained taking into account the crystal field J-J mixing and the intermediate-coupling effects. The interpretation of the magnetic data is very good down to ~1 K, below which the effects of the dipolar interaction take over, leading to the onset of ferromagnetism at 170 mK. Available information from heat-capacity and optical-absorption measurements is also explained. The influence of the crystal field on the thermal variation of the Mössbauer spectra, and hyperfine heat capacity CN for the two isotopes 161Dy and 163Dy is discussed.

  7. Effects of operating conditions on agglomeration and habit of paracetamol crystals in anti-solvent crystallization

    NASA Astrophysics Data System (ADS)

    Yu, Z. Q.; Tan, R. B. H.; Chow, P. S.

    2005-06-01

    Effects of agitation speed and feeding rate on agglomeration and habit of paracetamol crystals in anti-solvent crystallization from water-acetone mixture are reported. Water is used as anti-solvent and is added in a semi-batch manner to a baffled 1-l crystallizer equipped with a marine-type impeller. A simple new method to characterize agglomeration degree has been proposed. Results show that agglomeration degree of crystals depends on particle size and elevated agitation reduces agglomeration degree of big particles. Particle mean size exhibits a maximum with increasing agitation intensity in the range of 200-600 rpm, which is explained from the perspective of anti-solvent dispersion and crystal agglomeration/disruption. Agglomeration degree of products deteriorates with increasing feeding rate ranging from 1 to 20 g/min due to enhanced nucleation. Crystal habit changes when feeding rate is altered, mainly in the faces of [0 0 1] and [1 1 0]. Focused beam reflectance measurement (FBRM) was used to monitor indirectly the particle size distribution in situ. The data demonstrated that FBRM may potentially be used as a tool to control crystallization process.

  8. Far-field detection system for laser beam and crystal alignment

    NASA Astrophysics Data System (ADS)

    Zhang, Jiachen; Liu, Daizhong; Zhu, Baoqiang; Tang, Shunxing; Gao, Yanqi

    2016-03-01

    Laser beam far-field alignment as well as frequency-doubling and frequency-tripling crystal adjustment is very important for high-power laser facility. Separate systems for beam and crystal alignment are generally used while the proposed approach by off-axial grating sampling share common optics for these two functions, reducing both space and cost requirements. This detection system has been demonstrated on the National Laser Facility of Israel. The experimental results indicate that the average far-field alignment error is <5% of the spatial filter pinhole diameter, average autocollimation angle error of crystals is <10 μrad, and average frequency-tripling conversion efficiency is 69.3%, which meet the alignment system requirements on the beam direction and crystals.

  9. Effect of gamma ray irradiation on sodium borate single crystals

    NASA Astrophysics Data System (ADS)

    Kalidasan, M.; Asokan, K.; Baskar, K.; Dhanasekaran, R.

    2015-12-01

    In this work, the effects of 5 kGy, 10 kGy and 20 kGy doses of gamma ray irradiation on sodium borate, Na2[B4O5(OH)4]·(H2O)8 single crystals have been studied. Initially these crystals were grown by solution growth technique and identified as monoclinic using X-ray diffraction analysis. X-ray rocking curves confirm the formation of crystalline defects due to gamma rays in sodium borate single crystals. The electron paramagnetic resonance spectra have been recorded to identify the radicals created due to gamma ray irradiation in sodium borate single crystals. The thermoluminescence glow curves due to the defects created by gamma rays in this crystal have been observed and their kinetic parameters were calculated using Chen's peak shape method. The optical absorption increases and photoluminescence spectral intensity decreases for 5 kGy and 20 kGy doses gamma ray irradiated crystals compared to pristine and 10 kGy dose irradiated one. The effect of various doses of gamma rays on vibrational modes of the sodium borate single crystals was studied using FT-Raman and ATR-FTIR spectral analysis. The dielectric permittivity, conductance and dielectric loss versus frequency graphs of these crystals have been analyzed to know the effect of gamma ray irradiation on these parameters.

  10. X-ray dynamical diffraction from single crystals with arbitrary shape and strain field: A universal approach to modeling

    NASA Astrophysics Data System (ADS)

    Yan, Hanfei; Li, Li

    2014-01-01

    The effects of dynamical diffraction in single crystals engender many unique diffraction phenomena that cannot be interpreted by the kinematical-diffraction theory, yet knowledge of them is vital to resolving a vast variety of scientific problems ranging from crystal optics to strain measurements in crystalline specimens. Although the fundamental dynamical-diffraction theory was established decades ago, modeling it remains a challenge in a general case wherein the crystal has complex boundaries and mixed diffraction geometries (Bragg or Laue). Here, we propose a universal approach for modeling x-ray dynamical diffraction from a single crystal with arbitrary shape and strain field that is based on the integral representation of the Takagi-Taupin equations. Using it, we can construct the solution iteratively via a converging series, independent of the diffraction geometry. Moreover, the integral equations offer additional insights into the diffraction physics that are not readily apparent in its differential counterparts. To demonstrate this approach, we studied the dynamical diffraction from a slab of single crystal with both Bragg and Laue diffraction excited on the entrance boundaries, a problem that is difficult to model by other methods. We also explored the mirage effect caused by the presence of a linear strain field and compared it to the Eikonal theory. Lastly, we derived a dynamical-diffraction equation correlating the structural properties of a particle to its far-field Bragg-diffraction pattern, shedding light on how dynamical diffraction affects these kinematical-diffraction-based inverse techniques for reconstructing the shape and the strain field.

  11. Convective flow effects on protein crystal growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz

    1995-01-01

    During the fifth semi-annual period under this grant we have pursued the following activities: (1) Characterization of the purity and further purification of lysozyme solutions, these efforts are summarized in Section 2; (2) Crystal growth morphology and kinetics studies with tetragonal lysozyme, our observation on the dependence of lysozyme growth kinetics on step sources and impurities has been summarized in a manuscript which was accepted for publication in the Journal of Crystal Growth; (3) Numerical modelling of the interaction between bulk transport and interface kinetics, for a detailed summary of this work see the manuscript which was accepted for publication in the Journal of Crystal Growth; and (4) Light scattering studies, this work has been summarized in a manuscript that has been submitted for publication to the Journal of Chemical Physics.

  12. A Lattice-Strained Organic Single-Crystal Nanowire Array Fabricated via Solution-Phase Nanograting-Assisted Pattern Transfer for Use in High-Mobility Organic Field-Effect Transistors.

    PubMed

    Kim, Kyunghun; Rho, Yecheol; Kim, Yebyeol; Kim, Se Hyun; Hahm, Suk Gyu; Park, Chan Eon

    2016-04-01

    A 50 nm-wide 6,13-bis(triisopropylsilylethynyl) pentacene nanowire (NW) array is fabricated on a centimeter-sized substrate via a facile nanograting-assisted pattern-transfer method. NW growth under a nanoconfined space adopts a lattice-strained packing motif of the NWs for strong intermolecular electronic coupling, and thus a NW-based organic field-effect transistor shows high field-effect mobility up to 9.71 cm(2) V(-1) s(-1) . PMID:26915597

  13. Nanowires: A Lattice-Strained Organic Single-Crystal Nanowire Array Fabricated via Solution-Phase Nanograting-Assisted Pattern Transfer for Use in High-Mobility Organic Field-Effect Transistors (Adv. Mater. 16/2016).

    PubMed

    Kim, Kyunghun; Rho, Yecheol; Kim, Yebyeol; Kim, Se Hyun; Hahm, Suk Gyu; Park, Chan Eon

    2016-04-01

    S. H. Kim, S. G. Hahm, C. E. Park, and co-workers fabricate a 50 nm-wide organic single-crystalline nanowire array on a centimeter-sized substrate via a facile roll-to-plate process, as described on page 3209. Nanowire growth in a nano-confined space adopts a lattice-strained and single-crystalline packing motif, which can be harnessed for strong intermolecular electronic coupling. Thus, nanowire-based field-effect transistors show extremely high field-effect mobilities up to 9.71 cm(2) V(-1) s(-1) . PMID:27105809

  14. Growth, spectral property and crystal field analysis of Cr3+-doped Na2Mg5(MoO4)6 crystal

    NASA Astrophysics Data System (ADS)

    Zhang, Lizhen; Li, Linyun; Huang, Yisheng; Sun, Shijia; Lin, Zhoubin; Wang, Guofu

    2015-11-01

    This paper reports the growth and spectral properties of Cr3+:Na2Mg5(MoO4)6 crystals. The Na2Mg5(MoO4)6 crystal was grown from a flux of Na2Mo2O7 by the top seeded solution growth method. The absorption cross-sections are 0.692 × 10-19 cm2 at 507 nm and 1.151 × 10-19 cm2 at 736 nm, respectively. The emission cross-section is 1.62 × 10-19 cm2 at 914 nm with FWHM of 192 nm. Based on the absorption and emission spectra, the crystal field strength Dq, the Racah parameters B and C, effective phonon energy ℏω and the Huang-Rhys factor S were calculated. The spectral properties of Cr3+:Na2Mg5(MoO4)6 crystal demonstrate a good potential for tunable laser material.

  15. Convective flow effects on protein crystal growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz; Monaco, Lisa A.

    1994-01-01

    A high-resolution microscopic interferometric setup for the monitoring of protein morphologies has been developed. Growth or dissolution of a crystal can be resolved with a long-term depth resolution of 200 A and a lateral resolution of 2 microns. This capability of simultaneously monitoring the interfacial displacement with high local depth resolution has yielded several novel results. We have found with lysozyme that (1) the normal growth rate is oscillatory, and (2) depending on the impurity content of the solution, the growth step density is either greater or lower at the periphery of a facet than in its center. The repartitioning of Na plus and Cl minus ions between lysozyme solutions and crystals was studied for a wide range of crystallization conditions. A nucleation-growth-repartitioning model was developed, to interpret the large body of data in unified way. The results strongly suggest that (1) the ion to lysozyne ratio in the crystal depends mostly on kinetic rather than crystallographic parameters, and (2) lysozyme crystals possess a salt-rich core with a diameter electron microscopy results appear to confirm this finding, which could have far-reaching consequences for x-ray diffraction studies. A computational model for diffusive-convective transport in protein crystallization has been applied to a realistic growth cell geometry, taking into account the findings of the above repartitioning studies and our kinetics data for the growth of lysozyme. The results show that even in the small cell employed, protein concentration nonuniformities and gravity-driven solutal convection can be significant. The calculated convection velocities are of the same order to magnitude as those found in earlier experiments. As expected, convective transport, i.e., at Og, lysozyme crystal growth remains kinetically limited. The salt distribution in the crystal is predicted to be non-uniform at both 1g and 0g, as a consequence of protein depletion in the solution. Static and

  16. Separating different contributions to the crystal-field parameters using Wannier functions.

    PubMed

    Scaramucci, A; Ammann, J; Spaldin, N A; Ederer, C

    2015-05-01

    We discuss the calculation of crystal-field splittings using Wannier functions and show how contributions to the crystal-field splitting that are due to hybridization with different ligand states can be separated from the bare Coulomb contribution by constructing sets of Wannier functions incorporating different levels of hybridization. We demonstrate this method using SrVO3 as a generic example of a transition metal oxide. We then calculate trends in the crystal-field splitting for two series of hypothetical tetragonally distorted perovskite oxides and discuss the relation between the calculated 'electrostatic' contribution to the crystal field and the simple point charge model. Finally, we apply our method to the charge disproportionated 5d electron system CsAuCl3. The proposed procedure elucidates the way in which the negative charge transfer energy in this material leads to a reversal of the p-d ligand contribution to the crystal-field splitting such that the eg states of the nominally Au(3+) cation are energetically lower than the corresponding t2g states. PMID:25872527

  17. Spectroscopic characterisation and crystal field calculations of varicoloured kyanites from Loliondo, Tanzania

    NASA Astrophysics Data System (ADS)

    Wildner, Manfred; Beran, Anton; Koller, Friedrich

    2013-04-01

    Orange, ochre-coloured, light green and dark blue varieties of kyanite, ideally Al2SiO5, from Loliondo, Tanzania, have been characterised by electron microprobe analysis and polarised infrared and optical absorption spectroscopy. All colour varieties show elevated Fe contents of 0.39 to 1.31 wt.% FeO, but Ti contents only in the range of the EMP detection limit. Orange and ochre-coloured crystals have Mn contents of 0.23 and 0.06 wt.% MnO, respectively, the dark blue kyanite contains 0.28 wt.% Cr2O3, while the light green sample is nearly free from transition metal cations other than Fe. Polarised infrared spectra reveal OH defect concentrations of 3 to 17 wt.ppm H2O with structural OH defects partially replacing the OB (O2) oxygen atoms. Polarised optical absorption spectra show that the colour of all four varieties is governed by crystal field d-d transitions of trivalent cations, i.e. Fe3+ (all samples), Mn3+ (orange and ochre) and Cr3+ (blue kyanite), replacing Al in sixfold coordinated triclinic sites of the kyanite structure. Intervalence charge transfer, the prevalent colour-inducing mechanism in `usual' (Cr-poor) blue kyanites, seems to play a very minor, if any, role in the present samples. Crystal field calculations in both a `classic' tetragonal and in the semiempirical Superposition Model approach, accompanied by distance- and angle-least-squares refinements, indicate that Fe3+ preferably occupies the Al4 site, Cr3+ prefers the Al1 and Al2 sites, and Mn3+ predominantly enters the Al1 site. In each case specific local relaxation effects were observed according to the crystal chemical preferences of these transition metal cations. Furthermore, the high values obtained in the calculations for the interelectronic repulsion parameter Racah B correspond to a high ionic contribution to Me3+-O bonding in the kyanite structure. In the particular case of the blue sample, band positions specifically related to the high Racah B value enable this `unusual' type of

  18. Internal bias field in triglycine sulphate crystals with L-, α-alanine grown at negative temperatures

    NASA Astrophysics Data System (ADS)

    Milovidova, S. D.; Rogazinskaya, O. V.; Sidorkin, A. S.; Ionova, E. V.; Kirichenko, A. P.; Bavykin, S. A.

    2010-09-01

    The dielectric and pyroelectric properties of triglycine sulphate (TGS) crystals with L, α-alanine impurities grown at negative temperatures have been investigated. It is shown that a lower impurity concentration (2 mol % in solution) in this temperature range leads to the formation of internal bias fields of the same order of magnitude (˜800 V/cm) as for TGS crystals grown at T ⩽ 50°C but with an L, α-alanine concentration of 20 mol % in solution.

  19. Nonlinear optical tuning of photonic crystal microcavities by near-field probe

    SciTech Connect

    Vignolini, Silvia; Zani, Margherita; Riboli, Francesco; Vinattieri, Anna; Wiersma, Diederik S.; Gurioli, Massimo; Intonti, Francesca; Balet, Laurent; Li, Lianhe; Colocci, Marcello; Francardi, Marco; Gerardino, Annamaria; Fiore, Andrea

    2008-07-14

    We report on a nonlinear way to control and tune the dielectric environment of photonic crystal microcavities exploiting the local heating induced by near-field laser excitation at different excitation powers. The temperature gradient due to the optical absorption results in an index of refraction gradient which modifies the dielectric surroundings of the cavity and shifts the optical modes. Reversible tuning can be obtained either by changing the excitation power density or by exciting in different points of the photonic crystal microcavity.

  20. Role of the crystal field stabilization energy in the formation of metal(II) formate mixed crystals

    NASA Astrophysics Data System (ADS)

    Balarew, Christo; Stoilova, Donka; Vassileva, Violeta

    A relationship between the distribution coefficient values and the factors determining the isomorphous substitution of some metal(II) formates (Mg, Mn, Fe, Co, Ni, Cu, Zn, Cd) has been found, given by D=[exp⁡{aṡf[ΔR/R]+bṡϕ(Δɛ)+cṡψ(Δs)}/{RT}, where Δ R/R is the relative difference in the ionic radii of the intersubstituting ions, Δɛ is the difference in the Me sbnd O bond energy, Δ s is the difference in the crystal field stabilization energy. The pre-exponential term represents the balance in bonding factors between the ions in the crystal and in the aqueous solution, in the case of ideally mixing in the solid state. The exponential term takes into account the enthalpy of mixing in the solid state. For the isostructural formate salts in which the substitution of a given cation by another one occurs in equivalent octahedral positions, the difference in the crystal field stabilization energy exerts the most important influence on the enthalpy of mixing.

  1. Solidification behavior of high-density polyethylene (HDPE) during injection molding: Correlation between crystallization kinetics and thermal gradient field

    NASA Astrophysics Data System (ADS)

    Yang, Bin; Deng, Yan-Li; Li, Gui-Jing; Miao, Ji-Bin; Xia, Ru; Qian, Jia-Sheng; Chen, Peng; Liu, Jing-Wang

    2015-07-01

    This work mainly investigated the effect of thermal field on the crystallization kinetics of high-density polyethylene (HDPE) during injection molding (IM) process. The thickness X = 0.4 was found to be a crucial location heavily influenced by thermal conduction. The temperature decay tended to be stable, with limited variation of the crystallization rate when X > 0.4. It was observed that the crystallization rate was in good proportion to the cooling rate (ϕ). Our experimental finding showed that the consequence of relative crystallinity (χ) was in agreement with that of the secondary temperature difference (STD). This study is practically significant to the further investigation on the relationship among “processing-structure-property” of polymeric materials.

  2. Far-Field Patterns from Dye-Doped Planar-Aligned Nematic Liquid Crystals Under nanosecond Laser Irradiation

    SciTech Connect

    Lukishova, S.G.; Lepeshkin, N.; Boyd, R.W.; Marshall, K.L.

    2006-08-18

    High-definition patterns were observed under 10-Hz-pulse-repetition-rate, nanosecond laser irradiation of azodye-doped planar-nematic liquid crystal layers at incident intensities I ~ 5-10 MW/cm^2 in a single beam configuration and without any feedback involved. An incident polarization parallel to the nematic director was used. Under periodic pulsed laser irradiation, far-field beam patterns at the output of a dye-doped liquid crystal layer changed kaleidoscopically from rings and stripes to multiple hexagons. This pattern-formation regime had a buildup time of several seconds to minutes. We explain the observed effect by diffraction of the laser beam on light-induced micrometer-size inhomogeneities inside the liquid crystal layer with absorption and refraction properties different from the surrounding area. Possible mechanisms of the formation of the inhomogeneities are discussed.

  3. Liquid Crystal Switching Response by Localized Surface Plasmon Induced Electric Fields

    NASA Astrophysics Data System (ADS)

    Nuno, Zachary; Hirst, Linda; Ghosh, Sayantani

    2013-03-01

    We investigate the effect of electric fields induced by localized surface plasmons (LSPs) from gold nanoparticles (AuNPs) on the director of a nematic liquid crystal (LC). We deposit LC thin films on a self-assembled AuNP layer and excite the LSPs in the AuNPs using 530 nm excitation light. Using polarized optical microscopy we follow the birefringence of the LC film as the excitation is turned on and off and observe the homeotropic alignment of the LC change to planar. This realignment response is observed to be dependent on the excitation wavelength, excitation power, and temperature; occurring only within 1 degree Celsius of the LC phase transition from nematic to isotropic. This work was funded by UC Merced GRC Summer Fellowship.

  4. Atomic density functional and diagram of structures in the phase field crystal model

    NASA Astrophysics Data System (ADS)

    Ankudinov, V. E.; Galenko, P. K.; Kropotin, N. V.; Krivilyov, M. D.

    2016-02-01

    The phase field crystal model provides a continual description of the atomic density over the diffusion time of reactions. We consider a homogeneous structure (liquid) and a perfect periodic crystal, which are constructed from the one-mode approximation of the phase field crystal model. A diagram of 2D structures is constructed from the analytic solutions of the model using atomic density functionals. The diagram predicts equilibrium atomic configurations for transitions from the metastable state and includes the domains of existence of homogeneous, triangular, and striped structures corresponding to a liquid, a body-centered cubic crystal, and a longitudinal cross section of cylindrical tubes. The method developed here is employed for constructing the diagram for the homogeneous liquid phase and the body-centered iron lattice. The expression for the free energy is derived analytically from density functional theory. The specific features of approximating the phase field crystal model are compared with the approximations and conclusions of the weak crystallization and 2D melting theories.

  5. Giant Magnetic Field-induced Phase Transitions in Dimeric Liquid Crystals

    NASA Astrophysics Data System (ADS)

    Salili, Seyyed Muhammad; Salamonczyk, Miroslaw; Tamba, Maria-Gabriela; Sprunt, Samuel; Mehl, Georg; Jakli, Antal; Gleeson, James; Kent Group Collaboration; Hull Group Collaboration

    Liquid crystals are responsive to external fields such as electric, magnetic fields. The first experimental observation of dependence of isotropic to nematic phase transition on the applied magnetic field was done using a strong magnetic field on bent-core nematogens and the phase transition temperature exhibited an upshift of 0.7 C at B =30 T. We report on measurements of giant magnetic field-induced isotropic-nematic transition of chainsticks (nunchuks) type dimeric liquid crystals. Upon using the B =25 T split-helix resistive solenoid magnet at NHMFL, we have observed up to 18 C upshift of the isotropic to nematic phase transition temperature at B =22T. We discuss the results within the context of differential thermodynamic potential and the two basic mean-field theories. To our knowledge, this is the first observation of such huge shifts in the phase transitions of thermotropic liquid ctystals

  6. Semiconductor crystal growth in crossed electric and magnetic fields: Center Director's Discretionary Fund

    NASA Technical Reports Server (NTRS)

    Mazuruk, K.; Volz, M. P.

    1996-01-01

    A unique growth cell was designed in which crossed electric and magnetic fields could be separately or simultaneously applied during semiconductor crystal growth. A thermocouple was inserted into an InSb melt inside the growth cell to examine the temperature response of the fluid to applied electromagnetic fields. A static magnetic field suppressed time-dependent convection when a destabilizing thermal field was applied. The simultaneous application of electric and magnetic fields resulted in forced convection in the melt. The InSb ingots grown in the cell were polycrystalline. An InGaSb crystal, 0.5 cm in diameter and 23-cm long, was grown without electromagnetic fields applied. The axial composition results indicated that complete mixing in the melt occurred for this large aspect ratio.

  7. Anisotropic magnetic behavior of PrAg2Ge2—a crystal field study

    NASA Astrophysics Data System (ADS)

    Chatterji, A.; Chatterjee, Tania; Mitra, S.

