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Sample records for oxide-silicon-oxynitride stack structures

  1. Measuring Structural Parameters Through Stacking Galaxy Images

    NASA Astrophysics Data System (ADS)

    Li, Yubin; Zheng, Xian Zhong; Gu, Qiu-Sheng; Wang, Yi-Peng; Wen, Zhang Zheng; Guo, Kexin; An, Fang Xia

    2016-12-01

    It remains challenging to detect the low surface brightness structures of faint high-z galaxies, which are key to understanding the structural evolution of galaxies. The technique of image stacking allows us to measure the averaged light profile beneath the detection limit and probe the extended structure of a group of galaxies. We carry out simulations to examine the recovery of the averaged surface brightness profile through stacking model Hubble Space Telescope/Advanced Camera for Surveys images of a set of galaxies as functions of the Sérsic index (n), effective radius (R e) and axis ratio (AR). The Sérsic profile best fitting the radial profile of the stacked image is taken as the recovered profile, in comparison with the intrinsic mean profile of the model galaxies. Our results show that, in general, the structural parameters of the mean profile can be properly determined through stacking, though systematic biases need to be corrected when spreads of R e and AR are counted. We find that the Sérsic index is slightly overestimated and R e is underestimated at {AR}\\lt 0.5 because the stacked image appears to be more compact due to the presence of inclined galaxies; the spread of R e biases the stacked profile to have a higher Sérsic index. We stress that the measurements of structural parameters through stacking should take these biases into account. We estimate the biases in the recovered structural parameters from stacks of galaxies when the samples have distributions of {R}{{e}}, AR and n seen in local galaxies.

  2. Layer-stacking effect on electronic structures of bilayer arsenene

    NASA Astrophysics Data System (ADS)

    Mi, Kui; Xie, Jiafeng; Si, M. S.; Gao, C. X.

    2017-01-01

    A monolayer of orthorhombic arsenic (arsenene) is a promising candidate for nano-electronic devices due to the uniquely electronic properties. To further extend its practical applications, an additional layer is introduced to tune the electronic structures. Four layer-stacking manners, namely AA-, AB-, AB‧-, and AC-stacking, are constructed and studied through using first-principles calculations. Compared with monolayer, an indirect-direct gap transition is realized in AB-stacking. More importantly, a semimetal feature appears in the AC- and AB‧-stacked bilayers, leaving the electronic structure of AA-stacking trivial. In addition, the energy dispersion around Γ is largely tuned from the layer-stacking effect. To understand the underlying physics, the \\textbf{k}\\cdot\\textbf{p} approximation is taken to address this issue. Our results show that the level repulsion from the additional layer domaintes the anisotropy of energy dispersion around Γ. The works like ours would shed new light on the tunability of the electronic structure in layered arsenene.

  3. Manifold seal structure for fuel cell stack

    DOEpatents

    Collins, William P.

    1988-01-01

    The seal between the sides of a fuel cell stack and the gas manifolds is improved by adding a mechanical interlock between the adhesive sealing strip and the abutting surface of the manifolds. The adhesive is a material which can flow to some extent when under compression, and the mechanical interlock is formed providing small openings in the portion of the manifold which abuts the adhesive strip. When the manifolds are pressed against the adhesive strips, the latter will flow into and through the manifold openings to form buttons or ribs which mechanically interlock with the manifolds. These buttons or ribs increase the bond between the manifolds and adhesive, which previously relied solely on the adhesive nature of the adhesive.