    2012-02-01

    A crystal field (CF) analysis of the experimental, single crystal magnetic susceptibility data (300-1.8 K) along and perpendicular to the [0 0 1] axis, of the Ag based rare earth intermetallic compound PrAg 2Ge 2, has been carried out for the first time, thus yielding first reliable set of CF parameters for the system. The susceptibility feature at 12 K is possibly due to CF effects rather than the magnetic order as proposed earlier. This removes the issue of the transition temperature being too large to scale properly with the de Gennes factor. We have used the set of CF parameters to find the Stark energies of the ground state and the excited states together with their corresponding eigenvectors, and the thermal variation of the magnetic specific heat. Possible explanation of the absence of magnetic ordering of the Pr sublattice and the nature of variation of the CF parameters with the substitution of transition-metal ion in PrAg 2Ge 2 is studied and discussed in relation to PrAu 2Ge 2. All computations have been carried out using the intermediate coupling scheme including the J-mixing.

  8. A Monte Carlo study of the Blume-Capel thin film in the presence of a random crystal field

    NASA Astrophysics Data System (ADS)

    Boughrara, M.; Kerouad, M.; Zaim, A.

    2016-07-01

    A Monte Carlo simulation with heat bath algorithm is used to study the effect of random crystal field and surface exchange interactions on the critical behavior and the magnetic properties of a spin-1 Ising ferromagnetic thin film having the simple cubic symmetry. The phase diagram exhibits a rich variety of behaviors such as the double reentrant phenomena and the existence of tricritical points. Thermal magnetization behavior and phase diagrams have been discussed in detail.

  9. Self-action of a light beam in nematic liquid crystals in the presence of a DC electric field

    SciTech Connect

    Budagovsky, I. A.; Zolot'ko, A. S. Smayev, M. P.; Barnik, M. I.

    2010-07-15

    The results of experimental study of the light beam self-action in a nematic liquid crystal placed in a dc electric field are presented, and a theory of this effect is developed. This self-action of a light beam is shown to cause a hyperbolic umbilic caustic. The intensity distribution and caustics calculated in the far diffraction zone of the light beam agree well with the experimental data.

  10. Molecular dynamics simulation of the nematic liquid crystal phase in the presence of an intense magnetic field.

    PubMed

    Satoh, Katsuhiko

    2006-04-14

    The influence of an intense external field on the dynamics of the nematic liquid crystal phase is investigated using a molecular dynamics simulation for the Gay-Berne nematogen under isobaric-isothermal conditions. The molecular dynamics as a function of the second-rank orientational order parameter P<2> for a system consisting of a nematic liquid crystal in the presence of an intense magnetic field is compared with that of a similar system without the field. The translational motion of molecules is determined as a function of the translational diffusion coefficient tensor and the anisotropy and compared with the values predicted theoretically. The rotational dynamics of molecules is analyzed using the first- and the second-rank orientational time correlation functions. The translational diffusion coefficient parallel with respect to the director is constrained by the intense field, although the perpendicular one is decreased as the P<2> is increased, just as it is in the system without the field. However, no essential effect of the strong magnetic field is observed in the rotational molecular dynamics. Further, the rotational diffusion coefficient parallel with respect to the director obtained from the first-rank orientational time correlation function in the simulation is qualitatively in agreement with that in the real nematic liquid crystalline molecules. The P<2> dependence of the rotational diffusion coefficient for the system with the intense magnetic field shows a tendency similar to that for the system without the field. PMID:16626239

  11. Molecular dynamics simulation of the nematic liquid crystal phase in the presence of an intense magnetic field

    NASA Astrophysics Data System (ADS)

    Satoh, Katsuhiko

    2006-04-01

    The influence of an intense external field on the dynamics of the nematic liquid crystal phase is investigated using a molecular dynamics simulation for the Gay-Berne nematogen under isobaric-isothermal conditions. The molecular dynamics as a function of the second-rank orientational order parameter ⟨P2⟩ for a system consisting of a nematic liquid crystal in the presence of an intense magnetic field is compared with that of a similar system without the field. The translational motion of molecules is determined as a function of the translational diffusion coefficient tensor and the anisotropy and compared with the values predicted theoretically. The rotational dynamics of molecules is analyzed using the first- and the second-rank orientational time correlation functions. The translational diffusion coefficient parallel with respect to the director is constrained by the intense field, although the perpendicular one is decreased as the ⟨P2⟩ is increased, just as it is in the system without the field. However, no essential effect of the strong magnetic field is observed in the rotational molecular dynamics. Further, the rotational diffusion coefficient parallel with respect to the director obtained from the first-rank orientational time correlation function in the simulation is qualitatively in agreement with that in the real nematic liquid crystalline molecules. The ⟨P2⟩ dependence of the rotational diffusion coefficient for the system with the intense magnetic field shows a tendency similar to that for the system without the field.

  12. Control of Convection by Dynamic Magnetic Fields for VB, FZ and THM Crystal Growth Application

    NASA Technical Reports Server (NTRS)

    Mazuruk, Konstantin

    2000-01-01

    The Traveling Magnetic Field (TMF) technique, recently proposed to control meridional flow in electrically conducting melts is reviewed. In particular, the natural convection damping capability of this technique has been numerically demonstrated with the implication of significantly improving crystal quality. Advantages of the traveling magnetic field, in comparison to the more mature rotating magnetic field method, are discussed. Finally, a detailed one-dimensional planar TMF model has been developed and is presented.

  13. Experimental observation of effects of seeds on polymer crystallization

    NASA Astrophysics Data System (ADS)

    Zhu, Peng-Wei; Phillips, Andy; Edward, Graham; Nichols, Lance

    2009-11-01

    The effects of two seeds on the melt crystallization of isotactic polypropylene were experimentally investigated. The seed, which has the flat surface full of a nonuniform size distribution, has provided a right surface pattern to activate effectively the heterogeneous nucleation. In contrast, the seed, which has the curved surface full of a uniform size distribution, has failed to induce the heterogeneous nucleation. The results from the present work have also shown that the seed with strong nucleating ability leads to the formation of large crystals but the seed without nucleating ability does not influence much the crystal size.

  14. Fabrication of specimens of metamorphic magnetite crystals for field ion microscopy and atom probe microanalysis.

    PubMed

    Kuhlman, K R; Martens, R L; Kelly, T F; Evans, N D; Miller, M K

    2001-10-01

    Field ion specimens have been successfully fabricated from samples of metamorphic magnetite crystals (Fe3O4) extracted from a polymetamorphosed, granulite-facies marble with the use of a focused ion beam. These magnetite crystals contain nanometer-scale, disk-shaped inclusions making this magnetite particularly attractive for investigating the capabilities of atom probe field ion microscopy (APFIM) for geological materials. Field ion microscope images of these magnetite crystals were obtained in which the observed size and morphology of the precipitates agree with previous results. Samples were analyzed in the energy compensated optical position-sensitive atom probe. Mass spectra were obtained in which peaks for singly ionized 16O, 56Fe and 56FeO and doubly ionized 54Fe, 56Fe and 57Fe peaks were fully resolved. Manganese and aluminum were observed in a limited analysis of a precipitate in an energy compensated position sensitive atom probe. PMID:11770743

  15. Crystal structure analysis of LiTaO3 under electric field

    NASA Astrophysics Data System (ADS)

    Aoyagi, Shinobu; Osawa, Hitoshi; Sugimoto, Kunihisa; Iwata, Makoto; Takeda, Shoichi; Moriyoshi, Chikako; Kuroiwa, Yoshihiro

    2015-10-01

    Structural changes of a stoichiometric LiTaO3 single crystal accompanied by polarization switching are investigated using high-energy X-ray diffraction under static electric fields. The electric field dependence of the c-axis lattice constant depicts a small hysteresis and shows a butterfly curve. Inversion of the crystal structure accompanied by polarization switching is clearly detected with changes in the diffraction intensities of Friedel pairs. The electric field dependences of the atomic positions and volume ratio of the ferroelectric domains are obtained by crystal structure analyses. The results are fully consistent with the bulk properties and ensure that the present experimental techniques are applicable to detecting the transient atomic motions in the nucleation and growth of the ferroelectric domains during polarization switching.

  16. Eu(2+)-Activated Alkaline-Earth Halophosphates, M5(PO4)3X:Eu(2+) (M = Ca, Sr, Ba; X = F, Cl, Br) for NUV-LEDs: Site-Selective Crystal Field Effect.

    PubMed

    Kim, Donghyeon; Kim, Sung-Chul; Bae, Jong-Seong; Kim, Sungyun; Kim, Seung-Joo; Park, Jung-Chul

    2016-09-01

    Eu(2+)-activated M5(PO4)3X (M = Ca, Sr, Ba; X = F, Cl, Br) compounds providing different alkaline-earth metal and halide ions were successfully synthesized and characterized. The emission peak maxima of the M5(PO4)3Cl:Eu(2+) (M = Ca, Sr, Ba) compounds were blue-shifted from Ca to Ba (454 nm for Ca, 444 nm for Sr, and 434 nm for Ba), and those of the Sr5(PO4)3X:Eu(2+) (X = F, Cl, Br) compounds were red-shifted along the series of halides, F → Cl → Br (437 nm for F, 444 nm for Cl, and 448 nm for Br). The site selectivity and occupancy of the activator ions (Eu(2+)) in the M5(PO4)3X:Eu(2+) (M = Ca, Sr, Ba; X = F, Cl, Br) crystal lattices were estimated based on theoretical calculation of the 5d → 4f transition energies of Eu(2+) using LCAO. In combination with the photoluminescence measurements and theoretical calculation, it was elucidated that the Eu(2+) ions preferably enter the fully oxygen-coordinated sites in the M5(PO4)3X:Eu(2+) (M = Ca, Sr, Ba; X = F, Cl, Br) compounds. This trend can be well explained by "Pauling's rules". These compounds may provide a platform for modeling a new phosphor and application in the solid-state lighting field. PMID:27494550

  17. Effect of impurities on crystal growth rate of ammonium pentaborate

    NASA Astrophysics Data System (ADS)

    Şahin, Ö.; Özdemir, M.; Genli, N.

    2004-01-01

    The effect of sodium chloride, borax and boric acid of different concentrations on the growth rate of ammonium pentaborate octahydrate crystals (APBO) was measured and was found to depend on supersaturation in a fluidized bed crystallizer. The presence of impurities in APBO solution increases the growth rate compared with growth from pure solution. It was found that the presence of sodium chloride, borax and boric acid decreases the reaction rate constant kr, while it increases the mass-transfer coefficient, K, of APBO crystals. In pure aqueous solution, the crystal growth rate of APBO is mainly controlled by diffusion. However, both diffusion and integration steps affect the growth rate of APBO crystals in the presence of sodium chloride, borax and boric acid. The mass-transfer coefficient, K, reaction rate constant, kr and reaction order, r were calculated from general mass-transfer equation by using genetic algorithm method making no assumption.

  18. Effects of ionizing radiation on struvite crystallization of livestock wastewater

    NASA Astrophysics Data System (ADS)

    Kim, Tak-Hyun; Nam, Yun-Ku; Joo Lim, Seung

    2014-04-01

    Livestock wastewater is generally very difficult to be treated by conventional wastewater treatment techniques because it contains high-strength organics (COD), ammonium (NH4+), phosphate (PO43-) and suspended solids. Struvite crystallization has been recently studied for the simultaneous removal of NH4+ and PO43-. In this study, gamma ray irradiation was carried out prior to struvite crystallization of the anaerobically digested livestock wastewater. The effects of gamma ray irradiation on the struvite crystallization of livestock wastewater were investigated. As a result, gamma ray irradiation can decrease the concentration of COD, NH4+ and PO43- contained in the livestock wastewater. This results in not only an enhancement of the struvite crystallization efficiency but also a decrease in the chemical demands for the struvite crystallization of livestock wastewater.

  19. The onset of layer undulations in smectic A liquid crystals due to a strong magnetic field

    NASA Astrophysics Data System (ADS)

    Contreras, A.; Garcia-Azpeitia, C.; García-Cervera, C. J.; Joo, S.

    2016-08-01

    We investigate the effect of a strong magnetic field on a three dimensional smectic A liquid crystal. We identify a critical field above which the uniform layered state loses stability; this is associated to the onset of layer undulations. In a previous work García-Cervera and Joo (2012 Arch. Ration. Mech. Anal. 203 1–43), García-Cervera and Joo considered the two dimensional case and analyzed the transition to the undulated state via a simple bifurcation. In dimension n  =  3 the situation is more delicate because the first eigenvalue of the corresponding linearized problem is not simple. We overcome the difficulties inherent to this higher dimensional setting by identifying the irreducible representations for natural actions on the functional that take into account the invariances of the problem thus allowing for reducing the bifurcation analysis to a subspace with symmetries. We are able to describe at least two bifurcation branches, highlighting the richer landscape of energy critical states in the three dimensional setting. Finally, we analyze a reduced two dimensional problem, assuming the magnetic field is very strong, and are able to relate this to a model in micromagnetics studied in Alouges et al (2002 ESAIM Control Optim. Calc. Var. 8 31–68), from where we deduce the periodicity property of minimizers.

  20. Effects of ultrasonic fields in the phosphoric acid process

    NASA Technical Reports Server (NTRS)

    Kowalska, E.; Mizera, J.; Jakobiec, H.

    1974-01-01

    A process of apatite decomposition with sulfuric acid was studied under the influence of ultrasound in the phosphoric acid production process. The studies were carried out with and without ultrasonic fields in the reaction mixture, which resembled the mixing ratio used in technical production processes. Ultrasound with a frequency of 20 kHz and an intensity of 1 W/sq cm was used in the studies. A very favorable ultrasonic effect upon the degree of apatite decomposition was observed. The ultrasonic field affects the shape of byproduct gypsum crystals. In the H3PO4 production process without ultrasound, the byproduct gypsum crystallizes as long, thin needles which cause problems in filtration. In the trials involving the application of wound, gypsum crystallized in the form of small platelets possessing a favorable ratio of length to width.

  1. Twist-bend nematic liquid crystals in high magnetic fields.

    PubMed

    Challa, P K; Borshch, V; Parri, O; Imrie, C T; Sprunt, S N; Gleeson, J T; Lavrentovich, O D; Jákli, A

    2014-06-01

    We present magneto-optic measurements on two materials that form the recently discovered twist-bend nematic (N_{tb}) phase. This intriguing state of matter represents a fluid phase that is orientationally anisotropic in three directions and also exhibits translational order with periodicity several times larger than the molecular size. N_{tb} materials may also spontaneously form a visible, macroscopic stripe texture. We show that the optical stripe texture can be persistently inhibited by a magnetic field, and a 25T external magnetic field depresses the N-N_{tb} phase transition temperature by almost 1{∘}C. We propose a quantitative mechanism to account for this shift and suggest a Helfrich-Hurault-type mechanism for the optical stripe formation. PMID:25019707

  2. Rearranging Pionless Effective Field Theory

    SciTech Connect

    Martin Savage; Silas Beane

    2001-11-19

    We point out a redundancy in the operator structure of the pionless effective field theory which dramatically simplifies computations. This redundancy is best exploited by using dibaryon fields as fundamental degrees of freedom. In turn, this suggests a new power counting scheme which sums range corrections to all orders. We explore this method with a few simple observables: the deuteron charge form factor, n p -> d gamma, and Compton scattering from the deuteron. Higher dimension operators involving electroweak gauge fields are not renormalized by the s-wave strong interactions, and therefore do not scale with inverse powers of the renormalization scale. Thus, naive dimensional analysis of these operators is sufficient to estimate their contribution to a given process.

  3. Strong crystal size effect on deformation twinning.

    PubMed

    Yu, Qian; Shan, Zhi-Wei; Li, Ju; Huang, Xiaoxu; Xiao, Lin; Sun, Jun; Ma, Evan

    2010-01-21

    Deformation twinning in crystals is a highly coherent inelastic shearing process that controls the mechanical behaviour of many materials, but its origin and spatio-temporal features are shrouded in mystery. Using micro-compression and in situ nano-compression experiments, here we find that the stress required for deformation twinning increases drastically with decreasing sample size of a titanium alloy single crystal, until the sample size is reduced to one micrometre, below which the deformation twinning is entirely replaced by less correlated, ordinary dislocation plasticity. Accompanying the transition in deformation mechanism, the maximum flow stress of the submicrometre-sized pillars was observed to saturate at a value close to titanium's ideal strength. We develop a 'stimulated slip' model to explain the strong size dependence of deformation twinning. The sample size in transition is relatively large and easily accessible in experiments, making our understanding of size dependence relevant for applications. PMID:20090749

  4. Inflating with large effective fields

    SciTech Connect

    Burgess, C.P.; Cicoli, M.; Quevedo, F.; Williams, M. E-mail: mcicoli@ictp.it E-mail: mwilliams@perimeterinsititute.ca

    2014-11-01

    We re-examine large scalar fields within effective field theory, in particular focussing on the issues raised by their use in inflationary models (as suggested by BICEP2 to obtain primordial tensor modes). We argue that when the large-field and low-energy regimes coincide the scalar dynamics is most effectively described in terms of an asymptotic large-field expansion whose form can be dictated by approximate symmetries, which also help control the size of quantum corrections. We discuss several possible symmetries that can achieve this, including pseudo-Goldstone inflatons characterized by a coset G/H (based on abelian and non-abelian, compact and non-compact symmetries), as well as symmetries that are intrinsically higher dimensional. Besides the usual trigonometric potentials of Natural Inflation we also find in this way simple large-field power laws (like V ∝ φ{sup 2}) and exponential potentials, V(φ) = ∑{sub k}V{sub x}e{sup −kφ/M}. Both of these can describe the data well and give slow-roll inflation for large fields without the need for a precise balancing of terms in the potential. The exponential potentials achieve large r through the limit |η| || ε and so predict r ≅ (8/3)(1-n{sub s}); consequently n{sub s} ≅ 0.96 gives r ≅ 0.11 but not much larger (and so could be ruled out as measurements on r and n{sub s} improve). We examine the naturalness issues for these models and give simple examples where symmetries protect these forms, using both pseudo-Goldstone inflatons (with non-abelian non-compact shift symmetries following familiar techniques from chiral perturbation theory) and extra-dimensional models.

  5. Studying Crystal Growth With the Peltier Effect

    NASA Technical Reports Server (NTRS)

    Larsen, David J., Jr.; Dressler, B.; Silberstein, R. P.; Poit, W. J.

    1986-01-01

    Peltier interface demarcation (PID) shown useful as aid in studying heat and mass transfer during growth of crystals from molten material. In PID, two dissimilar "metals" solid and liquid phases of same material. Current pulse passed through unidirectionally solidifying sample to create rapid Peltier thermal disturbance at liquid/solid interface. Disturbance, measured by thermocouple stationed along path of solidification at or near interface, provides information about position and shape of interface.

  6. Accurate force fields and methods for modelling organic molecular crystals at finite temperatures.

    PubMed

    Nyman, Jonas; Pundyke, Orla Sheehan; Day, Graeme M

    2016-06-21

    We present an assessment of the performance of several force fields for modelling intermolecular interactions in organic molecular crystals using the X23 benchmark set. The performance of the force fields is compared to several popular dispersion corrected density functional methods. In addition, we present our implementation of lattice vibrational free energy calculations in the quasi-harmonic approximation, using several methods to account for phonon dispersion. This allows us to also benchmark the force fields' reproduction of finite temperature crystal structures. The results demonstrate that anisotropic atom-atom multipole-based force fields can be as accurate as several popular DFT-D methods, but have errors 2-3 times larger than the current best DFT-D methods. The largest error in the examined force fields is a systematic underestimation of the (absolute) lattice energy. PMID:27230942

  7. Convective flow effects on protein crystal growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz; Monaco, Lisa A.

    1993-01-01

    The experimental setup for the in-situ high resolution optical monitoring of protein crystal growth/dissolution morphologies was substantially improved. By augmenting the observation system with a temperature-controlled enclosure, laser illumination for the interferometric microscope, and software for pixel by pixel light intensity recording, a height resolution of about two unit cells for lysozyme can now be obtained. The repartitioning of Na(+) and Cl(-) ions between lysozyme solutions and crystals was studied. Quite unexpectedly, it was found that the longer crystals were in contact with their solution, the lower was their ion content. The development of a model for diffusive-convective transport and resulting distribution of the growth rate on facets was completed. Results obtained for a realistic growth cell geometry show interesting differences between 'growth runs' at 1g and 0g. The kinematic viscosity of lysozyme solutions of various supersaturations and salt concentrations was monitored over time. In contrast to the preliminary finding of other authors, no changes in viscosity were found over four days. The experimental setup for light scattering investigations of aggregation and nucleation in protein solutions was completed, and a computer program for the evaluation of multi-angle light scattering data was acquired.

  8. Convective flow effects on protein crystal growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz; Monaco, Lisa A.

    1995-01-01

    During the fourth semi-annual period under this grant we have pursued the following activities: (1) crystal growth morphology and kinetics studies with tetragonal lysozyme. These clearly revealed the influence of higher molecular weight protein impurities on interface shape; (2) characterization of the purity and further purification of lysozyme solutions. These efforts have, for the first time, resulted in lysozyme free of higher molecular weight components; (3) continuation of the salt repartitioning studies with Seikagaku lysozyme, which has a lower protein impurity content that Sigma stock. These efforts confirmed our earlier findings of higher salt contents in smaller crystals. However, less salt is in corporated into the crystals grown from Seikagaku stock. This strongly suggests a dependence of salt repartitioning on the concentration of protein impurities in lysozyme. To test this hypothesis, repartitioning studies with the high purity lysozyme prepared in-house will be begun shortly; (4) numerical modelling of the interaction between bulk transport and interface kinetics. These simulations have produced interface shapes which are in good agreement with out experimental observations; and (5) light scattering studies on under- and supersaturated lysozyme solutions. A consistent interpretation of the static and dynamic data leaves little doubt that pre-nucleation clusters, claimed to exist even in undersaturated solutions, are not present. The article: 'Growth morphology response to nutrient and impurity nonuniformities' is attached.

  9. Spectroscopy of Charge Carriers and Traps in Field-Doped Single Crystal Organic Semiconductors

    SciTech Connect

    Zhu, Xiaoyang

    2014-12-10

    The proposed research aims to achieve quantitative, molecular level understanding of charge carriers and traps in field-doped crystalline organic semiconductors via in situ linear and nonlinear optical spectroscopy, in conjunction with transport measurements and molecular/crystal engineering. Organic semiconductors are emerging as viable materials for low-cost electronics and optoelectronics, such as organic photovoltaics (OPV), organic field effect transistors (OFETs), and organic light emitting diodes (OLEDs). Despite extensive studies spanning many decades, a clear understanding of the nature of charge carriers in organic semiconductors is still lacking. It is generally appreciated that polaron formation and charge carrier trapping are two hallmarks associated with electrical transport in organic semiconductors; the former results from the low dielectric constants and weak intermolecular electronic overlap while the latter can be attributed to the prevalence of structural disorder. These properties have lead to the common observation of low charge carrier mobilities, e.g., in the range of 10-5 - 10-3 cm2/Vs, particularly at low carrier concentrations. However, there is also growing evidence that charge carrier mobility approaching those of inorganic semiconductors and metals can exist in some crystalline organic semiconductors, such as pentacene, tetracene and rubrene. A particularly striking example is single crystal rubrene (Figure 1), in which hole mobilities well above 10 cm2/Vs have been observed in OFETs operating at room temperature. Temperature dependent transport and spectroscopic measurements both revealed evidence of free carriers in rubrene. Outstanding questions are: what are the structural features and physical properties that make rubrene so unique? How do we establish fundamental design principles for the development of other organic semiconductors of high mobility? These questions are critically important but not comprehensive, as the nature of

  10. Dark-field transmission electron microscopy of cortical bone reveals details of extrafibrillar crystals.

    PubMed

    Schwarcz, Henry P; McNally, Elizabeth A; Botton, Gianluigi A

    2014-12-01

    In a previous study we showed that most of the mineral in bone is present in the form of "mineral structures", 5-6nm-thick, elongated plates which surround and are oriented parallel to collagen fibrils. Using dark-field transmission electron microscopy, we viewed mineral structures in ion-milled sections of cortical human bone cut parallel to the collagen fibrils. Within the mineral structures we observe single crystals of apatite averaging 5.8±2.7nm in width and 28±19nm in length, their long axes oriented parallel to the fibril axis. Some appear to be composite, co-aligned crystals as thin as 2nm. From their similarity to TEM images of crystals liberated from deproteinated bone we infer that we are viewing sections through platy crystals of apatite that are assembled together to form the mineral structures. PMID:25449316

  11. Electric field generation of Skyrmion-like structures in a nematic liquid crystal.

    PubMed

    Cattaneo, Laura; Kos, Žiga; Savoini, Matteo; Kouwer, Paul; Rowan, Alan; Ravnik, Miha; Muševič, Igor; Rasing, Theo

    2016-01-21

    Skyrmions are particle-like topological objects that are increasingly drawing attention in condensed matter physics, where they are connected to inversion symmetry breaking and chirality. Here we report the generation of stable Skyrmion-like structures in a thin nematic liquid crystal film on chemically patterned patchy surfaces. Using the interplay of material elasticity and surface boundary conditions, we use a strong electric field to quench the nematic liquid crystal from a fully aligned phase to vortex-like nematic liquid crystal structures, centered on patterned patches, which carry two different sorts of topological defects. Numerical calculations reveal that these are Skyrmion-like structures, seeded from the surface boojum topological defects and swirling towards the second confining surface. These observations, supported by numerical methods, demonstrate the possibility to generate, manipulate and study Skyrmion-like objects in nematic liquid crystals on patterned surfaces. PMID:26549212

  12. A full field, 3-D velocimeter for microgravity crystallization experiments

    NASA Technical Reports Server (NTRS)

    Brodkey, Robert S.; Russ, Keith M.

    1991-01-01

    The programming and algorithms needed for implementing a full-field, 3-D velocimeter for laminar flow systems and the appropriate hardware to fully implement this ultimate system are discussed. It appears that imaging using a synched pair of video cameras and digitizer boards with synched rails for camera motion will provide a viable solution to the laminar tracking problem. The algorithms given here are simple, which should speed processing. On a heavily loaded VAXstation 3100 the particle identification can take 15 to 30 seconds, with the tracking taking less than one second. It seeems reasonable to assume that four image pairs can thus be acquired and analyzed in under one minute.

  13. Pulsed field actuation of Ni-Mn-Ga ferromagnetic shape memory alloy single crystal

    NASA Astrophysics Data System (ADS)

    Marioni, M.; Bono, D.; Banful, A. B.; del Rosario, M.; Rodriguez, E.; Peterson, B. W.; Allen, S. M.; O'Handley, R. C.

    2003-10-01

    Ferromagnetic Shape Memory Alloy Ni-Mn-Ga has twin boundaries in the martensitic phase that move when a suitable magnetic field is applied. In this fashion strains of up to 6% have been observed for static fields in single crystals [1]. Recently 2.5% strain has been demonstrated [2] in Ni-Mn-Ga single crystals for oscillating fields up to frequencies of 75 Hz (150 Hz actuation). This work studies the actuation of single crystals when pulsed fields are applied. Fields in the 0.4-1.5MA/m-range were generated in an air coil with rise times of the order of 1ms and below. The elongation of the samples is measured with a light beam reflected off the tip of the crystal. Single twin boundaries have been observed to advance 0.16 mm during 600 μsec-ong pulses. Actuation has been shown to be possible at least up to frequencies of 1700 Hz.

  14. Realization of Field Sequential Color in Simple Matrix Antiferroelectric Liquid Crystal Displays by Utilizing Fast Pretransitional Response

    NASA Astrophysics Data System (ADS)

    Suzuki, Yasushi; Chen, Guo-Ping; Manna, Uttam; Vij, Jagdish K.; Fukuda, Atsuo

    2009-07-01

    Simple matrix antiferroelectric liquid crystal displays (SM-AFLCDs) are prototyped to realize field sequential color (FSC) by utilizing the fast pretransitional response. The developed FSC-SM-AFLCDs will lead to the replacement of existing static driven FSC-SM-nematic-LCDs. Bright and clear color can be given to already market-acquired, black-and-white SM-LCDs of up to 1/64-duty and 3-in. diagonal size. To optimize the display performance, we analyze two important factors, the large pretransitional effect and the appropriate reset pulse, in terms of the interlayer interaction potential used in describing the field-induced transition of the antiferroelectric smectic phase.

  15. Effect of amino acid doping on the growth and ferroelectric properties of triglycine sulphate single crystals

    SciTech Connect

    Raghavan, C.M.; Sankar, R.; Mohan Kumar, R.; Jayavel, R.

    2008-02-05

    Effect of amino acids (L-leucine and isoleucine) doping on the growth aspects and ferroelectric properties of triglycine sulphate crystals has been studied. Pure and doped crystals were grown from aqueous solution by low temperature solution growth technique. The cell parameter values were found to significantly vary for doped crystals. Fourier transform infrared analysis confirmed the presence of functional groups in the grown crystal. Morphology study reveals that amino acid doping induces faster growth rate along b-direction leading to a wide b-plane and hence suitable for pyroelectric detector applications. Ferroelectric domain structure has been studied by atomic force microscopy and hysteresis measurements reveal an increase of coercive field due to the formation of single domain pattern.

  16. Effect of solvent on crystallization behavior of xylitol

    NASA Astrophysics Data System (ADS)

    Hao, Hongxun; Hou, Baohong; Wang, Jing-Kang; Lin, Guangyu

    2006-04-01

    Effect of organic solvents content on crystallization behavior of xylitol was studied. Solubility and crystallization kinetics of xylitol in methanol-water system were experimentally determined. It was found that the solubility of xylitol at various methanol content all increases with increase of temperature. But it decreases when increasing methanol content at constant temperature. Based on the theory of population balance, the nucleation and growth rates of xylitol in methanol-water mixed solvents were calculated by moments method. From a series of experimental population density data of xylitol gotten from a batch-operated crystallizer, parameters of crystal nucleation and growth rate equations at different methanol content were got by the method of nonlinear least-squares. By analyzing, it was found that the content of methanol had an apparent effect on nucleation and growth rate of xylitol. At constant temperature, the nucleation and growth rate of xylitol all decrease with increase of methanol content.

  17. Thermoelectric Magnetohydrodynamic Flow During Crystal Growth with a Moderate or Weak Magnetic Field

    NASA Technical Reports Server (NTRS)

    Khine, Y. Y.; Walker, John S.; Szofran, Frank R.; Rose, M. Franklin (Technical Monitor)

    2000-01-01

    This paper treats a steady, axisymmetric melt motion in a cylindrical ampoule with a uniform, axial magnetic field and with an electric current due to a radial temperature variation along the crystal-melt interface, where the values of the absolute thermoelectric power for the crystal and melt are different. The radial component of the thermoelectric current in the melt produces an azimuthal body force, and the axial variation of the centrifugal force due to the azimuthal motion drives a meridional circulation with radial and axial velocities. For moderate magnetic field strengths, the azimuthal velocity and magnetic field produce a radial induced electric field which partially cancels the Seebeck electromotive force in the melt, so that the thermoelectric current and the melt motion are coupled. For weak magnetic fields, the thermoelectric current is decoupled from the melt motion, which is an ordinary hydrodynamic flow driven by a known azimuthal body force. The results show how the flow varies with the strength of the magnetic field and with the magnitude of the temperature variation along the crystal-melt interface. They also define the parameter ranges for which the simpler weak-field decoupled analysis gives accurate predictions.

  18. Deuterium NMR investigations of field-induced director alignment in nematic liquid crystals.

    PubMed

    Sugimura, Akihiko; Luckhurst, Geoffrey R

    2016-05-01

    There have been many investigations of the alignment of nematic liquid crystals by either a magnetic and/or an electric field. The basic features of the important hydrodynamic processes for low molar mass nematics have been characterized for the systems in their equilibrium and non-equilibrium states. These have been created using electric and magnetic fields to align the director and deuterium nuclear magnetic resonance ((2)H NMR) spectroscopy has been used to explore this alignment. Theoretical models based on continuum theory have been developed to complement the experiments and found to describe successfully the static and the dynamic phenomena observed. Such macroscopic behaviour has been investigated with (2)H NMR spectroscopy, in which an electric field in addition to the magnetic field of the spectrometer is used to rotate the director and produce a non-equilibrium state. This powerful technique has proved to be especially valuable for the investigation of nematic liquid crystals. Since the quadrupolar splitting for deuterons observed in the liquid crystal phase is determined by the angle between the director and the magnetic field, time-resolved and time-averaged (2)H NMR spectroscopies can be employed to investigate the dynamic director alignment process in a thin nematic film following the application or removal of an electric field. In this article, we describe some seminal studies to illustrate the field-induced static and dynamic director alignment for low molar mass nematics. PMID:27247284

  19. Two-prism crystal structures for far-field imaging of subwavelength features at terahertz frequencies

    NASA Astrophysics Data System (ADS)

    Barros, D. A.; Dumelow, T.

    2016-08-01

    We investigate how a system of two single crystals can be used for far field imaging of subwavelength features. We make use of the phonon response to induce canalization of narrow collimated beams in crystals with suitably high anisotropy at the appropriate transverse optical phonon frequency. By cutting the crystals into suitably designed prisms, we show that an magnified image can be obtained and projected into the far field by a two-prism structure, noting that a single prism does not give a faithful reproduction of the object and will usually result in total internal reflection of most of the radiation. We show simulations using triglycine sulphate, which is both highly anisotropic and has very low absorption, at low temperature.

  20. New theoretical results for the Lehmann effect in cholesteric liquid crystals

    NASA Technical Reports Server (NTRS)

    Brand, Helmut R.; Pleiner, Harald

    1988-01-01

    The Lehmann effect arising in a cholesteric liquid crystal drop when a temperature gradient is applied parallel to its helical axis is investigated theoretically using a local approach. A pseudoscalar quantity is introduced to allow for cross couplings which are absent in nematic liquid crystals, and the statics and dissipative dynamics are analyzed in detail. It is shown that the Lehmann effect is purely dynamic for the case of an external electric field and purely static for an external density gradient, but includes both dynamic and static coupling contributions for the cases of external temperature or concentration gradients.

  1. Electric Field-Controlled Crystallizing CaCO3 Nanostructures from Solution

    NASA Astrophysics Data System (ADS)

    Qi, Jian Quan; Guo, Rui; Wang, Yu; Liu, Xuan Wen; Chan, Helen Lai Wah

    2016-03-01

    The role of electric field is investigated in determining the structure, morphology, and crystallographic characteristics of CaCO3 nanostructures crystallized from solution. It is found that the lattice structure and crystalline morphology of CaCO3 can be tailed by the electric field applied to the solution during its crystallization. The calcite structure with cubic-like morphology can be obtained generally without electric field, and the vaterite structure with the morphology of nanorod is formed under the high electric field. The vaterite nanorods can be piled up to the petaliform layers. Both the nanorod and the petaliform layer can have mesocrystal structures which are piled up by much fine units of the rods with the size of several nanometers. Beautiful rose-like nanoflowers can be self-arranged by the petaliform layers. These structures can have potential application as carrier for medicine to involve into metabolism of living cell.

  2. Electric Field-Controlled Crystallizing CaCO3 Nanostructures from Solution.

    PubMed

    Qi, Jian Quan; Guo, Rui; Wang, Yu; Liu, Xuan Wen; Chan, Helen Lai Wah

    2016-12-01

    The role of electric field is investigated in determining the structure, morphology, and crystallographic characteristics of CaCO3 nanostructures crystallized from solution. It is found that the lattice structure and crystalline morphology of CaCO3 can be tailed by the electric field applied to the solution during its crystallization. The calcite structure with cubic-like morphology can be obtained generally without electric field, and the vaterite structure with the morphology of nanorod is formed under the high electric field. The vaterite nanorods can be piled up to the petaliform layers. Both the nanorod and the petaliform layer can have mesocrystal structures which are piled up by much fine units of the rods with the size of several nanometers. Beautiful rose-like nanoflowers can be self-arranged by the petaliform layers. These structures can have potential application as carrier for medicine to involve into metabolism of living cell. PMID:26932759

  3. Fringing field-induced monodomain of a polymer-stabilized blue phase liquid crystal

    NASA Astrophysics Data System (ADS)

    Li, Wei-Huan; Hu, De-Chun; Li, Yan; Chen, Chao Ping; Lee, Yung-Jui; Lien, Alan; Lu, Jian-Gang; Su, Yikai

    2015-12-01

    The influence of fringe electric field applied during photopolymerization on the electro-optic properties of polymer-stabilized blue phase liquid crystals (PS-BPLCs) was investigated. It has been found that the thermal stability would not degrade if the electric field was less than a critical value. The contrast ratio of PS-BPLC can be improved significantly because the uniformity of blue phase liquid crystal domain was enhanced by the electric fields, which were applied during photopolymerization. Meanwhile, with the electric filed, the potential energy of the BPLC molecules may lower the anchoring energy of the polymer network resulting in the improvement of electro-optic response properties. With optimized electric field during polymerization, the contrast ratio and the Kerr constant of PS-BPLC can be improved by 4.1 times and 15%, respectively, and the hysteresis can be decreased by 10%, while the response time and residual birefringence have no degradation.

  4. Tuning the colloidal crystal structure of magnetic particles by external field.

    PubMed

    Pal, Antara; Malik, Vikash; He, Le; Erné, Ben H; Yin, Yadong; Kegel, Willem K; Petukhov, Andrei V

    2015-02-01

    Manipulation of the self-assembly of magnetic colloidal particles by an externally applied magnetic field paves a way toward developing novel stimuli responsive photonic structures. Using microradian X-ray scattering technique we have investigated the different crystal structures exhibited by self-assembly of core-shell magnetite/silica nanoparticles. An external magnetic field was employed to tune the colloidal crystallization. We find that the equilibrium structure in absence of the field is random hexagonal close-packed (RHCP) one. External field drives the self-assembly toward a body-centered tetragonal (BCT) structure. Our findings are in good agreement with simulation results on the assembly of these particles. PMID:25510837

  5. Particle trapping and transport achieved via an adjustable acoustic field above a phononic crystal plate

    NASA Astrophysics Data System (ADS)

    Wang, T.; Ke, M.; Qiu, C.; Liu, Z.

    2016-06-01

    We present the design for an acoustic system that can achieve particle trapping and transport using the acoustic force field above a phononic crystal plate. The phononic crystal plate comprised a thin brass plate with periodic slits alternately embedded with two kinds of elastic inclusions. Enhanced acoustic transmission and localized acoustic fields were achieved when the structure was excited by external acoustic waves. Because of the different resonant frequencies of the two elastic inclusions, the acoustic field could be controlled via the working frequency. Particles were transported between adjacent traps under the influence of the adjustable acoustic field. This device provides a new and versatile avenue for particle manipulation that would complement other means of particle manipulation.

  6. CRYSTALLIZATION IN MULTICOMPONENT GLASSES

    SciTech Connect

    KRUGER AA; HRMA PR

    2009-10-08

    In glass processing situations involving glass crystallization, various crystalline forms nucleate, grow, and dissolve, typically in a nonuniform temperature field of molten glass subjected to convection. Nuclear waste glasses are remarkable examples of multicomponent vitrified mixtures involving partial crystallization. In the glass melter, crystals form and dissolve during batch-to-glass conversion, melter processing, and product cooling. Crystals often agglomerate and sink, and they may settle at the melter bottom. Within the body of cooling glass, multiple phases crystallize in a non-uniform time-dependent temperature field. Self-organizing periodic distribution (the Liesegnang effect) is common. Various crystallization phenomena that occur in glass making are reviewed.

  7. Faceted growth of primary Al{sub 2}Cu crystals during directional solidification in high magnetic field

    SciTech Connect

    Li, Chuanjun; Ren, Zhongming; Shen, Yu; Wang, Qiuliang; Dai, Yinming; Wang, Hui

    2013-10-21

    The high magnetic field is widely used to modify the crystal morphology. In this work, the effect of the magnetic field on growing behavior of faceted crystals in the Al-40 wt. %Cu alloy was investigated using directional solidification technique. It was found that the faceted growth of primary Al{sub 2}Cu phase was degraded and the primary spacing was reduced upon applying the magnetic field. Additionally, the length of the mushy zone first decreased and then increased with increase of the magnetic field intensity. The quantitative analysis reveals that the shear stress induced by the fluid motion is insufficient to break the atom bonds at the solid-liquid interface. However, both of the thermoelectric magnetic convection (TEMC) and the thermoelectric magnetic force (TEMF) cause dendrites to fracture and reduce the primary spacing. The two effects also weaken the faceting growth. Moreover, the instability of the solid-liquid interface is generated by the TEMF, which further leads to degrade the faceted growth. The length of mushy zone was changed by the TEMC and reached the minimum in the magnetic field of 0.5 T, which is in good agreement with the predicted value (0.83 T)

  8. Synthesis and field emission behaviour of well faceted In2Se3 micro-crystals

    NASA Astrophysics Data System (ADS)

    Kolhe, Panakj S.; Suryawanshi, Sachin R.; Shisode, Raju T.; More, Mahendra A.

    2015-06-01

    Here in, we report synthesis of crystalline Indium Selenide (In2Se3) elegant microcrystals on Au coated Si substrates using one-step facile thermal evaporation route and their field emission investigations. The as-synthesized In2Se3 micro-crystals were subjected to structural and morphological analysis prior to the field emission studies. The XRD spectrum of the as-synthesized product reveals formation of crystalline hexagonal phase of In2Se3 under the prevailing experimental conditions. Under optimized process variables, the morphology of the as-synthesized product is characterized by presence of well facetted micron size particles of In2Se3. Furthermore, the EDAX analysis confirms the presence of In and Se in the as-synthesized sample. The field emission characteristic of the In2Se3 micro-crystal emitter is found to be superior to the other metal chalcogenides micro-crystal based emitters. The synthesized In2Se3 micro-crystals emitter delivers current density of ˜ 225 µA/cm2 at an applied electric field of ˜ 7.44 V/µm. The emission current stability investigated at pre-set value of ˜ 3 µA is observed to be fairly good. These observed results demonstrate potential of the In2Se3 cathode as an electron source for practical applications in vacuum microelectronic devices.

  9. Crystal field splitting on D<-->S transitions of atomic manganese isolated in solid krypton

    NASA Astrophysics Data System (ADS)

    Byrne, O.; Collier, M. A.; Ryan, M. C.; McCaffrey, J. G.

    2010-05-01

    Narrow excitation features present on the [Ar]3d64s1aD(J=9/2-1/2)6←[Ar]3d54s2aS1/26 transitions of manganese atoms isolated in solid Kr are analyzed within the framework of weak crystal field splitting. Use of the Wp optical lineshape function allowed identification of multiple zero-phonon lines for individual spin-orbit J states of the a aD6←aS6 transition recorded with laser-induced excitation spectroscopy. Excellent agreement exists between the predicted crystal field splitting patterns for the J levels of the aD6 state isolated in the «red» tetravacancy site of solid Kr. The tetrahedral crystal field of the «red» trapping site splits J >3/2 levels of the aDJ6 and aD7/24 states by approximately 30cm-1. This report represents the first definitive evidence of crystal field splitting, induced by the weak van der Waals interactions between a neutral metal atom and the rare gas atoms surrounding it in a well-defined solid-state site.

  10. Double perovskite structure: a vibrational and luminescence investigation providing a perspective on crystal field strength.

    PubMed

    Li, Wenyu; Ning, Lixin; Tanner, Peter A

    2012-07-12

    The luminescence spectra of Eu(3+) doped in a series of double perovskite lattices Ba(2)LnMO(6) (Ln = Y, Gd; M = Nb, Ta) have been recorded at room temperature and 10 K. Together with FT-IR and FT-Raman spectra and aided by DFT vibrational energy calculations, assignments have been made for the crystal field levels of the (5)D(J) (J = 0,1) and (7)F(J) (J = 0-2) multiplets. The luminescence spectra are consistent with monoclinic symmetry of these systems. The crystal field parameters from the fitting of the energy level data set of Ba(2)YNbO(6):Eu(3+) enable the crystal field strength to be calculated, and the order of magnitude is Cl(-) < O(2-) < F(-) for the EuX(6)(n-) (n = 6 for halogen, 9 for oxide) moieties. For these systems, an empirical linear relationship between crystal field strength and electronegativity of ligand X has been found. By contrast, the nephelauxetic series from the depression of the Slater parameter F(2) is Cl(-) ≈ O(2-) > F(-) > free ion for these systems. PMID:22703165

  11. Crystal Field Theory and the Angular Overlap Model Applied to Hydrides of Main Group Elements.

    ERIC Educational Resources Information Center

    Moore, E. A.