  4. Simultaneous prediction of RNA secondary structure and helix coaxial stacking.

    PubMed

    Shareghi, Pooya; Wang, Yingfeng; Malmberg, Russell; Cai, Liming

    2012-06-11

    RNA secondary structure plays a scaffolding role for RNA tertiary conformation. Accurate secondary structure prediction can not only identify double-stranded helices and single stranded-loops but also help provide information for potential tertiary interaction motifs critical to the 3D conformation. The average accuracy in ab initio prediction remains 70%; performance improvement has only been limited to short RNA sequences. The prediction of tertiary interaction motifs is difficult without multiple, related sequences that are usually not available. This paper presents research that aims to improve the secondary structure prediction performance and to develop a capability to predict coaxial stacking between helices. Coaxial stacking positions two helices on the same axis, a tertiary motif present in almost all junctions that account for a high percentage of RNA tertiary structures. This research identified energetic rules for coaxial stacks and geometric constraints on stack combinations, which were applied to developing an efficient dynamic programming application for simultaneous prediction of secondary structure and coaxial stacking. Results on a number of non-coding RNA data sets, of short and moderately long lengths, show a performance improvement (specially on tRNAs) for secondary structure prediction when compared with existing methods. The program also demonstrates a capability for prediction of coaxial stacking. The significant leap of performance on tRNAs demonstrated in this work suggests that a breakthrough to a higher performance in RNA secondary structure prediction may lie in understanding contributions from tertiary motifs critical to the structure, as such information can be used to constrain geometrically as well as energetically the space of RNA secondary structure.

  5. Simultaneous prediction of RNA secondary structure and helix coaxial stacking

    PubMed Central

    2012-01-01

    Background RNA secondary structure plays a scaffolding role for RNA tertiary conformation. Accurate secondary structure prediction can not only identify double-stranded helices and single stranded-loops but also help provide information for potential tertiary interaction motifs critical to the 3D conformation. The average accuracy in ab initio prediction remains 70%; performance improvement has only been limited to short RNA sequences. The prediction of tertiary interaction motifs is difficult without multiple, related sequences that are usually not available. This paper presents research that aims to improve the secondary structure prediction performance and to develop a capability to predict coaxial stacking between helices. Coaxial stacking positions two helices on the same axis, a tertiary motif present in almost all junctions that account for a high percentage of RNA tertiary structures. Results This research identified energetic rules for coaxial stacks and geometric constraints on stack combinations, which were applied to developing an efficient dynamic programming application for simultaneous prediction of secondary structure and coaxial stacking. Results on a number of non-coding RNA data sets, of short and moderately long lengths, show a performance improvement (specially on tRNAs) for secondary structure prediction when compared with existing methods. The program also demonstrates a capability for prediction of coaxial stacking. Conclusions The significant leap of performance on tRNAs demonstrated in this work suggests that a breakthrough to a higher performance in RNA secondary structure prediction may lie in understanding contributions from tertiary motifs critical to the structure, as such information can be used to constrain geometrically as well as energetically the space of RNA secondary structure. PMID:22759616

  6. Efficiency of coaxial stacking depends on the DNA duplex structure.

    PubMed

    Pyshnyi, Dmitrii V; Goldberg, Eugenii L; Ivanova, Eugenia M

    2003-12-01

    Thermodynamic parameters of coaxial stacking at complementary helix-helix interfaces GX*pYG/CZVC (X,Y=A,C,T,G;*-nick) created by contiguous oligonucleotide hybridization were determined. The data obtained were compared to the thermodynamic parameters of coaxial stacking at the interfaces CX*pYC/GZVG. Multiple linear regression analysis has revealed that the free-energy increments of interaction for the contacts GX*pYG/CZVC and CX*pYC/GZVG can be described by a set of uniform Delta G degrees(X*pY/ZV) values. The difference in the observed free-energy of the coaxial stacking between the two sets is defined by the contribution from the factors reflecting structural differences between compared DNA duplexes.