    1990-01-01

    Described is how crystal field theory and the angular overlap model can be applied to very simple molecules which can then be used to introduce such concepts as bonding orbitals, MO diagrams, and Walsh diagrams. The main-group compounds are used as examples and a switch to the transition metal complexes. (KR)

  12. Local magnetic field study of patterned Bi_2Sr_2CaCu_2Ox and YBa_2Cu_3Ox single crystals

    NASA Astrophysics Data System (ADS)

    Karapetrov, Goran; Kwok, W. K.; Olsson, R. J.; Paulius, L. M.; Crabtree, G. W.

    1998-03-01

    Local magnetic field measurements using GaAs Hall probe arrays were conducted on patterned heavy ion irradiated Bi_2Sr_2CaCu_2Ox and YBa_2Cu_3Ox single crystals. μ - size masks were used in order to form patterns of irradiated and unirradiated arreas on the crystals. Local field distributions and relaxation rates across the boundaries between irradiated and unirradiated areas were measured as a function of applied magnetic field and temperature. The effect of columnar disorder on the static and dynamic characteristics of the vortex phases will be presented.

  13. Measurement of temperature and velocity fields of freezing water using liquid crystal tracers

    NASA Astrophysics Data System (ADS)

    Kowalewski, Tomasz A.

    A new experimental technique based on a computational analysis of the colour and displacement of thermochromic liquid crystal tracers was applied to determine both the temperature and velocity fields of freezing water. The technique combines Digital Particle Image Thermometry and Digital Particle Image Velocimetry. Full 2-D temperature and velocity fields are determined from a pair or a longer sequence, of colour images taken for the selected cross-section of the flow.

  14. Electric-field modulation of liquid crystal structures in contact with structured surfactant monolayers.

    PubMed

    Guillamat, Pau; Sagués, Francesc; Ignés-Mullol, Jordi

    2014-05-01

    We present experiments in which we use an electric field to switch between different configurations in the cellular patterns induced in a confined nematic liquid crystal by the contact with a surfactant monolayer that features lateral order and surface defects. By using different combinations of far-field alignment and mesogen dielectric anisotropy, we unravel the nature and stability of point defects and disclinations resulting from the hybrid boundary conditions. PMID:25353818

  15. Electro-optical field sensor using single total internal reflection in electro-optical crystals

    NASA Astrophysics Data System (ADS)

    Kijima, K.; Abe, O.; Shimizu, A.; Nakamura, T.; Kono, H.; Hagihara, S.; Torikai, E.; Hori, H.

    2015-08-01

    A novel electro-optical radio frequency field sensor with simple structure and high sensitivity is realized using single total internal reflection in electro-optical crystals. Without employing any waveguide structures, the minimum detectable electric field strength of the total internal reflection electro-optical-sensor is estimated to 86.52 dB μV/m (21.18 mV/m) at a resolution band width of 100 Hz for a short interaction length.

  16. High Field Magnetization measurements of uranium dioxide single crystals (P08358- E003-PF)

    SciTech Connect

    Gofryk, K.; Harrison, N.; Jaime, M.

    2014-12-01

    Our preliminary high field magnetic measurements of UO2 are consistent with a complex nature of the magnetic ordering in this material, compatible with the previously proposed non-collinear 3-k magnetic structure. Further extensive magnetic studies on well-oriented (<100 > and <111>) UO2 crystals are planned to address the puzzling behavior of UO2 in both antiferromagnetic and paramagnetic states at high fields.

  17. Influence of rotating magnetic fields on THM growth of CdZnTe crystals under microgravity and ground conditions

    NASA Astrophysics Data System (ADS)

    Stelian, Carmen; Duffar, Thierry

    2015-11-01

    The influence of rotating magnetic fields (RMF) on species transport and interface stability during the growth of Cd0.96Zn0.04Te:In crystals by using the traveling heater method (THM), under microgravity and terrestrial conditions, is numerically investigated. The numerical results are compared to ground and space experiments. The modeling of THM under ground conditions shows very deleterious effects of the natural convection on the morphological stability of the growth interface. The vertical flow transports the liquid of low Te concentration from the dissolution interface to the growth interface, which is consequently destabilized. The suppression of this flow, in low-gravity conditions, results in higher morphological stability of the growth interface. Application of RMF induces a two flow cell pattern, which has a destabilizing effect on the growth interface. Simulations performed by varying the magnetic field induction in the range of 1 - 3 mT show optimal conditions for the growth with a stable interface at low strength of the magnetic field (B = 1 mT). Computations of indium distribution show a better homogeneity of crystals grown under purely diffusive conditions. Rotating magnetic fields of B = 1 mT induce low intensity convection, which generates concentration gradients near the growth interface. These numerical results are in agreement with experiments performed during the FOTON M4 space mission, showing good structural quality of Cd0.96Zn0.04Te crystals grown at very low gravity level. Applying low intensity rotating magnetic fields in ground experiments has no significant influence on the flow pattern and solute distribution. At high intensity of RMF (B = 50 mT), the buoyancy convection is damped near the growth front, resulting in a more stable advancing interface. However, convection is strengthening in the upper part of the liquid zone, where the flow becomes unsteady. The multi-cellular unsteady flow generates temperature oscillations, having

  18. Effect of swift heavy ion beam irradiation on the dielectric and ferroelectric properties of pure and cobalt doped TGS crystals

    NASA Astrophysics Data System (ADS)

    Bajpai, P. K.; Shah, Deepak; Kumar, Ravi

    2012-01-01

    Effect of swift heavy ion (100 MeV O 7+ ion) beam irradiation on the temperature and frequency dependence of real ( ɛ') and imaginary ( ɛ″) parts of dielectric permittivity in pure and Co 2+ doped TGS crystals are analyzed. Irradiation with swift heavy ion beam changes the dielectric response considerably. Observed dielectric peak in irradiated crystals shifts towards lower temperature and broadens up; the reduction in peak value, shift in temperature and broadening changes systematically with fluence. The most interesting results of SHI irradiation are (i) the dielectric loss peak value ( emax″) in all crystals is invariably less in comparison to the value in unirradiated crystals (ii) the minimum value of dielectric loss peak ( emax″) occurs at different fluence in different crystals, and (iii) a second loss peak is observed below Tc in CTGS10 especially at higher fluence. It seems that irradiation creates/strengthens internal field in the crystals by orienting the domains through some mechanism that is not clear at present. The observed results could be explained if one presumes that irradiation annihilate the defects already present in the crystals by creating local charges and thermal gradient resulting into internal bias field. Ferroelectric hysteresis loops demonstrate the internal bias field developing in the SHI irradiated crystals. It is argued that SHI irradiation is a better alternate in comparison to cobalt doping in inhibiting dipolar switching in TGS crystal.

  19. Large Upper Critical Field of Superconductivity in the Single Crystal U6Co

    NASA Astrophysics Data System (ADS)

    Aoki, Dai; Nakamura, Ai; Honda, Fuminori; Li, DeXin; Homma, Yoshiya

    2016-07-01

    We grew single crystals of U6Co by the self-flux method and measured the magnetic susceptibility, resistivity, and specific heat. The magnetic susceptibility shows very small anisotropy and weak temperature dependence, indicating small spin-susceptibility. Superconductivity was clearly observed in the resistivity, susceptibility, and specific heat at Tc ˜ 2.3 K. The upper critical field was remarkably large, 7.9 and 6.6 T for H || [001] and [110], respectively, in the tetragonal structure, indicating that the ellipsoidal Fermi surface is slightly suppressed along the [001] direction according to the effective mass model. The specific heat shows a large jump at Tc with ΔC/γTc = 1.58, and the field dependence of the specific heat at low temperatures shows an almost linear increase. These experimental results are well explained by the BCS model in the dirty limit condition. U6Co is most likely a conventional s-wave superconductor with a full superconducting gap.

  20. Simulation of weak anchoring effects on nematic liquid crystal hemispheres

    NASA Astrophysics Data System (ADS)

    Gillen, Sean; Somers, David A. T.; Munday, Jeremy N.

    The free energy of a nematic liquid crystal droplet depends on an interplay between elastic and surface interactions. When the two contributions are of similar magnitude, there exists a transition of the nematic structure of the droplet. Because the two contributions scale differently with length scales, this transition is visible as a function of the size of the droplet. We carry out numerical simulations to explore the use of this transition in measuring surface anchoring energies. This technique could help elucidate alignment forces on liquid crystals, such as those caused by rubbed surfaces, electric fields, or even the Casimir torque. Electrical and Computer Engineering.

  1. Far-field detection system for laser beams alignment and crystals alignment

    NASA Astrophysics Data System (ADS)

    Liu, D.; Qin, H.; Zhu, B.

    2015-08-01

    Laser beams far-field alignment is very important for the high power laser facility as well as the frequency doubling crystals adjustment. Traditional beams alignment system and crystals alignment system are separated. That means, they use different optical image systems and CCD cameras, which will occupy larger space and use more money. A new farfield detection system of laser beams is presented with a big diffraction grating (37mm*37mm), a set of optical imaging components and a high resolution CCD camera. This detection system, which is fully demonstrated on the National Laser Facility of Israel, can align high power laser facility beams' direction as well as the frequency doubling crystals. The new system occupies small space in the spatial filter through off-axial grating sampling. The experimental results indicate that the average far-field alignment error is less than 5% of spatial filter pinhole diameter, and the average crystals' matching angle error is less than 10urad, which meet the alignment system requirements for beams and crystals.

  2. Ambipolar phosphorene field effect transistor.

    PubMed

    Das, Saptarshi; Demarteau, Marcel; Roelofs, Andreas

    2014-11-25

    In this article, we demonstrate enhanced electron and hole transport in few-layer phosphorene field effect transistors (FETs) using titanium as the source/drain contact electrode and 20 nm SiO2 as the back gate dielectric. The field effect mobility values were extracted to be ∼38 cm(2)/Vs for electrons and ∼172 cm(2)/Vs for the holes. On the basis of our experimental data, we also comprehensively discuss how the contact resistances arising due to the Schottky barriers at the source and the drain end effect the different regime of the device characteristics and ultimately limit the ON state performance. We also propose and implement a novel technique for extracting the transport gap as well as the Schottky barrier height at the metal-phosphorene contact interface from the ambipolar transfer characteristics of the phosphorene FETs. This robust technique is applicable to any ultrathin body semiconductor which demonstrates symmetric ambipolar conduction. Finally, we demonstrate a high gain, high noise margin, chemical doping free, and fully complementary logic inverter based on ambipolar phosphorene FETs. PMID:25329532

  3. Crystal field and magnetism of Pr³⁺ and Nd³⁺ ions in orthorhombic perovskites.

    PubMed

    Novák, P; Knížek, K; Maryško, M; Jirák, Z; Kuneš, J

    2013-11-01

    Fifteen parameters characterizing the crystal field of rare-earth ions in the RMO3 perovskites (R=Pr, Nd, M=Ga, Co) are calculated using a first-principles electronic structure and the Wannier projection. The method contains a single adjustable parameter that characterizes the hybridization of R(4f) states with the states of oxygen ligands. Subsequently the energy levels and magnetic moments of the trivalent R ion are determined by diagonalization of an effective Hamiltonian which, besides the crystal field, contains the 4f electron-electron repulsion, spin-orbit coupling and interaction with magnetic field. In the Ga compounds the energy levels of the ground multiplet agree within a few meV with those determined experimentally by other authors. For all four compounds in question the temperature dependence of magnetic susceptibility is measured on polycrystalline samples and compared with the results of calculation. For NdGaO3 the theory is also compared with the magnetic measurements on a single crystal presented by Luis et al (1998 Phys. Rev. B 58 798). Good agreement between the experiment and theory is found. PMID:24113417

  4. Experimental realization of a silicon spin field-effect transistor

    NASA Astrophysics Data System (ADS)

    Huang, Biqin; Monsma, Douwe J.; Appelbaum, Ian

    2007-08-01

    A longitudinal electric field is used to control the transit time (through an undoped silicon vertical channel) of spin-polarized electrons precessing in a perpendicular magnetic field. Since an applied voltage determines the final spin direction at the spin detector and hence the output collector current, this comprises a spin field-effect transistor. An improved hot-electron spin injector providing ≈115% magnetocurrent, corresponding to at least ≈37% electron current spin polarization after transport through 10μm undoped single-crystal silicon, is used for maximum current modulation.

  5. Mechanism Analysis of the Inverse Doppler Effect in Two-Dimensional Photonic Crystal based on Phase Evolution.

    PubMed

    Jiang, Qiang; Chen, Jiabi; Wang, Yan; Liang, Binming; Hu, Jinbing; Zhuang, Songlin

    2016-01-01

    Although the inverse Doppler effect has been observed experimentally at optical frequencies in photonic crystal with negative effective refractive index, its explanation is based on phenomenological theory rather than a strict theory. Elucidating the physical mechanism underlying the inverse Doppler shift is necessary. In this article, the primary electrical field component in the photonic crystal that leads to negative refraction was extracted, and the phase evolution of the entire process when light travels through a moving photonic crystal was investigated using static and dynamic finite different time domain methods. The analysis demonstrates the validity of the use of np (the effective refractive index of the photonic crystal in the light path) in these calculations, and reveals the origin of the inverse Doppler effect in photonic crystals. PMID:27102211

  6. Mechanism Analysis of the Inverse Doppler Effect in Two-Dimensional Photonic Crystal based on Phase Evolution

    NASA Astrophysics Data System (ADS)

    Jiang, Qiang; Chen, Jiabi; Wang, Yan; Liang, Binming; Hu, Jinbing; Zhuang, Songlin

    2016-04-01

    Although the inverse Doppler effect has been observed experimentally at optical frequencies in photonic crystal with negative effective refractive index, its explanation is based on phenomenological theory rather than a strict theory. Elucidating the physical mechanism underlying the inverse Doppler shift is necessary. In this article, the primary electrical field component in the photonic crystal that leads to negative refraction was extracted, and the phase evolution of the entire process when light travels through a moving photonic crystal was investigated using static and dynamic finite different time domain methods. The analysis demonstrates the validity of the use of np (the effective refractive index of the photonic crystal in the light path) in these calculations, and reveals the origin of the inverse Doppler effect in photonic crystals.

  7. Mechanism Analysis of the Inverse Doppler Effect in Two-Dimensional Photonic Crystal based on Phase Evolution

    PubMed Central

    Jiang, Qiang; Chen, Jiabi; Wang, Yan; Liang, Binming; Hu, Jinbing; Zhuang, Songlin

    2016-01-01

    Although the inverse Doppler effect has been observed experimentally at optical frequencies in photonic crystal with negative effective refractive index, its explanation is based on phenomenological theory rather than a strict theory. Elucidating the physical mechanism underlying the inverse Doppler shift is necessary. In this article, the primary electrical field component in the photonic crystal that leads to negative refraction was extracted, and the phase evolution of the entire process when light travels through a moving photonic crystal was investigated using static and dynamic finite different time domain methods. The analysis demonstrates the validity of the use of np (the effective refractive index of the photonic crystal in the light path) in these calculations, and reveals the origin of the inverse Doppler effect in photonic crystals. PMID:27102211

  8. Susceptibility of single molecule magnet Mn12-acetate single crystals as a function of temperature and transverse field

    NASA Astrophysics Data System (ADS)

    Subedi, Pradeep; Wen, Bo; Bo, Lin; Sarachik, Myriam; Yeshurun, Yosi; Kent, Andrew; Lampropoulos, Christos; Christou, George

    2010-03-01

    The longitudinal susceptibility of Mn12-acetate single crystals has been measured in a magnetic field applied transverse to the Ising axis using micro-Hall effect magnetometry in a He^3 cryostat with a 3D vector superconducting magnet. We have investigated the blocking temperature as a function of longitudinal-field-sweep-rate and as a function of the magnitude of the transverse field. We find that the transverse field accelerates the relaxation to equilibrium and lowers the blocking temperature, as expected based on the Mn12-ac spin-Hamiltonian and a classical model of single domain uniaxial nanomagnets. The susceptibility is found to obey a Curie-Weiss law, indicating a low temperature transition to a ferromagnetic phase due to dipolar interactions. We discuss these experiments as well as experiments in which an array of Hall-bars is used to spatially resolve the longitudinal susceptibility above the blocking temperature.

  9. Simultaneous negative refraction and focusing of fundamental frequency and second-harmonic fields by two-dimensional photonic crystals

    SciTech Connect

    Zhang, Jun; Zhang, Xiangdong

    2015-09-28

    Simultaneous negative refraction for both the fundamental frequency (FF) and second-harmonic (SH) fields in two-dimensional nonlinear photonic crystals have been found through both the physical analysis and exact numerical simulation. By combining such a property with the phase-matching condition and strong second-order susceptibility, we have designed a SH lens to realize focusing for both the FF and SH fields at the same time. Good-quality non-near field images for both FF and SH fields have been observed. The physical mechanism for such SH focusing phenomena has been disclosed, which is different from the backward SH generation as has been pointed out in the previous investigations. In addition, the effect of absorption losses on the phenomena has also been discussed. Thus, potential applications of these phenomena to biphotonic microscopy technique are anticipated.

  10. Self-Action of Light Fields in Waveguide Photon Structures Based on Electro-Optic Crystals

    NASA Astrophysics Data System (ADS)

    Shandarov, V. M.

    2016-02-01

    Special features of spatial self-action of light fields in nonlinear optical photonic waveguide structures formed in strontium barium niobate and lithium niobate electro-optic crystals are discussed. The main methods of forming such structures including photorefractive waveguide elements and systems are briefly considered. The formation of spatial optical solitons in planar waveguides based on lithium niobate and strontium barium niobate crystals as well as in one-dimensional photonic lattices in lithium niobate is demonstrated experimentally for light beams of microwatt power. In regimes of spatial optical solitons, channel optical waveguides are formed not only in the planar waveguides, but also in the volume of photorefractive lithium niobate.

  11. Conoscopic analysis of electric field driven planar aligned nematic liquid crystal.

    PubMed

    Ranjini, Radhakrishnan; Matham, Murukeshan Vadakke; Nguyen, Nam-Trung

    2014-05-01

    This paper illustrates the conoscopic observation of a molecular reconstruction occurring across a nematic liquid crystal (NLC) medium in the presence of an external electric field. Conoscopy is an optical interferometric method, employed to determine the orientation of an optic axis in uniaxial crystals. Here a planar aligned NLC medium is used, and the topological changes with respect to various applied voltages are monitored simultaneously. Homogenous planar alignment is obtained by providing suitable surface treatments to the ITO coated cell walls. The variation in the conoscopic interferometric patterns clearly demonstrates the transition from planar to homeotropic state through various intermediate states. PMID:24921859

  12. Glass bead size and morphology characteristics in support of Crystal Mist field experiments

    SciTech Connect

    Einfeld, W.

    1995-03-01

    One of the tasks of the Lethality Group within US Army Space and Strategic Defense Command (USASSDC) is the development of a capability to simulate various missile intercept scenarios using computer codes. Currently under development within USASSDC and its various contractor organizations is a group of codes collected under a master code called PEGEM for Post Event Ground Effects Model. Among the various components of the code are modules which are used to predict atmospheric dispersion and transport of particles or droplets following release at the altitude specified in the missile intercept scenario. The atmospheric transport code takes into account various source term data from the intercept such as: initial cloud size; droplet or particle size distribution; and, total mass of agent released. An ongoing USASSDC experimental program termed Crystal Mist involved release of precision glass beads under various altitude and meteorological conditions to assist in validation and refinement of various codes that are components of PEGEM used to predict particle atmospheric transport and diffusion following a missile intercept. Here, soda-lime glass beads used in the Crystal Mist series of atmospheric transport and diffusion tests were characterized by scanning electron microscopy and automated image processing routines in order to fully define their size distributions and morphology. Four bead size classifications ranging from a median count diameter of 45 to 200 micrometers were found to be approximately spherical and to fall within the supplier`s sizing specifications. Log-normal functions fit to the measured size distributions resulted in geometric standard deviations ranging from 1.08 to 1.12, thereby fulfilling the field trial requirements for a relatively narrow bead size distribution.

  13. Te inclusion-induced electrical field perturbation in CdZnTe single crystals revealed by Kelvin probe force microscopy.

    PubMed

    Gu, Yaxu; Jie, Wanqi; Li, Linglong; Xu, Yadong; Yang, Yaodong; Ren, Jie; Zha, Gangqiang; Wang, Tao; Xu, Lingyan; He, Yihui; Xi, Shouzhi

    2016-09-01

    To understand the effects of tellurium (Te) inclusions on the device performance of CdZnTe radiation detectors, the perturbation of the electrical field in and around Te inclusions was studied in CdZnTe single crystals via Kelvin probe force microscopy (KPFM). Te inclusions were proved to act as lower potential centers with respect to surrounding CdZnTe matrix. Based on the KPFM results, the energy band diagram at the Te/CdZnTe interface was established, and the bias-dependent effects of Te inclusion on carrier transportation is discussed. PMID:27376976

  14. Investigation of Three-Dimensional Stress Fields and Slip Systems for FCC Single Crystal Superalloy Notched Specimens

    NASA Technical Reports Server (NTRS)

    Arakere, Nagaraj K.; Magnan, Shannon; Ebrahimi, Fereshteh; Ferroro, Luis

    2004-01-01

    Metals and their alloys, except for a few intermetallics, are inherently ductile, i.e. plastic deformation precedes fracture in these materials. Therefore, resistance to fracture is directly related to the development of the plastic zone at the crack tip. Recent studies indicate that the fracture toughness of single crystals depends on the crystallographic orientation of the notch as well as the loading direction. In general, the dependence of crack propagation resistance on crystallographic orientation arises from the anisotropy of (i) elastic constants, (ii) plastic deformation (or slip), and (iii) the weakest fracture planes (e.g. cleavage planes). Because of the triaxial stress state at the notch tips, many slip systems that otherwise would not be activated during uniaxial testing, become operational. The plastic zone formation in single crystals has been tackled theoretically by Rice and his co-workers and only limited experimental work has been conducted in this area. The study of the stresses and strains in the vicinity of a FCC single crystal notch tip is of relatively recent origin. We present experimental and numerical investigation of 3D stress fields and evolution of slip sector boundaries near notches in FCC single crystal tension test specimens, and demonstrate that a 3D linear elastic finite element model that includes the effect of material anisotropy is shown to predict active slip planes and sectors accurately. The slip sector boundaries are shown to have complex curved shapes with several slip systems active simultaneously near the notch. Results are presented for surface and mid-plane of the specimens. The results demonstrate that accounting for 3D elastic anisotropy is very important for accurate prediction of slip activation near FCC single crystal notches loaded in tension. Results from the study will help establish guidelines for fatigue damage near single crystal notches.