  7. Free energy contributions and structural characterization of stacking disordered ices.

    PubMed

    Hudait, Arpa; Qiu, Siwei; Lupi, Laura; Molinero, Valeria

    2016-04-14

    Crystallization of ice from deeply supercooled water and amorphous ices - a process of fundamental importance in the atmosphere, interstellar space, and cryobiology - results in stacking disordered ices with a wide range of metastabilities with respect to hexagonal ice. The structural origin of this high variability, however, has not yet been elucidated. Here we use molecular dynamics simulations with the mW water model to characterize the structure of ice freshly grown from supercooled water at temperatures from 210 to 270 K, the thermodynamics of stacking faults, line defects, and interfaces, and to elucidate the interplay between kinetics and thermodynamics in determining the structure of ice. In agreement with experiments, the ice grown in the simulations is stacking disordered with a random distribution of cubic and hexagonal layers, and a cubicity that decreases with growth temperature. The former implies that the cubicity of ice is determined by processes at the ice/liquid interface, without memory of the structure of buried ice layers. The latter indicates that the probability of building a cubic layer at the interface decreases upon approaching the melting point of ice, which we attribute to a more efficient structural equilibration of ice at the liquid interface as the driving force for growth wanes. The free energy cost for creating a pair of cubic layers in ice is 8.0 J mol(-1) in experiments, and 9.7 ± 1.9 J mol(-1) for the mW water model. This not only validates the simulations, but also indicates that dispersion in cubicity is not sufficient to explain the large energetic variability of stacking disordered ices. We compute the free energy cost of stacking disorder, line defects, and interfaces in ice and conclude that a characterization of the density of these defects is required to predict the degree of metastability and vapor pressure of atmospheric ices.

  8. Multilayer graphenes with mixed stacking structure: Interplay of Bernal and rhombohedral stacking

    NASA Astrophysics Data System (ADS)

    Koshino, Mikito; McCann, Edward

    2013-01-01

    We study the electronic structure of multilayer graphenes with a mixture of Bernal and rhombohedral stacking and propose a general scheme to understand the electronic band structure of an arbitrary configuration. The system can be viewed as a series of finite Bernal graphite sections connected by stacking faults. We find that the low-energy eigenstates are mostly localized in each Bernal section, and, thus, the whole spectrum is well approximated by a collection of the spectra of independent sections. The energy spectrum is categorized into linear, quadratic, and cubic bands corresponding to specific eigenstates of Bernal sections. The ensemble-averaged spectrum exhibits a number of characteristic discrete structures originating from finite Bernal sections or their combinations likely to appear in a random configuration. In the low-energy region, in particular, the spectrum is dominated by frequently appearing linear bands and quadratic bands with special band velocities or curvatures. In the higher-energy region, band edges frequently appear at some particular energies, giving optical absorption edges at the corresponding characteristic photon frequencies.

  9. Stacking-dependent electronic structure of bilayer silicene

    SciTech Connect

    Fu, Huixia; Zhang, Jin; Ding, Zijing; Li, Hui E-mail: smeng@iphy.ac.cn; Meng, Sheng E-mail: smeng@iphy.ac.cn

    2014-03-31

    Bilayer silicene (BLS) is a class of material that possibly holds both topological and superconducting properties; however, its structure is not fully understood. By scanning stacking modes and lattice constants using first principles calculations, several meta-stable configurations are identified, including a slightly faulted-AA packing structure, named slide-2AA. Different from the metallic properties of conventional AA and AB stacking forms, band structure of slide-2AA bilayer presents a sizeable indirect energy gap of ∼1.16 eV. A metal-semiconductor phase transition along the sliding pathway with a small energy barrier is also observed, indicating its electronic properties can be easily tuned by applying small shear force along the BLS surface plane. Such unique quantitative relationship of structure and electronic properties has profound implications in nanoelectronics and electromechanical devices.

  10. Stacking-dependent electronic structure of bilayer silicene

    NASA Astrophysics Data System (ADS)

    Fu, Huixia; Zhang, Jin; Ding, Zijing; Li, Hui; Meng, Sheng

    2014-03-01

    Bilayer silicene (BLS) is a class of material that possibly holds both topological and superconducting properties; however, its structure is not fully understood. By scanning stacking modes and lattice constants using first principles calculations, several meta-stable configurations are identified, including a slightly faulted-AA packing structure, named slide-2AA. Different from the metallic properties of conventional AA and AB stacking forms, band structure of slide-2AA bilayer presents a sizeable indirect energy gap of ˜1.16 eV. A metal-semiconductor phase transition along the sliding pathway with a small energy barrier is also observed, indicating its electronic properties can be easily tuned by applying small shear force along the BLS surface plane. Such unique quantitative relationship of structure and electronic properties has profound implications in nanoelectronics and electromechanical devices.

  11. Electronic structure of stacking faults in rhombohedral graphite

    NASA Astrophysics Data System (ADS)

    Taut, M.; Koepernik, K.; Richter, M.

    2014-08-01

    The electronic structure of stacking faults and surfaces without and with an additional displaced layer is calculated for the case of rhombohedral (ABC) graphite. The full-potential local-orbital code and the generalized gradient approximation to density functional theory are used. All considered surfaces and interfaces induce surface/interface bands. All discovered surface and interface bands are restricted to the vicinity of the symmetry line K-M in the two-dimensional Brillouin zone. There are groups of localized band pairs around ±0, ±0.2, and ±0.6 eV for one of the two considered types of stacking faults; ±0 and ±0.5 eV for the other type and for a displaced surface layer. At the K point in the Brillouin zone, there is a one-to-one correspondence between these localized bands and the eigenvalues of those linear atomic clusters, which are produced by the perturbation of periodicity due to the displaced surface layer or due to the stacking faults. Some of the localized bands produce strong van Hove singularities in the local density of states near the surface or interface at energies up to several 0.1 eV. It is suggested to check these findings experimentally by appropriate spectroscopic methods. Undisturbed bulk (ABC) graphite is virtually a zero-gap semiconductor with a minute density of states at the Fermi energy. Both the surface and any of the considered stacking faults produce sharp peaks in the local density of states near the perturbation at energies of about 10 meV around the Fermi energy. This should provide a considerable contribution to the conductivity and its temperature dependence for samples with stacking faults or large surface-to-volume fraction.

  12. Formation and atomic structure of boron nitride nanotubes with a cup-stacked structure

    NASA Astrophysics Data System (ADS)

    Oku, Takeo; Koi, Naruhiro; Suganuma, Katsuaki; Belosludov, Rodion V.; Kawazoe, Yoshiyuki

    2007-08-01

    Boron nitride (BN) nanotubes were synthesized by annealing Fe 4N/B powder at 1000 ∘C for 1 h in a nitrogen gas atmosphere, and large amounts of BN nanotubes with a cup-stacked structure were obtained after a purification process. The atomic structures of the cup-stacked BN nanotubes were investigated by high-resolution electron microscopy as well as molecular mechanics calculations, and compared with double walled BN nanotubes. The present results indicate that the cup-stacked structure with a cone angle of 20 ∘ is more stable than the structure with an angle of 38 ∘ and ordinary nanotube structures.

  13. Periodic barrier structure in AA-stacked bilayer graphene

    NASA Astrophysics Data System (ADS)

    Redouani, Ilham; Jellal, Ahmed

    2016-06-01

    We study the charge carriers transport in an AA-stacked bilayer graphene modulated by a lateral one-dimensional multibarrier structure. We investigate the band structures of our system, that is made up of two shifted Dirac cones, for finite and zero gap. We use the boundary conditions to explicitly determine the transmission probability of each individual cone (τ =+/- 1) for single, double and finite periodic barrier structure. We find that the Klein tunneling is only possible when the band structure is gapless and can occur at normal incidence as a result of the Dirac nature of the quasiparticles. We observe that the band structure of the barriers can have more than one Dirac points for finite periodic barrier. The resonance peaks appear in the transmission probability, which correspond to the positions of new cones index like associated with τ =+/- 1. Two conductance channels through different cones (τ =+/- 1) are found where the total conductance has been studied and compared to the cases of single layer and AB-stacked bilayer graphene.

  14. Stacking dependent electronic structures of transition metal dichalcogenides heterobilayer

    NASA Astrophysics Data System (ADS)

    Lee, Yea-Lee; Park, Cheol-Hwan; Ihm, Jisoon

    The systematic study of the electronic structures and optical properties of the transition metal dichalcogenides (TMD) heterobilayers can significantly improve the designing of new electronic and optoelectronic devices. Here, we theoretically study the electronic structures and optical properties of TMD heterobilayers using the first-principles methods. The band structures of TMD heterobilayer are shown to be determined by the band alignments of the each layer, the weak interlayer interactions, and angle dependent stacking patterns. The photoluminescence spectra are investigated using the calculated band structures, and the optical absorption spectra are examined by the GW approximations including the electron-hole interaction through the solution of the Bethe-Salpeter equation. It is expected that the weak interlayer interaction gives rise to the substantial interlayer optical transition which will be corresponding to the interlayer exciton.