  15. Effect of Crystal Orientation on Fatigue Failure of Single Crystal Nickel Base Turbine Blade Superalloys

    NASA Technical Reports Server (NTRS)

    Arakere, Nagaraj K.; Swanson, Gregory R.

    2000-01-01

    High Cycle Fatigue (HCF) induced failures in aircraft gas-turbine engines is a pervasive problem affecting a wide range of components and materials. HCF is currently the primary cause of component failures in gas turbine aircraft engines. Turbine blades in high performance aircraft and rocket engines are increasingly being made of single crystal nickel superalloys. Single-crystal Nickel-base superalloys were developed to provide superior creep, stress rupture, melt resistance and thermomechanical fatigue capabilities over polycrystalline alloys previously used in the production of turbine blades and vanes. Currently the most widely used single crystal turbine blade superalloys are PWA 1480/1493 and PWA 1484. These alloys play an important role in commercial, military and space propulsion systems. PWA1493, identical to PWA1480, but with tighter chemical constituent control, is used in the NASA SSME (Space Shuttle Main Engine) alternate turbopump, a liquid hydrogen fueled rocket engine. Objectives for this paper are motivated by the need for developing failure criteria and fatigue life evaluation procedures for high temperature single crystal components, using available fatigue data and finite element modeling of turbine blades. Using the FE (finite element) stress analysis results and the fatigue life relations developed, the effect of variation of primary and secondary crystal orientations on life is determined, at critical blade locations. The most advantageous crystal orientation for a given blade design is determined. Results presented demonstrates that control of secondary and primary crystallographic orientation has the potential to optimize blade design by increasing its resistance to fatigue crack growth without adding additional weight or cost.

  16. Creating physically-based three-dimensional microstructures: Bridging phase-field and crystal plasticity models.

    SciTech Connect

    Lim, Hojun; Owen, Steven J.; Abdeljawad, Fadi F.; Hanks, Byron; Battaile, Corbett Chandler

    2015-09-01

    In order to better incorporate microstructures in continuum scale models, we use a novel finite element (FE) meshing technique to generate three-dimensional polycrystalline aggregates from a phase field grain growth model of grain microstructures. The proposed meshing technique creates hexahedral FE meshes that capture smooth interfaces between adjacent grains. Three dimensional realizations of grain microstructures from the phase field model are used in crystal plasticity-finite element (CP-FE) simulations of polycrystalline a -iron. We show that the interface conformal meshes significantly reduce artificial stress localizations in voxelated meshes that exhibit the so-called "wedding cake" interfaces. This framework provides a direct link between two mesoscale models - phase field and crystal plasticity - and for the first time allows mechanics simulations of polycrystalline materials using three-dimensional hexahedral finite element meshes with realistic topological features.

  17. Effective field theory out of equilibrium: Brownian quantum fields

    NASA Astrophysics Data System (ADS)

    Boyanovsky, D.

    2015-06-01

    The emergence of an effective field theory out of equilibrium is studied in the case in which a light field—the system—interacts with very heavy fields in a finite temperature bath. We obtain the reduced density matrix for the light field, its time evolution is determined by an effective action that includes the influence action from correlations of the heavy degrees of freedom. The non-equilibrium effective field theory yields a Langevin equation of motion for the light field in terms of dissipative and noise kernels that obey a generalized fluctuation dissipation relation. These are completely determined by the spectral density of the bath which is analyzed in detail for several cases. At T = 0 we elucidate the effect of thresholds in the renormalization aspects and the asymptotic emergence of a local effective field theory with unitary time evolution. At T\

  18. Specific features of attenuated light transmission by liquid-crystal twist cells in constant and alternating electric fields

    NASA Astrophysics Data System (ADS)

    Konshina, E. A.; Amosova, L. P.

    2012-07-01

    Optical transmission characteristics of dual-frequency nematic liquid crystal (NLC) twist cells with different alignment layers (rubbed polyimide and obliquely deposited cerium dioxide) have been studied in constant and alternating electric fields. It has been established that a change in the optical (twist effect) threshold and dynamic range of attenuated transmission depend both on the boundary conditions (that influence the screening of applied voltage) and on the parameters of the applied electric field. The maximum dynamic range (49.5 dB) has been obtained in the cell with a CeO2 alignment layer controlled by a constant potential. In the case of an alternating electric field, the dynamic range decreases because of reduced effective voltage.

  19. Magnetic field induced extraordinary photoluminescence enhancement in Er{sup 3+}:YVO{sub 4} single crystal

    SciTech Connect

    Zhang, Junpei; Wang, Xia; Tang, Chaoqun; Zhong, Zhiqiang; Ma, Zongwei; Wang, Shaoliang; Han, Yibo; Han, Jun-Bo Li, Liang

    2015-08-28

    A bright green photoluminescence (PL) from {sup 4}S{sub 3∕2} → {sup 4}I{sub 15∕2} emission band in Er{sup 3+}:YVO{sub 4} single crystal has been observed with the excitation of an argon laser at 488.0 nm. More than two orders of PL enhancement have been obtained under the effect of magnetic fields, and the enhancement factor f reaches 170 when the applied magnetic field is 7.7 T under the sample temperature of 4.2 K. Unusually, the PL enhancements only happen at some certain magnetic fields (B{sub c}s), and a decrease of sample temperature will lead to the increase of f and decrease of B{sub c}. The results confirm that this PL enhancement originates from the resonance excitation of the electron transitions induced by the cross of the laser energy and the absorption energy modulated by both the magnetic field and temperature. This special PL enhancement in Er{sup 3+}:YVO{sub 4} single crystal can be applied in the calibration of pulsed high magnetic field, detection of material fine energy structures, and modulation of magneto-optical devices.

  20. Large low-field positive magnetoresistance in nonmagnetic half-Heusler ScPtBi single crystal

    NASA Astrophysics Data System (ADS)

    Hou, Zhipeng; Wang, Yue; Liu, Enke; Zhang, Hongwei; Wang, Wenhong; Wu, Guangheng

    2015-11-01

    High-quality nonmagnetic half-Heusler ScPtBi single crystals were synthesized by a Bi self-flux method. This compound was revealed to be a hole-dominated semimetal with a large low-field magnetoresistance up to 240% at 2 K in a magnetic field of 1 T. Magneto-transport measurements demonstrated that the large low-field magnetoresistance effect resulted from the coexistence of field-induced metal-semiconductor transition and weak-antilocalization effect. Moreover, Hall measurements indicated that ScPtBi single crystal showed a high mobility over a wide temperature region even up to room temperature (4050 cm2V-1s-1 at 2 K-2016 cm2V-1s-1 at 300 K). These findings not only suggest the nonmagnetic ScPtBi semimetal a potential material candidate for applications in high-sensitivity magnetic sensors but also are of great significance to comprehensively understand the rare-earth based half-Heusler compounds.

  1. Crystal field excitations in CeCu2Ge2: Revisited employing a single crystal and inelastic neutron scattering

    NASA Astrophysics Data System (ADS)

    Loewenhaupt, Michael; Faulhaber, Enrico; Schneidewind, Astrid; Deppe, Micha; Hradil, Klaudia

    2012-04-01

    The intermetallic compound, CeCu2Ge2, is the counterpart of the heavy-fermion superconductor CeCu2Si2. CeCu2Ge2 is a magnetically ordering (TN = 4.1K) Kondo lattice with a moderate Sommerfeld coefficient of 140 mJ/ molK2. Earlier inelastic neutron measurements on a polycrystalline sample revealed a doublet ground state and a quasi-quartet excited state at 16.5 meV, although a splitting of the 4f1 (J = 5/2) ground state multiplet into 3 doublets is expected from the point symmetry of the Ce3+ ions. We performed detailed inelastic neutron scattering experiments on a single crystal at the thermal triple-axis spectrometer PUMA at FRM II for different crystallographic directions. From our results we infer that the quasi-quartet, in fact, consists of two doublets at 17.0 and 18.3 meV which exhibit a strong directional dependence of their transition matrix elements to the ground state doublet. Finally, we will present a new set of crystal field parameters.

  2. Study of crystal-field excitations and infrared active phonons in the multiferroic hexagonal DyMnO3

    NASA Astrophysics Data System (ADS)

    Jandl, S.; Mansouri, S.; Vermette, J.; Mukhin, A. A.; Ivanov, V. Yu; Balbashov, A.; Orlita, M.

    2013-11-01

    In hexagonal DyMnO3, Dy3+ crystal-field excitations are studied as a function of temperature and applied magnetic field. They are complemented with the measurements of infrared active phonon frequency shifts under applied magnetic field at T = 4.2 K. Between TN = 68 K and T = 10 K, the absence of Dy3+ Kramers doublet splittings at either the C3 or the C3v site symmetries indicates that the Mn3+ magnetic order effective exchange field has no component parallel to the c-axis at either site. Below T = 10 K, the ground state Kramers doublet splits under the Dy3+ internal effective field as well as the applied magnetic field. Also, relatively strong infrared active phonon energy shifts are observed in magneto-infrared reflectance measurements at T = 4.2 K, allowing the calculation of the induced electric polarization changes as a function of the applied magnetic field. Such changes are associated with a large magnetoelectric effect in DyMnO3, arising from a charge transfer between Dy3+ and apical oxygen ions.

  3. `Guest-host' effect in liquid crystal mixtures

    NASA Astrophysics Data System (ADS)

    Suchodolska, B.; Rudzki, A.; Ossowska-Chruściel, M. D.; Zalewski, S.; Chruściel, J.

    2015-01-01

    The most important goal of our research is to show the influence of the 'guest' (bent-core mesogen, 1,3-phenyldicarboxylatebis{4-[(4-octylbenzoyl)sulphanyl]phenyl} [IFOS8], banana-shaped liquid crystal [BLC]) on the 'host' (calamitic liquid crystal [CLC], (S)-(+)-1-methylheptyloxybiphenyl-(4-n-octylphenyl)thiobenzoate [MHOBS8]), on the stability and the destabilization of the antiferroelectric B2 and the ferroelectric smectic C* (SmC*) phases, and change of the temperature ranges of other phases in the binary liquid crystal mixtures. This work is focused on polymorphism of three new binary liquid crystal mixtures, exhibiting a 'guest-host' (guest liquid crystal-host liquid crystal [GH-LC]) effect. MHOBS8 has, among others, a ferroelectric SmC* phase, and IFOS8 assumes the B2 phase with antiferroelectric properties. The observed properties of the mixtures, such as variation of the phase transition temperatures, spontaneous polarization, tilt angle and switching time, are characteristic of a 'guest-host' mixture. The influence of BLC on the character of the interactions within the CLC host is discussed, with particular attention paid to electro-optical properties of the GH-LC mixtures.

  4. Effect of Viscosity on the Crystallization of Undercooled Liquids

    NASA Technical Reports Server (NTRS)

    2003-01-01

    There have been numerous studies of glasses indicating that low-gravity processing enhances glass formation. NASA PI s are investigating the effect of low-g processing on the nucleation and crystal growth rates. Dr. Ethridge is investigating a potential mechanism for glass crystallization involving shear thinning of liquids in 1-g. For shear thinning liquids, low-g (low convection) processing will enhance glass formation. The study of the viscosity of glass forming substances at low shear rates is important to understand these new crystallization mechanisms. The temperature dependence of the viscosity of undercooled liquids is also very important for NASA s containerless processing studies. In general, the viscosity of undercooled liquids is not known, yet knowledge of viscosity is required for crystallization calculations. Many researchers have used the Turnbull equation in error. Subsequent nucleation and crystallization calculations can be in error by many orders of magnitude. This demonstrates the requirement for better methods for interpolating and extrapolating the viscosity of undercooled liquids. This is also true for undercooled water. Since amorphous water ice is the predominant form of water in the universe, astrophysicists have modeled the crystallization of amorphous water ice with viscosity relations that may be in error by five orders-of-magnitude.

  5. [Health effects of electromagnetic fields].

    PubMed

    Röösli, Martin

    2013-12-01

    Use of electricity causes extremely low frequency magnetic fields (ELF-MF) and wireless communication devices emit radiofrequency electromagnetic fields (RF-EMF). Average ELF-MF exposure is mainly determined by high voltage power lines and transformers at home or at the workplace, whereas RF-EMF exposure is mainly caused by devices operating close to the body (mainly mobile and cordless phones). Health effects of EMF are controversially discussed. The IARC classified ELF-MF and RF-EMF as possible carcinogenic. Most consistent epidemiological evidence was found for an association between ELF-MF and childhood leukaemia. If causal, 1 - 4 percent of all childhood leukaemia cases could be attributed to ELF-MF. Epidemiological research provided some indications for an association between ELF-MF and Alzheimer's diseases as well as amyotrophic lateral sclerosis, although not entirely consistent. Regarding mobile phones and brain tumours, some studies observed an increased risk after heavy or long term use on the one hand. On the other hand, brain tumour incidence was not found to have increased in the last decade in Sweden, England or the US. Acute effects of RF-EMF on non-specific symptoms of ill health seem unlikely according to randomized and double blind provocation studies. However, epidemiological research on long term effects is still limited. Although from the current state of the scientific knowledge a large individual health risk from RF-EMF exposure is unlikely, even a small risk would have substantial public health relevance because of the widespread use of wireless communication technologies. PMID:24297859

  6. A coupled ductile fracture phase-field model for crystal plasticity

    NASA Astrophysics Data System (ADS)

    Hernandez Padilla, Carlos Alberto; Markert, Bernd

    2015-08-01

    Nowadays crack initiation and evolution play a key role in the design of mechanical components. In the past few decades, several numerical approaches have been developed with the objective to predict these phenomena. The objective of this work is to present a simplified, nonetheless representative phenomenological model to predict the crack evolution of ductile fracture in single crystals. The proposed numerical approach is carried out by merging a conventional elasto-plastic crystal plasticity model and a phase-field model modified to predict ductile fracture. A two-dimensional initial boundary value problem of ductile fracture is introduced considering a single-crystal setup and Nickel-base superalloy material properties. The model is implemented into the finite element context subjected to a quasi-static uniaxial tension test. The results are then qualitatively analyzed and briefly compared to current benchmark results in the literature.

  7. Photorefractive Bragg gratings in nematic liquid crystals aligned by a magnetic field

    SciTech Connect

    Wiederrecht, G.P.; Wasielewski, M.R. |

    1999-06-01

    Photorefractive Bragg gratings are observed in low-molar-mass nematic liquid crystals doped with electron donor and acceptor molecules. This is accomplished by alignment of the nematic liquid crystals in a 0.3 T magnetic field, which produces thicker homeotropic aligned samples than traditional surfactant techniques. Grating fringe spacings as low as 3.7 {mu}m are achieved with 176-{mu}m-thick samples, producing grating {ital Q} values of 33. Up to this point, low molar mass nematic liquid crystals have exhibited photorefractive gratings with Q{le}1. Asymmetric two-beam coupling and photoconductivity experiments are performed to verify the photorefractive origin of the gratings. {copyright} {ital 1999 American Institute of Physics.}

  8. Spin-to-orbital momentum conversion via electro-optic Pockels effect in crystals

    SciTech Connect

    Skab, Ihor; Vasylkiv, Yurij; Smaga, Ihor; Vlokh, Rostyslav

    2011-10-15

    In the present work we have demonstrated a possibility for operation by orbital angular momentum (OAM) of optical beams via the Pockels effect in solid-crystalline materials. Based on the analysis of an optical Fresnel ellipsoid perturbed by a conically shaped electric field, we have shown that the point groups of crystals convenient for the conversion of spin angular momentum (SAM) to OAM should contain a threefold symmetry axis or a sixfold inversion axis. The results of our experimental studies and theoretical simulations of the SAM-to-OAM conversion efficiency carried out for LiNbO{sub 3} crystals agree well with each other.

  9. Prospective effect in dispersion properties of photonic crystal fibers by selective water-filling of holes.

    PubMed

    Ghosh, Prasenjit; Sarkar, Somenath

    2016-01-20

    Based on a simple but accurate semivectorial solution of Helmholtz's equation by the finite difference method devised with a mode-field convergence technique, we have shown an interesting and significant effect showing an almost ultraflat zero group velocity dispersion in photonic crystal fiber when the holes of the first ring of the fiber are filled with water. Crosschecking our results with earlier results involving a deeply involved multipole method for the central core of photonic crystal fiber filled with water and fused silica, our observation in the case of filling the first ring holes with water reveals potential information in studies of supercontinuum generation. PMID:26835922

  10. Faraday effect in Sn2P2S6 crystals.

    PubMed

    Krupych, Oleh; Adamenko, Dmytro; Mys, Oksana; Grabar, Aleksandr; Vlokh, Rostyslav

    2008-11-10

    We have revealed a large Faraday rotation in tin thiohypodiphosphate (Sn(2)P(2)S(6)) crystals, which makes this material promising for magneto-optics. The effective Faraday tensor component and the Verdet constant for the direction of the optic axis have been determined by measuring the pure Faraday rotation in Sn(2)P(2)S(6) crystals with both the single-ray and small-angular polarimetric methods at the normal conditions and a wavelength of 632.8 nm. The effective Verdet constant is found to be equal to 115 rad/T x m. PMID:19002228

  11. Quantum effects for particles channeling in a bent crystal

    NASA Astrophysics Data System (ADS)

    Feranchuk, Ilya; San, Nguyen Quang

    2016-09-01

    Quantum mechanical theory for channeling of the relativistic charged particles in the bent crystals is considered in the paper. Quantum effects of under-barrier tunneling are essential when the radius of the curvature is closed to its critical value. In this case the wave functions of the quasi-stationary states corresponding to the particles captured in a channel are presented in the analytical form. The efficiency of channeling of the particles and their angular distribution at the exit crystal surface are calculated. Characteristic experimental parameters for observation the quantum effects are estimated.

  12. Effect of copper ions on the crystallization of bayer aluminium trihydroxide

    NASA Astrophysics Data System (ADS)

    Brown, N.

    1988-02-01

    The effect of copper ions on the crystallization of Bayer aluminium trihydroxide has been examined using the SEM/EDAX technique and particle size analyses. The presence of copper ions, presumably stabilised in solution as the cuprate(II) ion, disrupts the normal crystal growth process and induces secondary nucleation on the aluminium trihydroxide seed crystal surfaces. Although the copper ions adsorb preferentially on the (001) seed crystal surfaces, most of the new crystal formation occurs on the prismatic faces of the pseudo-hexagonal seed crystals. The roughened seed crystal surfaces and the tiny crystalline protrusions promote agglomeration of the seed crystals during subsequent crystallization.

  13. Direct and inverse magnetoelectric effects in HoAl{sub 3}(BO{sub 3}){sub 4} single crystal

    SciTech Connect

    Freydman, A. L.; Balaev, A. D.; Dubrovskiy, A. A.; Eremin, E. V.; Temerov, V. L.; Gudim, I. A.

    2014-05-07

    The direct (ME{sub H}-) and inverse (ME{sub E}-) magnetoelectric effects in the HoAl{sub 3}(BO{sub 3}){sub 4} single crystal are studied. Temperature and magnetic field dependences of permittivity of the crystal are investigated. A relation between the investigated effects was established. It was found that the magnetoelectric effect can exist in crystals without magnetic order or spontaneous polarization. It was shown that the phenomena investigated are due to magnetostriction or magnetoelastic effect. The thermodynamic potential was considered for describing magnetoelectric effect at low magnetic fields. The results obtained are explained within a proposed qualitative microscopic model, based on interplay of configuration of 4f- electron subshell of the rare-earth element and applied magnetic or electric field.

  14. Selective Precipitation and Concentrating of Perovskite Crystals from Titanium-Bearing Slag Melt in Supergravity Field

    NASA Astrophysics Data System (ADS)

    Gao, Jintao; Zhong, Yiwei; Guo, Zhancheng

    2016-06-01

    Selective precipitation and concentrating of perovskite crystals from titanium-bearing slag melt in the supergravity field was investigated in this study. Since perovskite was the first precipitated phase from the slag melt during the cooling process, and a greater precipitation quantity and larger crystal sizes of perovskite were obtained at 1593 K to 1563 K (1320 °C to 1290 °C), concentrating of perovskite crystals from the slag melt was carried out at this temperature range in the supergravity field, at which the perovskite transforms into solid particles while the other minerals remain in the liquid melt. The layered structures appeared significantly in the sample obtained by supergravity treatment, and all the perovskite crystals moved along the supergravity direction and concentrated as the perovskite-rich phase in the bottom area, whereas the molten slag concentrated in the upper area along the opposite direction, in which it was impossible to find any perovskite crystals. With the gravity coefficient of G = 750, the mass fraction of TiO2 in the perovskite-rich phase was up to 34.65 wt pct, whereas that of the slag phase was decreased to 12.23 wt pct, and the recovery ratio of Ti in the perovskite-rich phase was up to 75.28 pct. On this basis, an amplification experimental centrifugal apparatus was exploited and the continuous experiment with larger scale was further carried out, the results confirming that selective precipitation and concentrating of perovskite crystals from the titanium-bearing slag melt by supergravity was a feasible method.

  15. Selective Precipitation and Concentrating of Perovskite Crystals from Titanium-Bearing Slag Melt in Supergravity Field

    NASA Astrophysics Data System (ADS)

    Gao, Jintao; Zhong, Yiwei; Guo, Zhancheng

    2016-08-01

    Selective precipitation and concentrating of perovskite crystals from titanium-bearing slag melt in the supergravity field was investigated in this study. Since perovskite was the first precipitated phase from the slag melt during the cooling process, and a greater precipitation quantity and larger crystal sizes of perovskite were obtained at 1593 K to 1563 K (1320 °C to 1290 °C), concentrating of perovskite crystals from the slag melt was carried out at this temperature range in the supergravity field, at which the perovskite transforms into solid particles while the other minerals remain in the liquid melt. The layered structures appeared significantly in the sample obtained by supergravity treatment, and all the perovskite crystals moved along the supergravity direction and concentrated as the perovskite-rich phase in the bottom area, whereas the molten slag concentrated in the upper area along the opposite direction, in which it was impossible to find any perovskite crystals. With the gravity coefficient of G = 750, the mass fraction of TiO2 in the perovskite-rich phase was up to 34.65 wt pct, whereas that of the slag phase was decreased to 12.23 wt pct, and the recovery ratio of Ti in the perovskite-rich phase was up to 75.28 pct. On this basis, an amplification experimental centrifugal apparatus was exploited and the continuous experiment with larger scale was further carried out, the results confirming that selective precipitation and concentrating of perovskite crystals from the titanium-bearing slag melt by supergravity was a feasible method.

  16. A Lagrangian effective field theory

    SciTech Connect

    Vlah, Zvonimir; White, Martin; Aviles, Alejandro

    2015-09-02

    We have continued the development of Lagrangian, cosmological perturbation theory for the low-order correlators of the matter density field. We provide a new route to understanding how the effective field theory (EFT) of large-scale structure can be formulated in the Lagrandian framework and a new resummation scheme, comparing our results to earlier work and to a series of high-resolution N-body simulations in both Fourier and configuration space. The `new' terms arising from EFT serve to tame the dependence of perturbation theory on small-scale physics and improve agreement with simulations (though with an additional free parameter). We find that all of our models fare well on scales larger than about two to three times the non-linear scale, but fail as the non-linear scale is approached. This is slightly less reach than has been seen previously. At low redshift the Lagrangian model fares as well as EFT in its Eulerian formulation, but at higher z the Eulerian EFT fits the data to smaller scales than resummed, Lagrangian EFT. Furthermore, all the perturbative models fare better than linear theory.

  17. A Lagrangian effective field theory

    DOE PAGESBeta

    Vlah, Zvonimir; White, Martin; Aviles, Alejandro

    2015-09-02

    We have continued the development of Lagrangian, cosmological perturbation theory for the low-order correlators of the matter density field. We provide a new route to understanding how the effective field theory (EFT) of large-scale structure can be formulated in the Lagrandian framework and a new resummation scheme, comparing our results to earlier work and to a series of high-resolution N-body simulations in both Fourier and configuration space. The `new' terms arising from EFT serve to tame the dependence of perturbation theory on small-scale physics and improve agreement with simulations (though with an additional free parameter). We find that all ofmore » our models fare well on scales larger than about two to three times the non-linear scale, but fail as the non-linear scale is approached. This is slightly less reach than has been seen previously. At low redshift the Lagrangian model fares as well as EFT in its Eulerian formulation, but at higher z the Eulerian EFT fits the data to smaller scales than resummed, Lagrangian EFT. Furthermore, all the perturbative models fare better than linear theory.« less

  18. Vertically-Aligned Single-Crystal Nanocone Arrays: Controlled Fabrication and Enhanced Field Emission.

    PubMed

    Duan, Jing Lai; Lei, Dang Yuan; Chen, Fei; Lau, Shu Ping; Milne, William I; Toimil-Molares, M E; Trautmann, Christina; Liu, Jie

    2016-01-13

    Metal nanostructures with conical shape, vertical alignment, large ratio of cone height and curvature radius at the apex, controlled cone angle, and single-crystal structure are ideal candidates for enhancing field electron-emission efficiency with additional merits, such as good mechanical and thermal stability. However, fabrication of such nanostructures possessing all these features is challenging. Here, we report on the controlled fabrication of large scale, vertically aligned, and mechanically self-supported single-crystal Cu nanocones with controlled cone angle and enhanced field emission. The Cu nanocones were fabricated by ion-track templates in combination with electrochemical deposition. Their cone angle is controlled in the range from 0.3° to 6.2° by asymmetrically selective etching of the ion tracks and the minimum tip curvature diameter reaches down to 6 nm. The field emission measurements show that the turn-on electric field of the Cu nanocone field emitters can be as low as 1.9 V/μm at current density of 10 μA/cm(2) (a record low value for Cu nanostructures, to the best of our knowledge). The maximum field enhancement factor we measured was as large as 6068, indicating that the Cu nanocones are promising candidates for field emission applications. PMID:26666466

  19. Recent developments in Liquid Phase Electroepitaxial growth of bulk crystals under magnetic field

    NASA Astrophysics Data System (ADS)

    Dost, Sadik; Lent, Brian; Sheibani, Hamdi; Liu, Yongcai

    2004-05-01

    This review article presents recent developments in Liquid Phase Electroepitaxial (LPEE) growth of bulk single crystals of alloy semiconductors under an applied static magnetic field. The growth rate in LPEE is proportional to the applied electric current. However, at higher electric current levels the growth becomes unstable due to the strong convection occurring in the liquid zone. In order to address this problem, a significant body of research has been performed in recent years to suppress and control the natural convection for the purpose of prolonging the growth process to grow larger crystals. LPEE growth experiments show that the growth rate under an applied static magnetic field is also proportional and increases with the field intensity level. The modeling of LPEE growth under magnetic field was also the subject of interest. Two-dimensional mathematical models developed for the LPEE growth process predicted that the natural convection in the liquid zone would be suppressed almost completely with increasing the magnetic field level. However, experiments and also three-dimensional models have shown that there is an optimum magnetic field level below which the growth process is stable and the convection in the liquid zone is suppressed, but above such a field level the convective flow becomes very strong and leads to unstable growth with unstable interfaces. To cite this article: S. Dost et al., C. R. Mecanique 332 (2004).

  20. Temperature dependence of Fe/++/ crystal field spectra - Implications to mineralogical mapping of planetary surfaces

    NASA Technical Reports Server (NTRS)

    Sung, C.-M.; Singer, R. B.; Parkin, K. M.; Burns, R. G.; Osborne, M.

    1977-01-01

    Results are reported of Fe(++) crystal field spectral measurements for olivines and pyroxenes up to 400 C. The results are correlated with crystal structure data at elevated temperatures, and the validity of remote-sensed identifications of minerals on hot surfaces of the moon and Mercury is assessed. Two techniques were used to obtain spectra of minerals at elevated temperatures using a spectrophotometer. One employed a diamond cell assembly or a specially designed sample holder to measure polarized absorption spectra of heated single crystals. For the other technique, a sample holder was designed to attach to a diffuse reflectance accessory to produce reflectance spectra of heated powdered samples. Polarized absorption spectra of forsterite at 20-400 C are shown in a graph. Other graphs show the temperature dependence of Fe(++) crystal field bands in olivines, the diffuse reflectance spectra of olivine at 40-400 C, the polarization absorption spectra of orthopyroxene at 30-400 C, the diffuse reflectance spectra of pigeonite at 40-400 C, and unpolarized absorption spectra of lunar pyroxene from Apollo 15 rock 15058.

  1. DNA- and AC electric field-assisted assembly of two-dimensional colloidal photonic crystals and their controlled defect insertion

    NASA Astrophysics Data System (ADS)

    Kim, Sejong

    Photonic crystals (PC) are structures in which the refractive index is a periodic function in space. The ability of photonic crystals to localize and manipulate electromagnetic waves has attracted considerable attention from the scientific community. The self-assembly of monodisperse micrometer scale colloidal spheres into hexagonal closed-packed colloidal crystals provides a simple, fast, and cheap materials chemistry approach to PCs. Employing DNA supramolecular recognition, 2-dimensional (2D) photonic crystal monolayer was fabricated with monodisperse polystyrene colloidal microspheres. Amine-terminated DNA oligomers were covalently attached onto carboxy-decorated microspheres and enabled their DNA-functionalization while preserving their colloidal stability and organization properties. Following a capillary-force-assisted organization of DNA-decorated microspheres into close-packed 2D opaline arrays, the first monolayer was immobilized by DNA hybridization. Insertion of vacancies at predetermined sites within the lattice of colloidal crystals is a prerequisite in order to realize high-quality, opaline-based photonic devices. The previously obtained DNA-hybridization type binding of 2D-opaline arrays provides a heat-sensitive "adhesive" between substrate and microspheres within a surrounding aqueous medium that enables tuning the hybridization strength of DNA linker as well as a mechanism to facilitate the removal of unbound microspheres. Focusing a laser beam onto a single microsphere of the opaline array induces localized heating that enables the microsphere to detach, leaving behind vacancies. By repeating this process, line vacancies were successfully obtained. The effects of salt concentration, laser power, light-absorbing dyes, DNA length and refractive index mismatch were investigated and found to correlate with heat-induced DNA dehybridization. In addition, AC (alternating current) electrokinetic force was also utilized to obtain assembly of colloidal

  2. Effective field theory in nuclear physics

    SciTech Connect

    Martin J. Savage

    2000-12-12

    I review recent developments in the application of effective field theory to nuclear physics. Emphasis is placed on precision two-body calculations and efforts to formulate the nuclear shell model in terms of an effective field theory.

  3. Confined Crystal Growth in Space. Deterministic vs Stochastic Vibroconvective Effects

    NASA Astrophysics Data System (ADS)

    Ruiz, Xavier; Bitlloch, Pau; Ramirez-Piscina, Laureano; Casademunt, Jaume

    The analysis of the correlations between characteristics of the acceleration environment and the quality of the crystalline materials grown in microgravity remains an open and interesting question. Acceleration disturbances in space environments usually give rise to effective gravity pulses, gravity pulse trains of finite duration, quasi-steady accelerations or g-jitters. To quantify these disturbances, deterministic translational plane polarized signals have largely been used in the literature [1]. In the present work, we take an alternative approach which models g-jitters in terms of a stochastic process in the form of the so-called narrow-band noise, which is designed to capture the main statistical properties of realistic g-jitters. In particular we compare their effects so single-frequency disturbances. The crystalline quality has been characterized, following previous analyses, in terms of two parameters, the longitudinal and the radial segregation coefficients. The first one averages transversally the dopant distribution, providing continuous longitudinal information of the degree of segregation along the growth process. The radial segregation characterizes the degree of lateral non-uniformity of the dopant in the solid-liquid interface at each instant of growth. In order to complete the description, and because the heat flux fluctuations at the interface have a direct impact on the crystal growth quality -growth striations -the time dependence of a Nusselt number associated to the growing interface has also been monitored. For realistic g-jitters acting orthogonally to the thermal gradient, the longitudinal segregation remains practically unperturbed in all simulated cases. Also, the Nusselt number is not significantly affected by the noise. On the other hand, radial segregation, despite its low magnitude, exhibits a peculiar low-frequency response in all realizations. [1] X. Ruiz, "Modelling of the influence of residual gravity on the segregation in

  4. Heteromorphism and crystallization paths of katungites, Navajo volcanic field, Arizona, USA

    SciTech Connect

    Laughlin, A.W.; Charles, R.W.; Aldrich, M.J. Jr.

    1986-01-01

    A swarm of thin, isochemical but heteromorphic dikes crops out in the valley of Hasbidito Creek in NE Arizona. The swarm is part of the dominantly potassic, mid-Tertiary Navajo volcanic field of the Colorado Plateau. Whole-rock chemical analyses of five samples from four of the dikes indicate that they are chemically identical to the katungites of Uganda. These dikes show the characteristic seriate-porphyritic texture of lamprophyres. Samples of an olivine-melilitite dike from the same swarm lack this texture and the chemical analysis, while similar to those of the other dikes, shows effects from the incorporation of xenocrystic olivine. Over 20 mineral phases have been identified in the Arizona samples and as many as 18 phases may occur in a single sample. The major phases are phlogopite, olivine, perovskite, opaque oxides, +- melilite and +- clinopyroxene. Based upon the modal mineralogies and textures of ten dike samples, we recognize five general non-equilibrium assemblages. Comparison of these assemblages with recent experimental results shows that they represent various combinations of complete and incomplete reactions. Reaction relations were determined by entering melt and phase compositions into the computer program GENMIX to obtain balanced reactions. By combining petrographic observations with mineral chemical data, balanced reactions from GENMIX, and the recently determined phase diagrams we are able to trace crystallization paths for the katungite magma.

  5. Velocity profiles of electric-field-induced backflows in liquid crystals confined between parallel plates

    NASA Astrophysics Data System (ADS)

    Tsuji, Tomohiro; Chono, Shigeomi; Matsumi, Takanori

    2015-02-01

    For the purpose of developing liquid crystalline microactuators, we visualize backflows induced between two parallel plates for various parameters such as the twist angle, cell gap, applied voltage, and molecular configuration mode. We use 4-cyano-4'-pentyl biphenyl, a typical low-molar-mass nematic liquid crystal. By increasing the twist angle from 0° to 180°, the velocity component parallel to the anchoring direction of the lower plate changes from an S-shaped profile to a distorted S-shaped profile before finally becoming unidirectional. In contrast, the velocity component perpendicular to the anchoring direction evolves from a flat profile at 0° into an S-shaped profile at 180°. Because both an increase in the applied voltage and a decrease in the cell gap increase the electric field intensity, the backflow becomes large. The hybrid molecular configuration mode induces a larger backflow than that for the planar aligned mode. The backflow develops in two stages: an early stage with a microsecond time scale and a later stage with a millisecond time scale. The numerical predictions are in qualitative agreement with the measurements, but not quantitative agreement because our computation ignores the plate edge effect of surface tension.

  6. Magnetostrictive behaviors of Fe-Si(001) single-crystal films under rotating magnetic fields

    NASA Astrophysics Data System (ADS)

    Kawai, Tetsuroh; Aida, Takuya; Ohtake, Mitsuru; Futamoto, Masaaki

    2015-05-01

    Magnetostrictive behaviors under rotating magnetic fields are investigated for bcc(001) single-crystal films of Fe100-x-Six(x = 0, 6, 10 at. %). The magnetostriction observation directions are along bcc[100] and bcc[110] of the films. The magnetostriction waveform varies greatly depending on the observation direction. For the observation along [100], the magnetostriction waveform of all the films is bathtub-like and the amplitude stays at almost constant even when the magnetic field is increased up to the anisotropy field. On the other hand, the waveform along [110] is triangular and the amplitude increases with increasing magnetic field up to the anisotropy field and then saturates. In addition, the waveform of Fe90Si10 film is distorted triangular when the applied magnetic fields are less than its anisotropy field. These magnetostrictive behaviors under rotating magnetic fields are well explained by employing a proposed modified coherent rotation model where the anisotropy field and the magnetization reversal field are determined by using measured magnetization curves. The results show that magnetocrystalline anisotropy plays important role on magnetostrictive behavior under rotating magnetic fields.

  7. Flow and temperature field measurements of thermal convection in a small vertical gap using liquid crystals

    NASA Astrophysics Data System (ADS)

    Heiland, Hans Georg; Wozniak, Günter; Wozniak, Klaus

    2007-07-01

    Thermal convection in a small vertical gap is studied experimentally applying digital particle image velocimetry/thermometry. This optical method enables the simultaneous measurement of two-dimensional flow and temperature fields in a liquid. The principle is based on seeding the liquid flow medium with thermochromic liquid crystal particles. The temperature is measured by the crystal particles which change their reflected colour as function of temperature. The flow velocity is measured by using the same particles as flow tracers. The investigation shall contribute to the understanding of the fluid mechanical behaviour of biological liquids within micro reactor systems. However, the problem is also of fundamental interest as far as heat and mass transfer is concerned. Measured temperature and flow velocity fields are presented and discussed.

  8. Comprehensive Spectroscopic Determination of the Crystal Field Splitting in an Erbium Single-Ion Magnet.

    PubMed

    Rechkemmer, Yvonne; Fischer, Julia E; Marx, Raphael; Dörfel, María; Neugebauer, Petr; Horvath, Sebastian; Gysler, Maren; Brock-Nannestad, Theis; Frey, Wolfgang; Reid, Michael F; van Slageren, Joris

    2015-10-14

    The electronic structure of a novel lanthanide-based single-ion magnet, {C(NH2)3}5[Er(CO3)4]·11H2O, was comprehensively studied by means of a large number of different spectroscopic techniques, including far-infrared, optical, and magnetic resonance spectroscopies. A thorough analysis, based on crystal field theory, allowed an unambiguous determination of all relevant free ion and crystal field parameters. We show that inclusion of methods sensitive to the nature of the lowest-energy states is essential to arrive at a correct description of the states that are most relevant for the static and dynamic magnetic properties. The spectroscopic investigations also allowed for a full understanding of the magnetic relaxation processes occurring in this system. Thus, the importance of spectroscopic studies for the improvement of single-molecule magnets is underlined. PMID:26394012

  9. Emergence of foams from the breakdown of the phase field crystal model

    NASA Astrophysics Data System (ADS)

    Guttenberg, Nicholas; Goldenfeld, Nigel; Dantzig, Jonathan

    2010-06-01

    The phase field crystal (PFC) model captures the elastic and topological properties of crystals with a single scalar field at small undercooling. At large undercooling, new foamlike behavior emerges. We characterize this foam phase of the PFC equation and propose a modified PFC equation that may be used for the simulation of foam dynamics. This minimal model reproduces von Neumann’s rule for two-dimensional dry foams and Lifshitz-Slyozov coarsening for wet foams. We also measure the coordination number distribution and find that its second moment is larger than previously reported experimental and theoretical studies of soap froths, a finding that we attribute to the wetness of the foam increasing with time.

  10. Direct mapping of local director field of nematic liquid crystals at the nanoscale.

    PubMed

    Xia, Yu; Serra, Francesca; Kamien, Randall D; Stebe, Kathleen J; Yang, Shu

    2015-12-15

    Liquid crystals (LCs), owing to their anisotropy in molecular ordering, are of wide interest in both the display industry and soft matter as a route to more sophisticated optical objects, to direct phase separation, and to facilitate colloidal assemblies. However, it remains challenging to directly probe the molecular-scale organization of nonglassy nematic LC molecules without altering the LC directors. We design and synthesize a new type of nematic liquid crystal monomer (LCM) system with strong dipole-dipole interactions, resulting in a stable nematic phase and strong homeotropic anchoring on silica surfaces. Upon photopolymerization, the director field can be faithfully "locked," allowing for direct visualization of the LC director field and defect structures by scanning electron microscopy (SEM) in real space with 100-nm resolution. Using this technique, we study the nematic textures in more complex LC/colloidal systems and calculate the extrapolation length of the LCM. PMID:26621729

  11. Direct mapping of local director field of nematic liquid crystals at the nanoscale

    PubMed Central

    Xia, Yu; Serra, Francesca; Kamien, Randall D.; Stebe, Kathleen J.; Yang, Shu

    2015-01-01

    Liquid crystals (LCs), owing to their anisotropy in molecular ordering, are of wide interest in both the display industry and soft matter as a route to more sophisticated optical objects, to direct phase separation, and to facilitate colloidal assemblies. However, it remains challenging to directly probe the molecular-scale organization of nonglassy nematic LC molecules without altering the LC directors. We design and synthesize a new type of nematic liquid crystal monomer (LCM) system with strong dipole–dipole interactions, resulting in a stable nematic phase and strong homeotropic anchoring on silica surfaces. Upon photopolymerization, the director field can be faithfully “locked,” allowing for direct visualization of the LC director field and defect structures by scanning electron microscopy (SEM) in real space with 100-nm resolution. Using this technique, we study the nematic textures in more complex LC/colloidal systems and calculate the extrapolation length of the LCM. PMID:26621729

  12. Novel magnetic field sensor based on magnetic fluids infiltrated dual-core photonic crystal fibers

    NASA Astrophysics Data System (ADS)

    Li, Jianhua; Wang, Rong; Wang, Jingyuan; Zhang, Baofu; Xu, Zhiyong; Wang, Huali

    2014-03-01

    Novel magnetic field sensor based on magnetic fluids infiltrated dual-core Photonic Crystal Fibers (PCFs) is proposed in this paper. Inside the cross-section of the designed PCFs, the two fiber cores filled with magnetic fluids (Fe3O4) are separated by an air hole, and then form two independent waveguides with mode coupling. The mode coupling under different magnetic field strength is investigated theoretically. A novel and simple magnetic field sensing system is proposed and its sensing performances have been studied numerically. The results show that the magnetic field sensor with 15-cm PCFs has a large sensing range and high sensitivity of 4.80 pm/Oe. It provides a new feasible method to design PCF-based magnetic field sensor.

  13. Low-field magnetic torque of a single crystal MgB 2

    NASA Astrophysics Data System (ADS)

    Atsumi, Toshiyuki; Tsuji, Mitsuyuki; Xu, Mingxiang; Kitazawa, Hideaki; Ishida, Takekazu

    2003-10-01

    We have investigated the magnetic torque of MgB 2 single crystal synthesized by the vapor transport method. We use a torque magnetometer consisting of a 4-K closed cycle refrigerator and a variable field permanent magnet up to 10 kG. The torque can be measured as an off-balance signal of the Wheatstone bridge of the four piezoresistors on a Si cantilever. The torque curves are analyzed by the Kogan model. The superconducting anisotropy γ is rather independent of temperature, but is dependent on field. As expected from the BCS theory, the prefactor of the Kogan formula, which corresponds to the lower critical field Hc1, changes smoothly as a function of temperature. We consider that the field dependence of γ comes from the multiple superconducting gaps and their different upper critical fields Hc2.

  14. Effective field theory, past and future

    NASA Astrophysics Data System (ADS)

    Weinberg, Steven

    2016-02-01

    I reminisce about the early development of effective field theories of the strong interactions, comment briefly on some other applications of effective field theories, and then take up the idea that the Standard Model and General Relativity are the leading terms in an effective field theory. Finally, I cite recent calculations that suggest that the effective field theory of gravitation and matter is asymptotically safe.

  15. Enhanced magnetic-field-induced optical properties of nanostructured magnetic fluids by doping nematic liquid crystals

    NASA Astrophysics Data System (ADS)

    Wang, Xiang; Pu, Shengli; Ji, Hongzhu; Yu, Guojun

    2012-05-01

    Ferronematic materials composed of 4-cyano-4'-pentylbiphenyl nematic liquid crystal and oil-based Fe3O4 magnetic fluid were prepared using ultrasonic agitation. The birefringence (Δ n) and figure of merit of optical properties ( Q = Δ n/α, where α is the extinction coefficient) of pure magnetic fluids and the as-prepared ferronematic materials were examined and compared. The figure of merit of optical properties weighs the birefringence and extinction of the materials and is more appropriate to evaluate their optical properties. Similar magnetic-field- and magnetic-particle-concentration-dependent properties of birefringence and figure of merit of optical properties were obtained for the pure magnetic fluids and the ferronematic materials. For the ferronematic materials, the values of Q increase with the volume fractions of nematic liquid crystal under certain fixed field strength and are larger than those of their corresponding pure magnetic fluids at high field region. In addition, the enhancement of Q value increases monotonously with the magnetic field and becomes remarkable when the applied magnetic field is beyond 50 mT. The maximum relative enhanced value of Q R exceeds 6.8% in our experiments. The results of this work may conduce to extend the pragmatic applications of nanostructured magnetic fluids in optical field.