  15. Electrical Characteristics of the Uniaxial-Strained nMOSFET with a Fluorinated HfO₂/SiON Gate Stack.

    PubMed

    Chen, Yung-Yu

    2014-03-20

    The channel fluorine implantation (CFI) process was integrated with the Si₃N₄ contact etch stop layer (SiN CESL) uniaxial-strained n-channel metal-oxide-semiconductor field-effect transistor (nMOSFET) with the hafnium oxide/silicon oxynitride (HfO₂/SiON) gate stack. The SiN CESL process clearly improves basic electrical performance, due to induced uniaxial tensile strain within the channel. However, further integrating of the CFI process with the SiN CESL-strained nMOSFET exhibits nearly identical transconductance, subthreshold swing, drain current, gate leakage and breakdown voltage, which indicates that the strain effect is not affected by the fluorine incorporation. Moreover, hydrogen will diffuse toward the interface during the SiN deposition, then passivate dangling bonds to form weak Si-H bonds, which is detrimental for channel hot electron stress (CHES). Before hydrogen diffusion, fluorine can be used to terminate oxygen vacancies and dangling bonds, which can create stronger Hf-F and Si-F bonds to resist consequent stress. Accordingly, the reliability of constant voltage stress (CVS) and CHES for the SiN CESL uniaxial-strained nMOSFET can be further improved by the fluorinated HfO₂/SiON using the CFI process. Nevertheless, the nMOSFET with either the SiN CESL or CFI process exhibits less charge detrapping, which means that a greater part of stress-induced charges would remain in the gate stack after nitrogen (SiN CESL) or fluorine (CFI) incorporation.

  16. A thermal stack structure for measurement of fluid flow

    NASA Astrophysics Data System (ADS)

    Zhao, Hao; Mitchell, S. J. N.; Campbell, D. H.; Gamble, Harold S.

    2003-03-01

    A stacked thermal structure for fluid flow sensing has been designed, fabricated, and tested. A double-layer polysilicon process was employed in the fabrication. Flow measurement is based on the transfer of heat from a temperature sensor element to the moving fluid. The undoped or lightly doped polysilicon temperature sensor is located on top of a heavily doped polysilicon heater element. A dielectric layer between the heater and the sensor elements provides both thermal coupling and electrical isolation. In comparison to a hot-wire flow sensor, the heating and sensing functions are separated, allowing the electrical characteristics of each to be optimized. Undoped polysilicon has a large temperature coefficient of resistance (TCR) up to 7 %/K and is thus a preferred material for the sensor. However, heavily doped polysilicon is preferred for the heater due to its lower resistance. The stacked flow sensor structure offers a high thermal sensitivity making it especially suitable for medical applications where the working temperatures are restricted. Flow rates of various fluids can be measured over a wide range. The fabricated flow sensors were used to measure the flow rate of water in the range μl - ml/min and gas (Helium) in the range 10 - 100ml/min.

  17. Stacking-Dependent Electronic Structure of Trilayer Graphene Resolved by Nanospot Angle-Resolved Photoemission Spectroscopy.

    PubMed

    Bao, Changhua; Yao, Wei; Wang, Eryin; Chen, Chaoyu; Avila, José; Asensio, Maria C; Zhou, Shuyun

    2017-03-08

    The crystallographic stacking order in multilayer graphene plays an important role in determining its electronic structure. In trilayer graphene, rhombohedral stacking (ABC) is particularly intriguing, exhibiting a flat band with an electric-field tunable band gap. Such electronic structure is distinct from simple hexagonal stacking (AAA) or typical Bernal stacking (ABA) and is promising for nanoscale electronics and optoelectronics applications. So far clean experimental electronic spectra on the first two stackings are missing because the samples are usually too small in size (μm or nm scale) to be resolved by conventional angle-resolved photoemission spectroscopy (ARPES). Here, by using ARPES with a nanospot beam size (NanoARPES), we provide direct experimental evidence for the coexistence of three different stackings of trilayer graphene and reveal their distinctive electronic structures directly. By fitting the experimental data, we provide important experimental band parameters for describing the electronic structure of trilayer graphene with different stackings.