  16. Enhanced magnetic-field-induced optical properties of nanostructured magnetic fluids by doping nematic liquid crystals.

    PubMed

    Wang, Xiang; Pu, Shengli; Ji, Hongzhu; Yu, Guojun

    2012-01-01

    Ferronematic materials composed of 4-cyano-4'-pentylbiphenyl nematic liquid crystal and oil-based Fe3O4 magnetic fluid were prepared using ultrasonic agitation. The birefringence (Δn) and figure of merit of optical properties (Q = Δn/α, where α is the extinction coefficient) of pure magnetic fluids and the as-prepared ferronematic materials were examined and compared. The figure of merit of optical properties weighs the birefringence and extinction of the materials and is more appropriate to evaluate their optical properties. Similar magnetic-field- and magnetic-particle-concentration-dependent properties of birefringence and figure of merit of optical properties were obtained for the pure magnetic fluids and the ferronematic materials. For the ferronematic materials, the values of Q increase with the volume fractions of nematic liquid crystal under certain fixed field strength and are larger than those of their corresponding pure magnetic fluids at high field region. In addition, the enhancement of Q value increases monotonously with the magnetic field and becomes remarkable when the applied magnetic field is beyond 50 mT. The maximum relative enhanced value of QR exceeds 6.8% in our experiments. The results of this work may conduce to extend the pragmatic applications of nanostructured magnetic fluids in optical field. PMID:22587542

  17. Enhanced magnetic-field-induced optical properties of nanostructured magnetic fluids by doping nematic liquid crystals

    PubMed Central

    2012-01-01

    Ferronematic materials composed of 4-cyano-4′-pentylbiphenyl nematic liquid crystal and oil-based Fe3O4 magnetic fluid were prepared using ultrasonic agitation. The birefringence (Δn) and figure of merit of optical properties (Q = Δn/α, where α is the extinction coefficient) of pure magnetic fluids and the as-prepared ferronematic materials were examined and compared. The figure of merit of optical properties weighs the birefringence and extinction of the materials and is more appropriate to evaluate their optical properties. Similar magnetic-field- and magnetic-particle-concentration-dependent properties of birefringence and figure of merit of optical properties were obtained for the pure magnetic fluids and the ferronematic materials. For the ferronematic materials, the values of Q increase with the volume fractions of nematic liquid crystal under certain fixed field strength and are larger than those of their corresponding pure magnetic fluids at high field region. In addition, the enhancement of Q value increases monotonously with the magnetic field and becomes remarkable when the applied magnetic field is beyond 50 mT. The maximum relative enhanced value of QR exceeds 6.8% in our experiments. The results of this work may conduce to extend the pragmatic applications of nanostructured magnetic fluids in optical field. PMID:22587542

  18. Observation of nonlinear bands in near-field scanning optical microscopy of a photonic-crystal waveguide

    SciTech Connect

    Singh, A.; Huisman, S. R.; Ctistis, G. Mosk, A. P.; Pinkse, P. W. H.; Korterik, J. P.; Herek, J. L.

    2015-01-21

    We have measured the photonic bandstructure of GaAs photonic-crystal waveguides with high resolution in energy as well as in momentum using near-field scanning optical microscopy. Intriguingly, we observe additional bands that are not predicted by eigenmode solvers, as was recently demonstrated by Huisman et al. [Phys. Rev. B 86, 155154 (2012)]. We study the presence of these additional bands by performing measurements of these bands while varying the incident light power, revealing a non-linear power dependence. Here, we demonstrate experimentally and theoretically that the observed additional bands are caused by a waveguide-specific near-field tip effect not previously reported, which can significantly phase-modulate the detected field.

  19. Observation of nonlinear bands in near-field scanning optical microscopy of a photonic-crystal waveguide

    NASA Astrophysics Data System (ADS)

    Singh, A.; Ctistis, G.; Huisman, S. R.; Korterik, J. P.; Mosk, A. P.; Herek, J. L.; Pinkse, P. W. H.

    2015-01-01

    We have measured the photonic bandstructure of GaAs photonic-crystal waveguides with high resolution in energy as well as in momentum using near-field scanning optical microscopy. Intriguingly, we observe additional bands that are not predicted by eigenmode solvers, as was recently demonstrated by Huisman et al. [Phys. Rev. B 86, 155154 (2012)]. We study the presence of these additional bands by performing measurements of these bands while varying the incident light power, revealing a non-linear power dependence. Here, we demonstrate experimentally and theoretically that the observed additional bands are caused by a waveguide-specific near-field tip effect not previously reported, which can significantly phase-modulate the detected field.

  20. Effective vibration isolation system for perfect-crystal neutron interferometry

    SciTech Connect

    Arthur, J.

    1985-01-01

    Perfect-crystal neutron interferometers are subject to degradation of their performance caused by vibrational accelerations. It is shown that the most seriously offending accelerations are rotational, and an effective and simple vibration isolation system that has been developed at the MIT Neutron Diffraction Laboratory is described.

  1. 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.

  2. Dust Lattice Waves in Two-Dimensional Hexagonal Dust Crystals with an External Magnetic Field

    SciTech Connect

    Farokhi, B.; Shahmansouri, M.

    2008-09-07

    The influence of a constant magnetic field on the propagation of dust-lattice (DL) modes in a two-dimensional hexagonal strongly coupled plasma crystal formed by paramagnetic particles is considered. The expression for the wave dispersion relation clearly shows that high-frequency and low-frequency branches exist as a result of the coupling of longitudinal and transverse modes due to the Lorentz force acting on the dust particles.

  3. Consideration of the condensation processes of thin films in the crystal substrate's potential field

    NASA Astrophysics Data System (ADS)

    Tupik, V. A.; Margolin, V. I.; Trong Su, Chu

    2016-07-01

    The condensation process of a single particle in an ideal crystal substrate's potential field is considered. The optimal deposition path and the potential barrier of deposited particle's motion are shown. Some computer modeling examples of thin film's growth process were carried out on the basis of the implemented programs. A fractal analysis of obtained thin films was made, on the basis of which the possibility of estimating the performance of thin film's growth process will be discussed.

  4. Extended phase diagram of the three-dimensional phase field crystal model.

    PubMed

    Jaatinen, A; Ala-Nissila, T

    2010-05-26

    We determine the phase diagram of the phase field crystal model in three dimensions by using numerical free energy minimization methods. Previously published results, based on single mode approximations, have indicated that in addition to the uniform (liquid) phase, there would be regions of stability of body-centered cubic, hexagonal and stripe phases. We find that in addition to these, there are also regions of stability of face-centered cubic and hexagonal close packed structures in this model. PMID:21393705

  5. Crystalline sulfur dioxide: Crystal field splittings, absolute band intensities, and complex refractive indices derived from infra-red spectra

    NASA Astrophysics Data System (ADS)

    Khanna, R. K.; Zhao, Guizhi; Ospina, M. J.; Pearl, J. C.

    The infra-red absorption spectra of thin crystalline films of sulfur dioxide at 90 K are reported in the 2700-450 cm -1 region. The observed multiplicity of the bands in the regions of fundamental modes is attributed to crystal field effects, including factor group and LO—TO splittings, and naturally present minor 34S, 36S and 18O substituted isotopic species. Complex refractive indices determined by an iterative Kramers—Kronig analysis of the extinction data, and absolute band strengths derived from them, are also reported in this region.

  6. Nucleation and Convection Effects in Protein Crystal Growth

    NASA Technical Reports Server (NTRS)

    Rosenberger, Franz

    1997-01-01

    Work during the second year under this grant (NAG8-1161) resulted in several major achievements. We have characterized protein impurities as well as microheterogeneities in the proteins hen egg white lysozyme and horse spleen apoferritin, and demonstrated the effects of these impurities on nucleation and crystallization. In particular, the purification of apoferritin resulted in crystals with an X-ray diffraction resolution of better than 1.8 A, i.e. a 1 A improvement over earlier work on the cubic form. Furthermore, we have shown, in association with studies of liquid-liquid phase separation, that depending on the growth conditions, lysozyme can produce all growth morphologies that have been observed with other proteins. Finally, in connection with our experimental and simulation work on growth step bunching, we have developed a system-dependent criterion for advantages and disadvantages of crystallization from solution under reduced gravity. In the following, these efforts are described in some detail.

  7. Effect of crystal habit on the dissolution behaviour of simvastatin crystals and its relationship to crystallization solvent properties.

    PubMed

    Bukovec, P; Benkic, P; Smrkolj, M; Vrecer, F

    2016-05-01

    Simvastatin crystals, having same crystal structure but different types of habits and hence different intrinsic dissolution rate, were prepared by recrystallization from solvents selected according to their polarity index. Scanning electron microscopy, laser diffraction, image analysis, X-ray powder diffractometry, Fourier transform infrared spectroscopy and differential scanning calorimetry were used to investigate the physicochemical characteristics of the prepared crystals. The isolated crystals exhibited different crystal habits but possessed the same internal crystal structure. In this study the comparative intrinsic dissolution behaviour of the simvastatin crystals with different types of habits was studied and explained by surface energy and correlated to different solvent systems that were used for crystallization. In our work we diminished the influence of all other physical parameters that could influence the dissolution rate, e.g. particle size, specific surface area and polymorphism in order to focus the study onto the impact of crystal shape itself on the dissolution rate of simvastatin crystals. Rod shaped crystals isolated from more hydrophilic solvent mixture dissolved faster than plate-like crystals obtained from solvent mixture with lower polarity index. We correlated this fact to the different growth rate of the individual faces which resulted in different relative size of the individual crystal faces exposed to the dissolution medium as well as the chemical nature of those faces which in turn influenced the wettability and subsequent dissolution of the active pharmaceutical ingredient. PMID:27348970

  8. A polarization independent liquid crystal phase modulation adopting surface pinning effect of polymer dispersed liquid crystals

    NASA Astrophysics Data System (ADS)

    Lin, Yi-Hsin; Tsou, Yu-Shih

    2011-12-01

    A polarization-independent liquid crystal (LC) phase modulation using the surface pinning effect of polymer dispersed liquid crystals (SP-PDLC) is demonstrated. In the bulk region of the SP-PDLC, the orientations of LC directors are randomly dispersed; thus, any polarization of incident light experiences the same averaged refractive index. In the regions near glass substrates, the LC droplets are pinned. The orientations of top and bottom droplets are orthogonal. Two eigen-polarizations of an incident light experience the same phase shift. As a result, the SP-PDLC is polarization independent. Polarizer-free microlens arrays of SP-PDLC are also demonstrated. The SP-PDLC has potential for application in spatial light modulators, laser beam steering, and electrically tunable microprisms.

  9. Effective bichromatic potential for ultra-high Q-factor photonic crystal slab cavities

    SciTech Connect

    Alpeggiani, Filippo Andreani, Lucio Claudio; Gerace, Dario

    2015-12-28

    We introduce a confinement mechanism in photonic crystal slab cavities, which relies on the superposition of two incommensurate one-dimensional lattices in a line-defect waveguide. It is shown that the resulting photonic profile realizes an effective quasi-periodic bichromatic potential for the electromagnetic field confinement yielding extremely high quality (Q) factor nanocavities, while simultaneously keeping the mode volume close to the diffraction limit. We apply these concepts to pillar- and hole-based photonic crystal slab cavities, respectively, and a Q-factor improvement by over an order of magnitude is shown over existing designs, especially in pillar-based structures. Thanks to the generality and easy adaptation of such confinement mechanism to a broad class of cavity designs and photonic lattices, this work opens interesting routes for applications where enhanced light–matter interaction in photonic crystal structures is required.

  10. A molecular-field approximation for quantum crystals. Ph.D. Thesis; [considering ground state properties

    NASA Technical Reports Server (NTRS)

    Danilowicz, R.

    1973-01-01

    Ground-state properties of quantum crystals have received considerable attention from both theorists and experimentalists. The theoretical results have varied widely with the Monte Carlo calculations being the most successful. The molecular field approximation yields ground-state properties which agree closely with the Monte Carlo results. This approach evaluates the dynamical behavior of each pair of molecules in the molecular field of the other N-2 molecules. In addition to predicting ground-state properties that agree well with experiment, this approach yields data on the relative importance of interactions of different nearest neighbor pairs.

  11. A photonic-crystal optical antenna for extremely large local-field enhancement.

    PubMed

    Chang, Hyun-Joo; Kim, Se-Heon; Lee, Yong-Hee; Kartalov, Emil P; Scherer, Axel

    2010-11-01

    We propose a novel design of an all-dielectric optical antenna based on photonic-band-gap confinement. Specifically, we have engineered the photonic-crystal dipole mode to have broad spectral response (Q~70) and well-directed vertical-radiation by introducing a plane mirror below the cavity. Considerably large local electric-field intensity enhancement~4,500 is expected from the proposed design for a normally incident planewave. Furthermore, an analytic model developed based on coupled-mode theory predicts that the electric-field intensity enhancement can easily be over 100,000 by employing reasonably high-Q (~10,000) resonators. PMID:21164762

  12. Capacitance changes in ferronematic liquid crystals induced by low magnetic fields

    NASA Astrophysics Data System (ADS)

    Tomašovičová, Natália; Timko, Milan; Mitróová, Zuzana; Koneracká, Martina; Rajňak, Michal; Éber, Nándor; Tóth-Katona, Tibor; Chaud, Xavier; Jadzyn, Jan; Kopčanský, Peter

    2013-01-01

    The response in capacitance to low external magnetic fields (up to 0.1 T) of suspensions of spherical magnetic nanoparticles, single-wall carbon nanotubes (SWCNT), SWCNT functionalized with carboxyl group (SWCNT-COOH), and SWCNT functionalized with Fe3O4 nanoparticles in a nematic liquid crystal has been studied experimentally. The volume concentration of nanoparticles was ϕ1=10-4 and ϕ2=10-3. Independent of the type and the volume concentration of the nanoparticles, a linear response to low magnetic fields (far below the magnetic Fréederiksz transition threshold) has been observed, which is not present in the undoped nematic.

  13. Crystal fields of porphyrins and phthalocyanines from polarization-dependent 2p-to-3d multiplets

    SciTech Connect

    Johnson, Phillip S.; Boukahil, Idris; Himpsel, F. J.; García-Lastra, J. M.; Kennedy, Colton K.; Jersett, Nathan J.; Cook, Peter L.

    2014-03-21

    Polarization-dependent X-ray absorption spectroscopy is combined with density functional calculations and atomic multiplet calculations to determine the crystal field parameters 10Dq, Ds, and Dt of transition metal phthalocyanines and octaethylporphyrins (Mn, Fe, Co, Ni). The polarization dependence facilitates the assignment of the multiplets in terms of in-plane and out-of-plane orbitals and avoids ambiguities. Crystal field values from density functional calculations provide starting values close to the optimum fit of the data. The resulting systematics of the crystal field can be used for optimizing electron-hole separation in dye-sensitized solar cells.

  14. In-situ observation of electric-field-induced acceleration in crystal growth of tetrathiafulvalene-tetracyanoquinodimethane

    NASA Astrophysics Data System (ADS)

    Sakai, Masatoshi; Kuniyoshi, Shigekazu; Yamauchi, Hiroshi; Iizuka, Masaaki; Nakamura, Masakazu; Kudo, Kazuhiro

    2013-04-01

    In-situ observations of vapor-phase growth of tetrathiafulvalene (TTF)-tetracyanoquinodimethane (TCNQ) crystals under an electric field were conducted without influencing the actual crystal growth process. The shortest incubation time of TTF-TCNQ nuclei and the highest initial growth rate of the crystals are obtained on the anode side and in high electric field regions. It is demonstrated that the distribution of molecules thermally diffusing on the substrate surface is controlled by an external electric field. These results indicate the potential for selective growth of highly conductive organic wires for micro- and nanoscale wiring in organic nanodevices.

  15. Field-induced enhancement of voltage-controlled diffractive properties in paraelectric iron and manganese co-doped potassium-tantalate-niobate crystal

    NASA Astrophysics Data System (ADS)

    Wang, Lei; Tian, Hao; Meng, Xiangda; Chen, Huishun; Zhou, Zhongxiang; Shen, Yanqing

    2014-11-01

    High voltage-controlled diffraction efficiency of 78.3% was obtained in paraelectric potassium-tantalate-niobate crystal co-doped with iron and manganese. It was found that the recording time required to achieve maximum diffraction efficiency can be significantly reduced through the application of an external electric field on the crystal during writing. More importantly, the maximum diffraction efficiency maintained a considerably high value under a low external field at different writing angles. The external-field-enhanced space-charge fields were also calculated to interpret the important role of the enhancement effect. The results show that employing an enhanced electric field is of great significance for electroholography device applications.

  16. Lensing effects in a nematic liquid crystal with topological defects.

    PubMed

    Sátiro, C; Moraes, F

    2006-06-01

    Light traveling through a liquid crystal with disclinations perceives a geometrical background which causes lensing effects similar to the ones predicted for cosmic objects like global monopoles and cosmic strings. In this paper we explore the effective geometry as perceived by light in such media. The comparison between both systems suggests that experiments can be done in the laboratory to simulate optical properties, like gravitational lensing, of cosmic objects. PMID:16775663

  17. The Effect of Aerosil Network on Liquid Crystal (4O.8) Phase Transition

    NASA Astrophysics Data System (ADS)

    Ramazanoglu, Mehmet; Larochelle, Simon; Birgeneau, Robert J.

    2005-03-01

    We report a high resolution x-ray diffraction study of the nematic (N) to smectic-A (SmA) transition in the single-layer smectic (SmAm) liquid crystal butyloxybenzylidene octylaniline (4O.8) within aerosil dispersion. Aerosils are dispersed in liquid crystal material with a broad range concentration. They dramatically affect the phase transition properties in different liquid crystals [1]. These effects were studied in the view of random field theory introduced by quenched randomness of the silica gel network. The second order N-SmA phase transition and strong first order SmA-CrB freezing transitions are shifted to lower temperatures. SmA line-shape is broadened indicating a short-range order. Correlation lengths and power-law fits show behavior similar to bilayer SmAd liquid crystals. The present work enables us to test our understanding of random field effects introduced by dispersed aerosils forming a network in SmAm material. [1] S. Park, R.L. Leheny, R.J. Birgeneau, J.-L. Gallani, C.W. Garland and G.S. Iannacchione, Phys. Rev. E 65 050703(R) (2002)

  18. Crystal structure and high-field magnetism of La{sub 2}CuO{sub 4}

    SciTech Connect

    Reehuis, M.; Ulrich, C.; Keimer, B.; Prokes, K.; Gozar, A.; Blumberg, G.; Komiya, Seiki; Ando, Yoichi; Pattison, P.

    2006-04-01

    Neutron diffraction was used to determine the crystal structure and magnetic ordering pattern of a La{sub 2}CuO{sub 4} single crystal, with and without applied magnetic field. A previously unreported, subtle monoclinic distortion of the crystal structure away from the orthorhombic space group Bmab was detected. The distortion is also present in lightly Sr-doped crystals. A refinement of the crystal structure shows that the deviation from orthorhombic symmetry is predominantly determined to drive a continuous reorientation of the copper spins from the orthorhombic b axis to the c axis, directly confirming predictions based on prior magnetoresistance and Raman scattering experiments. A spin-flop transition induced by a c-axis oriented field previously reported for nonstoichiometric La{sub 2}CuO{sub 4} is also observed, but the transition field (11.5 T) is significantly larger than that in the previous work.

  19. Photonic crystal cavities for resonant evanescent field trapping of single bacteria

    NASA Astrophysics Data System (ADS)

    van Leest, Thijs; Heldens, Jeroen; van der Gaag, Bram; Caro, Jaap

    2012-06-01

    In monitoring the quality of drinking water with respect to the presence of hazardous bacteria there is a strong need for on-line sensors that allow quick identification of bacterium species at low cost. In this respect, the combination of photonics and microfluidics is promising for lab-on-a-chip sensing of these contaminants. Photonic crystal slabs have proven to form a versatile platform for controlling the flow of light and creating resonant cavities on a wavelength scale. The goal of our research is to use photonic crystal cavities for optical trapping of microorganisms in water, exploiting the enhanced evanescent field of the cavity mode. We optimize the H0, H1 and L3 cavities for optical trapping of bacteria in water, by reducing out-of-plane losses and taking into account the trapping-induced resonance shift and the in-plane coupling with photonic crystal waveguides. The cavities are fabricated on silicon-on-insulator material, using e-beam lithography and dry etching. A fluidic channel is created on top of the photonic crystal using dry film resist techniques. Transmission measurements show clear resonances for the cavities in water. In the present state of our research, we demonstrate optical trapping of 1 μm diameter polystyrene beads for the three cavities, with estimated trapping forces on the order of 0.7 pN.

  20. Theoretically informed Monte Carlo simulation of liquid crystals by sampling of alignment-tensor fields

    SciTech Connect

    Armas-Pérez, Julio C.; Londono-Hurtado, Alejandro; Guzmán, Orlando; Hernández-Ortiz, Juan P.; Pablo, Juan J. de

    2015-07-28

    A theoretically informed coarse-grained Monte Carlo method is proposed for studying liquid crystals. The free energy functional of the system is described in the framework of the Landau-de Gennes formalism. The alignment field and its gradients are approximated by finite differences, and the free energy is minimized through a stochastic sampling technique. The validity of the proposed method is established by comparing the results of the proposed approach to those of traditional free energy minimization techniques. Its usefulness is illustrated in the context of three systems, namely, a nematic liquid crystal confined in a slit channel, a nematic liquid crystal droplet, and a chiral liquid crystal in the bulk. It is found that for systems that exhibit multiple metastable morphologies, the proposed Monte Carlo method is generally able to identify lower free energy states that are often missed by traditional approaches. Importantly, the Monte Carlo method identifies such states from random initial configurations, thereby obviating the need for educated initial guesses that can be difficult to formulate.

  1. Theoretically informed Monte Carlo simulation of liquid crystals by sampling of alignment-tensor fields.

    SciTech Connect

    Armas-Perez, Julio C.; Londono-Hurtado, Alejandro; Guzman, Orlando; Hernandez-Ortiz, Juan P.; de Pablo, Juan J.

    2015-07-27

    A theoretically informed coarse-grained Monte Carlo method is proposed for studying liquid crystals. The free energy functional of the system is described in the framework of the Landau-de Gennes formalism. The alignment field and its gradients are approximated by finite differences, and the free energy is minimized through a stochastic sampling technique. The validity of the proposed method is established by comparing the results of the proposed approach to those of traditional free energy minimization techniques. Its usefulness is illustrated in the context of three systems, namely, a nematic liquid crystal confined in a slit channel, a nematic liquid crystal droplet, and a chiral liquid crystal in the bulk. It is found that for systems that exhibit multiple metastable morphologies, the proposed Monte Carlo method is generally able to identify lower free energy states that are often missed by traditional approaches. Importantly, the Monte Carlo method identifies such states from random initial configurations, thereby obviating the need for educated initial guesses that can be difficult to formulate.

  2. Theoretically informed Monte Carlo simulation of liquid crystals by sampling of alignment-tensor fields.

    PubMed

    Armas-Pérez, Julio C; Londono-Hurtado, Alejandro; Guzmán, Orlando; Hernández-Ortiz, Juan P; de Pablo, Juan J

    2015-07-28

    A theoretically informed coarse-grained Monte Carlo method is proposed for studying liquid crystals. The free energy functional of the system is described in the framework of the Landau-de Gennes formalism. The alignment field and its gradients are approximated by finite differences, and the free energy is minimized through a stochastic sampling technique. The validity of the proposed method is established by comparing the results of the proposed approach to those of traditional free energy minimization techniques. Its usefulness is illustrated in the context of three systems, namely, a nematic liquid crystal confined in a slit channel, a nematic liquid crystal droplet, and a chiral liquid crystal in the bulk. It is found that for systems that exhibit multiple metastable morphologies, the proposed Monte Carlo method is generally able to identify lower free energy states that are often missed by traditional approaches. Importantly, the Monte Carlo method identifies such states from random initial configurations, thereby obviating the need for educated initial guesses that can be difficult to formulate. PMID:26233107

  3. Nematic liquid crystals in a spatially step-wise magnetic field.

    PubMed

    Napoli, Gaetano; Scaraggi, Michele

    2016-01-01

    We study the molecular reorientation induced by a textured external field in a nematic liquid crystal (nLC). In particular, we consider an infinitely wide cell with strong planar anchoring boundary conditions, subjected to a spatially periodic piecewise magnetic field. In the framework of the Frank's continuum theory, we use the perturbation analysis to study in detail the field-induced splay-bend Fréedericksz transition. A numerical approach, based on the finite differences method, is instead employed to solve the fully nonlinear equations. At high field strengths, an analytic approach allows us to draw the bulk profile of the director in terms of elliptic integrals. Finally, through the application of the Bruggeman texture hydrodynamics theory, we qualitatively discuss on the LCs piecewise director configuration under sliding interfaces, which can be adopted to actively regulate friction. Our study opens the pathway for the application of highly controlled nLC texturing for tribotronics. PMID:26871129

  4. A high-field (30 Tesla) pulsed magnet instrument for single-crystal scattering studies

    NASA Astrophysics Data System (ADS)

    Islam, Zahirul; Nojiri, Hiroyuki; Narumi, Yasuo; Lang, Jonathan

    2010-03-01

    Pulsed magnets have emerged as a viable approach at synchrotron x-ray facilities for studying materials in high magnetic fields. We are developing a new high-field (30 Tesla) pulsed magnet system for single-crystal x-ray diffraction studies. It consists of a single 18mm-bore solenoid, designed and built at Tohoku University using high-tensile-strength and high conductivity CuAg wires. A dual-cryostat scheme has been developed at Advanced Photon Source in order to cool the coil using liquid nitrogen and the sample using a closed-cycle cryostat independently. Liquid nitrogen cooling allows repetition rate of a few minutes for peak fields near 30 Tesla. This scheme is unique in that it allows the applied magnetic field to be parallel to the scattering plane. Time-resolved scattering data are typically collected using a fast one-dimensional strip detector. Opportunities and challenges for experiments and instrumentation will be discussed.

  5. Nematic liquid crystals in a spatially step-wise magnetic field

    NASA Astrophysics Data System (ADS)

    Napoli, Gaetano; Scaraggi, Michele

    2016-01-01

    We study the molecular reorientation induced by a textured external field in a nematic liquid crystal (nLC). In particular, we consider an infinitely wide cell with strong planar anchoring boundary conditions, subjected to a spatially periodic piecewise magnetic field. In the framework of the Frank's continuum theory, we use the perturbation analysis to study in detail the field-induced splay-bend Fréedericksz transition. A numerical approach, based on the finite differences method, is instead employed to solve the fully nonlinear equations. At high field strengths, an analytic approach allows us to draw the bulk profile of the director in terms of elliptic integrals. Finally, through the application of the Bruggeman texture hydrodynamics theory, we qualitatively discuss on the LCs piecewise director configuration under sliding interfaces, which can be adopted to actively regulate friction. Our study opens the pathway for the application of highly controlled nLC texturing for tribotronics.

  6. The Effect of Crystallizing and Non-crystallizing Cosolutes on Succinate Buffer Crystallization and the Consequent pH Shift in Frozen Solutions

    SciTech Connect

    Sundaramurthi, Prakash; Suryanarayanan, Raj

    2011-09-06

    To effectively inhibit succinate buffer crystallization and the consequent pH changes in frozen solutions. Using differential scanning calorimetry (DSC) and X-ray diffractometry (XRD), the crystallization behavior of succinate buffer in the presence of either (i) a crystallizing (glycine, mannitol, trehalose) or (ii) a non-crystallizing cosolute (sucrose) was evaluated. Aqueous succinate buffer solutions, 50 or 200 mM, at pH values 4.0 or 6.0 were cooled from room temperature to -25 C at 0.5 C/min. The pH of the solution was measured as a function of temperature using a probe designed to function at low temperatures. The final lyophiles prepared from these solutions were characterized using synchrotron radiation. When the succinic acid solution buffered to pH 4.0, in the absence of a cosolute, was cooled, there was a pronounced shift in the freeze-concentrate pH. Glycine and mannitol, which have a tendency to crystallize in frozen solutions, remained amorphous when the initial pH was 6.0. Under this condition, they also inhibited buffer crystallization and prevented pH change. At pH 4.0 (50 mM initial concentration), glycine and mannitol crystallized and did not prevent pH change in frozen solutions. While sucrose, a non-crystallizing cosolute, did not completely prevent buffer crystallization, the extent of crystallization was reduced. Sucrose decomposition, based on XRD peaks attributable to {beta}-D-glucose, was observed in frozen buffer solutions with an initial pH of 4.0. Trehalose completely inhibited crystallization of the buffer components when the initial pH was 6.0 but not at pH 4.0. At the lower pH, the crystallization of both trehalose dihydrate and buffer components was evident. When retained amorphous, sucrose and trehalose effectively inhibited succinate buffer component crystallization and the consequent pH shift. However, when trehalose crystallized or sucrose degraded to yield a crystalline decomposition product, crystallization of buffer was

  7. Effect of borax on the crystallization kinetics of boric acid

    NASA Astrophysics Data System (ADS)

    Şahin, Ömer

    2002-03-01

    The effect of different borax concentrations on the growth and dissolution rates of boric acid crystals were measured in a fluidized bed crystallizer under well-established conditions of supersaturation and undersaturation and fluidization. It was found that the presence of borax in boric-acid solution decreases the mass-transfer coefficient, kd, the surface-reaction constant, kr and reaction order r pertaining to growth and dissolution rates of boric acid crystals. The effectiveness factors were estimated from the growth rate data to evaluate the relative magnitudes of the two resistances in series, diffusion and integration. The controlling mechanism is mainly by integration for the crystal growth of boric acid in the pure state and in the presence of borax in solution. The kinetic parameters ( kr, kd, r) were determined by a new method which is called trial and error under no assumption. This method gives a high accuracy of determination of the mass-transfer coefficient, kd, the surface-reaction constant, kr and surface-reaction order, r. The relative standard deviation between the equation Rg= kr(( ρα- ρeq)- Rg(1- wα)/ kd) r and those experimentally obtained and represented by the equation Rg= kg( ρα- ρeq) g do not exceed 0.013 for both the growth and dissolution regions.

  8. Effect of temperature on wet agglomeration of crystals

    PubMed Central

    Maghsoodi, Maryam; Yari, Zahra

    2014-01-01

    Objective(s): This study dealt with the wet agglomeration process in which a small quantity of binder liquid was added into a suspension of crystals, directly in the stirring vessel where the crystallization took place. The purpose of this investigation was evaluation of the effect of temperature on the agglomeration process in order to gain insight into the mechanism of the formation of the agglomerates. Materials and Methods: Carbamazepine was used as a model drug and water/ethanol and isopropyl acetate were used as crystallization system and binder liquid, respectively. The agglomeration of crystals was carried out at various temperatures and the agglomerates were characterized in terms of size, morphology, density and mechanical strength. Results: Evaluation of the agglomerates along the course of agglomeration shows that the properties of the particles change gradually but substantially. Higher temperature of the system during agglomeration process favors the formation of more regular agglomerates with mechanically stronger and denser structure; this can be explained by the promotion effect of temperature on the agglomeration process. Conclusion: With optimized wet agglomeration temperature, spherical, dense, and strong agglomerates can be obtained. PMID:24967063

  9. Infrared light gated MoS₂ field effect transistor.

    PubMed

    Fang, Huajing; Lin, Ziyuan; Wang, Xinsheng; Tang, Chun-Yin; Chen, Yan; Zhang, Fan; Chai, Yang; Li, Qiang; Yan, Qingfeng; Chan, H L W; Dai, Ji-Yan

    2015-12-14

    Molybdenum disulfide (MoS₂) as a promising 2D material has attracted extensive attentions due to its unique physical, optical and electrical properties. In this work, we demonstrate an infrared (IR) light gated MoS₂ transistor through a device composed of MoS₂ monolayer and a ferroelectric single crystal Pb(Mg(1/3)Nb(2/3))O₃-PbTiO₃ (PMN-PT). With a monolayer MoS₂ onto the top surface of (111) PMN-PT crystal, the drain current of MoS₂ channel can be modulated with infrared illumination and this modulation process is reversible. Thus, the transistor can work as a new kind of IR photodetector with a high IR responsivity of 114%/Wcm⁻². The IR response of MoS₂ transistor is attributed to the polarization change of PMN-PT single crystal induced by the pyroelectric effect which results in a field effect. Our result promises the application of MoS₂ 2D material in infrared optoelectronic devices. Combining with the intrinsic photocurrent feature of MoS₂ in the visible range, the MoS₂ on ferroelectric single crystal may be sensitive to a broadband wavelength of light. PMID:26698982

  10. Magnetic-field-driven surface electromagnetic states in the graphene-antiferromagnetic photonic crystal system

    SciTech Connect

    Averkov, Yu. O. Tarapov, S. I.; Yakovenko, V. M.; Yampol’skii, V. A.

    2015-04-15

    The surface electromagnetic states (SEMSs) on graphene, which has a linear carrier dispersion law and is placed in an antiferromagnetic photonic crystal, are theoretically studied in the terahertz frequency range. The unit cell of such a crystal consists of layers of a nonmagnetic insulator and a uniaxial antiferromagnet, the easy axis of which is parallel to the crystal layers. A dc magnetic field is parallel to the easy axis of the antiferromagnet. An expression that relates the SEMS frequencies to the structure parameters is obtained. The problem of SEMS excitation by an external TE-polarized electromagnetic wave is solved, and the dependences of the transmission coefficient on the dc magnetic field and the carrier concentration are constructed. These dependences are shown to differ substantially from the case of a conventional two-dimensional electron gas with a quadratic electron dispersion law. Thus, the positions of the transmission coefficient peaks related to resonance SEMS excitation can be used to determine the character of carrier dispersion law in a two-dimensional electron gas.

  11. Electric field dependence of nonlinearity parameters and third order elastic constants of 0.70Pb(Mg1∕3Nb2∕3)O3–0.30PbTiO3 single crystal

    PubMed Central

    Liu, Xiaozhou; Zhang, Shujun; Luo, Jun; Shrout, Thomas R.; Cao, Wenwu

    2010-01-01

    Through second harmonic measurements, the ultrasonic nonlinearity parameters of [001]c and [111]c polarized 0.70Pb(Mg1∕3Nb2∕3)O3–0.30PbTiO3(PMN–0.3PT) single crystals have been measured as a function of bias electric field. It was found that the nonlinearity parameter increases almost linearly with field at low field but shows a drastic increase near the coercive field. The [111]c polarized single domain crystal has much smaller nonlinearity parameter than that of the [001]c polarized multidomain crystal. Based on effective symmetries of these crystals, we were able to derive the field dependence of several third order elastic constants, which are important parameters for high field applications. PMID:20198132

  12. Segregation effects during solidification in weightless melts. [effects of evaporation and solidification on crystalization

    NASA Technical Reports Server (NTRS)

    Li, C.

    1975-01-01

    Computer programs are developed and used in the study of the combined effects of evaporation and solidification in space processing. The temperature and solute concentration profiles during directional solidification of binary alloys with surface evaporation were mathematically formulated. Computer results are included along with an econotechnical model of crystal growth. This model allows: prediction of crystal size, quality, and cost; systematic selection of the best growth equipment or alloy system; optimization of growth or material parameters; and a maximization of zero-gravity effects. Segregation in GaAs crystals was examined along with vibration effects on GaAs crystal growth. It was found that a unique segregation pattern and strong convention currents exist in GaAs crystal growth. Some beneficial effects from vibration during GaAs growth were discovered. The implications of the results in space processing are indicated.

  13. Directed peptide amphiphile assembly using aqueous liquid crystal templates in magnetic fields.

    PubMed

    van der Asdonk, Pim; Keshavarz, Masoumeh; Christianen, Peter C M; Kouwer, Paul H J

    2016-08-21

    An alignment technique based on the combination of magnetic fields and a liquid crystal (LC) template uses the advantages of both approaches: the magnetic fields offer non-contact methods that apply to all sample sizes and shapes, whilst the LC templates offer high susceptibilities. The combination introduces a route to control the spatial organization of materials with low intrinsic susceptibilities. We demonstrate that we can unidirectionally align one such material, peptide amphiphiles in water, on a centimeter scale at a tenfold lower magnetic field by using a lyotropic chromonic liquid crystal as a template. We can transform the aligned supramolecular assemblies into optically active π-conjugated polymers after photopolymerization. Lastly, by reducing the magnetic field strength needed for addressing these assemblies, we are able to create more complex structures by initiating self-assembly of our supramolecular materials under competing alignment forces between the magnetically induced alignment of the assemblies (with a positive diamagnetic anisotropy) and the elastic force dominated alignment of the template (with a negative diamagnetic anisotropy), which is directed orthogonally. Although the approach is still in its infancy and many critical parameters need optimization, we believe that it is a very promising technique to create tailor-made complex structures of (aqueous) functional soft matter. PMID:27320385

  14. Imaging the oblique propagation of electrons in germanium crystals at low temperature and low electric field

    NASA Astrophysics Data System (ADS)

    Moffatt, R. A.; Cabrera, B.; Corcoran, B. M.; Kreikebaum, J. M.; Redl, P.; Shank, B.; Yen, J. J.; Young, B. A.; Brink, P. L.; Cherry, M.; Tomada, A.; Phipps, A.; Sadoulet, B.; Sundqvist, K. M.

    2016-01-01

    Excited electrons in the conduction band of germanium collect into four energy minima, or valleys, in momentum space. These local minima have highly anisotropic mass tensors which cause the electrons to travel in directions which are oblique to an applied electric field at sub-Kelvin temperatures and low electric fields, in contrast to the more isotropic behavior of the holes. This experiment produces a full two-dimensional image of the oblique electron and hole propagation and the quantum transitions of electrons between valleys for electric fields oriented along the [0,0,1] direction. Charge carriers are excited with a focused laser pulse on one face of a germanium crystal and then drifted through the crystal by a uniform electric field of strength between 0.5 and 6 V/cm. The pattern of charge density arriving on the opposite face is used to reconstruct the trajectories of the carriers. Measurements of the two-dimensional pattern of charge density are compared in detail with Monte Carlo simulations developed for the Cryogenic Dark Matter Search (SuperCDMS) to model the transport of charge carriers in high-purity germanium detectors.

  15. Magnetostrictive behaviors of Fe-Al(001) single-crystal films under rotating magnetic fields

    NASA Astrophysics Data System (ADS)

    Kawai, Tetsuroh; Abe, Tatsuya; Ohtake, Mitsuru; Futamoto, Masaaki

    2016-05-01

    Magnetostrictive behaviors of Fe100-x - Alx(x = 0 - 30 at.%)(001) single-crystal films under rotating magnetic fields are investigated along the two different crystallographic orientations, [100] and [110]. The behaviors of Fe and Fe90Al10 films show bath-tub like waveform along [100], easy magnetization axis, and triangular waveform along [110], hard magnetization axis, with respect to their four-fold magnetic anisotropy. On the other hand, the behaviors of Fe80Al20 film are different from those of Fe or Fe90Al10 film. The output of the film along [100] shows a strong magnetic field dependence. The Fe70Al30 film shows similar magnetostrictive behaviors along both [100] and [110] reflecting its magnetic properties, which are almost same for the both directions. The growth of ordered phase (B2) in Fe80Al20 and Fe70Al30 films is considered to have affected their magnetostrictive behaviors. The Al content dependence on λ100 and λ111 values shows similar tendency to that reported for the bulk samples but the values are slightly different. The Fe90Al10(001) single-crystal film shows a large magnetostriction along [100] under a very small magnetic field of 0.02 kOe, which is comparable to the saturated one, and changes the value abruptly in relation to the angle of applied magnetic field.

  16. Generation of an amorphous phase on surface of LiF by thermoelectric effect and its crystallization

    NASA Astrophysics Data System (ADS)

    Feodorov, Victor A.; Sterelukhin, Andrei A.; Karyev, Leonid G.

    2005-04-01

    Influence of an electric field and simultaneous heating on a condition of {0\\overbar 35}, {110} and {111} crystal surfaces of LiF was investigated. It was shown that the effect resulted in structural changes shown as a jelly uncertain form formations. Generation of the amorphous phase was caused by the change of stoichiometry and accumulation of a charge in superficial layers. Fast growth of crystals is a result of photoeffect. Crystallization of neoplasm at seasoning in full darkness is caused by a relaxation of a volumetric charge and restoration of stoichiometric structure.

  17. Phase-field crystal modeling of shape transition of strained islands in heteroepitaxy

    NASA Astrophysics Data System (ADS)

    Chen, Cheng; Chen, Zheng; Zhang, Jing; Du, XiuJuan

    2012-11-01

    The phase-field crystal (PFC) model is employed to study the shape transition of strained islands in heteroepitaxy on vicinal substrates. The influences of both substrate vicinal angles β and the lattice mismatch ζ are discussed. The increase of substrate vicinal angles is found to be capable of significantly changing the surface nanostructures of epitaxial films. The surface morphology of films undergoes a series of transitions that include Stranski-Krastonov (SK) islands, the couple growth of islands and the step flow as well as the formation of step bunching. In addition, the larger ζ indicates an increased strained island density after coarsening, and results in the incoherent growth of strained islands with the creation of misfit dislocations. Coarsening, coalescence and faceting of strained islands are also observed. Some facets in the shape transition of strained islands are found to be stable and can be determined by β and crystal symmetry of the film.

  18. General equations for the motions of ice crystals and water drops in gravitational and electric fields

    NASA Technical Reports Server (NTRS)

    Nisbet, John S.

    1988-01-01

    General equations for the Reynolds number of a variety of types of ice crystals and water drops are given in terms of the Davies, Bond, and Knudsen numbers. The equations are in terms of the basic physical parameters of the system and are valid for calculating velocities in gravitational and electric fields over a very wide range of sizes and atmospheric conditions. The equations are asymptotically matched at the bottom and top of the size spectrum, useful when checking large computer codes. A numerical system for specifying the dimensional properties of ice crystals is introduced. Within the limits imposed by such variables as particle density, which have large deviations, the accuracy of velocities appears to be within 10 percent over the entire range of sizes of interest.

  19. Temperature and Field Induced Strain Measurements in Single Crystal Gd5Si2Ge2

    NASA Astrophysics Data System (ADS)

    McCall, S. K.; Nersessian, N.; Carman, G. P.; Pecharsky, V. K.; Schlagel, D. L.; Radousky, H. B.

    2016-06-01

    The first-order magneto-structural transformation that occurs in Gd5Si2Ge2 near room temperature makes it a strong candidate for many energy harvesting applications. Understanding the single crystal properties is crucial for allowing simulations of device performance. In this study, magnetically and thermally induced transformation strains were measured in a single crystal of Gd5Si2.05Ge1.95 as it transforms from a high-temperature monoclinic paramagnet to a lower-temperature orthorhombic ferromagnet. Thermally induced transformation strains of -8500 ppm, +960 ppm and +1800 ppm, and magnetically induced transformation strains of -8500 ppm, +900 ppm and +2300 ppm were measured along the a, b and c axes, respectively. Using experimental data coupled with general thermodynamic considerations, a universal phase diagram was constructed showing the transition from the monoclinic to the orthorhombic phase as a function of temperature and magnetic field.

  20. Crystal size of epidotes: A potentially exploitable geothermometer in geothermal fields

    SciTech Connect

    Patrier, P.; Beaufort, D.; Touchard, G. ); Fouillac, A.M. )

    1990-11-01

    Crystal size of epidotes crystallized in quartz + epidote veins is used as the basis for a new geothermometer from the fossil geothermal field of Saint Martin (Lesser Antilles). The epidote-bearing alteration paragenesis is developed as far as 3 km from a quartz diorite pluton at temperatures of 220-350C. The length/width ratio of the epidote grains is constant for all the analyzed samples and suggests isotropic growth environments. However, the length and width of the grains vary exponentially with temperature. The obtained results offer new perspectives for simple grain-size geothermomentry but must be extended to other geologic environments to clarify the influence of different rock types.