  18. Energy absorption characteristics of lightweight structural member by stacking conditions

    NASA Astrophysics Data System (ADS)

    Choi, Juho; Yang, Yongjun; Hwang, Woochae; Pyeon, Seokbeom; Min, Hanki; Yeo, Ingoo; Yang, Inyoung

    2012-04-01

    The recent trend in vehicle design is aimed at improving crash safety and environmental-friendliness. To solve these issues, the needs for lighter vehicle to limit exhaust gas and improve fuel economy has been requested for environmental-friendliness. Automobile design should be made for reduced weight once the safety of vehicle is maintained. In this study, composite structural members were manufactured using carbon fiber reinforced plastic (CFRP) which are representative lightweight structural materials. Carbon fiber has been researched as alternative to metals for lightweight vehicle and better fuel economy. CFRP is an anisotropic material which is the most widely adapted lightweight structural member because of their inherent design flexibility and high specific strength and stiffness. Also, variation of CFRP interface number is important to increase the energy absorption capacity. In this study, one type of circular shaped composite tube was used, combined with reinforcing foam. The stacking condition was selected to investigate the effect of the fiber orientation angle and interface number. The crashworthy behavior of circular composite material tubes subjected to static axial compression under same conditions is reported. The axial static collapse tests were carried out for each section member. The collapse modes and the energy absorption capability of the members were analyzed.

  19. Energy absorption characteristics of lightweight structural member by stacking conditions

    NASA Astrophysics Data System (ADS)

    Choi, Juho; Yang, Yongjun; Hwang, Woochae; Pyeon, Seokbeom; Min, Hanki; Yeo, Ingoo; Yang, Inyoung

    2011-11-01

    The recent trend in vehicle design is aimed at improving crash safety and environmental-friendliness. To solve these issues, the needs for lighter vehicle to limit exhaust gas and improve fuel economy has been requested for environmental-friendliness. Automobile design should be made for reduced weight once the safety of vehicle is maintained. In this study, composite structural members were manufactured using carbon fiber reinforced plastic (CFRP) which are representative lightweight structural materials. Carbon fiber has been researched as alternative to metals for lightweight vehicle and better fuel economy. CFRP is an anisotropic material which is the most widely adapted lightweight structural member because of their inherent design flexibility and high specific strength and stiffness. Also, variation of CFRP interface number is important to increase the energy absorption capacity. In this study, one type of circular shaped composite tube was used, combined with reinforcing foam. The stacking condition was selected to investigate the effect of the fiber orientation angle and interface number. The crashworthy behavior of circular composite material tubes subjected to static axial compression under same conditions is reported. The axial static collapse tests were carried out for each section member. The collapse modes and the energy absorption capability of the members were analyzed.

  20. Electrical Characteristics of the Uniaxial-Strained nMOSFET with a Fluorinated HfO2/SiON Gate Stack

    PubMed Central

    Chen, Yung-Yu

    2014-01-01

    The channel fluorine implantation (CFI) process was integrated with the Si3N4 contact etch stop layer (SiN CESL) uniaxial-strained n-channel metal-oxide-semiconductor field-effect transistor (nMOSFET) with the hafnium oxide/silicon oxynitride (HfO2/SiON) gate stack. The SiN CESL process clearly improves basic electrical performance, due to induced uniaxial tensile strain within the channel. However, further integrating of the CFI process with the SiN CESL-strained nMOSFET exhibits nearly identical transconductance, subthreshold swing, drain current, gate leakage and breakdown voltage, which indicates that the strain effect is not affected by the fluorine incorporation. Moreover, hydrogen will diffuse toward the interface during the SiN deposition, then passivate dangling bonds to form weak Si-H bonds, which is detrimental for channel hot electron stress (CHES). Before hydrogen diffusion, fluorine can be used to terminate oxygen vacancies and dangling bonds, which can create stronger Hf-F and Si-F bonds to resist consequent stress. Accordingly, the reliability of constant voltage stress (CVS) and CHES for the SiN CESL uniaxial-strained nMOSFET can be further improved by the fluorinated HfO2/SiON using the CFI process. Nevertheless, the nMOSFET with either the SiN CESL or CFI process exhibits less charge detrapping, which means that a greater part of stress-induced charges would remain in the gate stack after nitrogen (SiN CESL) or fluorine (CFI) incorporation. PMID:28788572

  1. Density Functional Study of Stacking Structures and Electronic Behaviors of AnE-PV Copolymer.

    PubMed

    Dong, Chuan-Ding; Beenken, Wichard J D

    2016-10-10

    In this work, we report an in-depth investigation on the π-stacking and interdigitating structures of poly(p-anthracene-ethynylene)-alt-poly(p-phenylene-vinylene) copolymer with octyl and ethyl-hexyl side chains and the resulting electronic band structures using density functional theory calculations. We found that in the π-stacking direction, the preferred stacking structure, determined by the steric effect of the branched ethyl-hexyl side chains, is featured by the anthracene-ethynylene units stacking on the phenylene-vinylene units of the neighboring chains and vice versa. This stacking structure, combined with the interdigitating structure where the branched side chains of the laterally neighboring chains are isolated, defines the energetically favorable structure of the ordered copolymer phase, which provides a good compromise between light absorption and charge-carrier transport.

  2. Theoretical analysis of structural diversity of covalent organic framework: Stacking isomer structures thermodynamics and kinetics

    NASA Astrophysics Data System (ADS)

    Hayashi, Taku; Hijikata, Yuh; Page, Alister; Jiang, Donglin; Irle, Stephan

    2016-11-01

    Covalent organic frameworks (COFs) have attracted much interest due to their utility as functional materials. Unfortunately, experimental synthesis struggles with low single crystallinity of COFs. We have theoretically investigated isomer structures of a representative two-dimensional COF for both monolayer and three-dimensional stacking orders. We show that rotations of p-phenylene rings are common in monolayers, however, affect the global stacking order substantially. We also discuss the discrepancy between powder X-ray diffraction patterns corresponding to the structures predicted by our calculations and those experimentally observed. The discrepancy demonstrates the importance of dynamics in the self-assembly process of COF organic components.

  3. Stacking Pattern of Inner Structures Characterizing Tsunami Deposits

    NASA Astrophysics Data System (ADS)

    Fujiwara, O.; Kamataki, T.; Hirakawa, K.; Irizuki, T.; Hasegawa, S.; Sakai, T.; Haraguchi, T.

    2006-12-01

    Processes of sediment transport and deposition by tsunamis are not well known, though they strongly influence the reliability of paleo-tsunami studies. We provide some criteria for distinguishing the tsunami deposits from other events such as storms, based on the observations and literature reviews for various depositional conditions. Tsunami waves have one hundred times or more longer wavelengths (ca. 100 km) and wave periods (ca. 15-20 min.), compared with wind waves. They cause repeating and long lasting sediment flows on the coast, and print their waveforms within the deposits. We positively conclude that the single deposits with co-existence of following four characters were deposited from tsunami. Complete set of four characters is rare due to the erosion by succeeding waves. Each of characters may individually be made by other processes, such as storms or floods. Interpretation of tsunami deposits needs reference to the background environment of the depositional sites. 1. The deposits display scour and grading structure composed of stacked sub-layers, each of which indicates the deposition from waning sediment flows. Each sub-layer often exhibits spaced stratification and HCS, and is graded with muddy top. 2. Mud drape or suspension fallout covers each sub-layer indicating long stagnant period between depositions of each sub-layer. 3. Flow reversal in landward- and seaward- directions is often displayed by a pair of underlying and overlying sub-layers. 4. The stacked sub-layers show fining- and thinning-upward trend in the deposits and indicate that they were sequentially deposited from waning wave train through time The AD 1703 Kanto tsunami deposit [1] and Holocene tsunami deposits in eastern Japan [2] are good examples. The former, about 90 cm thick sand bed deposited on the beach, has at least eight to nine sub- layers showing up- and return-flows. The latter, up to 1 m thick sand and gravel beds laid on the 10-m deep bay floor, are the stack of 5 cycle

  4. Module comprising IC memory stack dedicated to and structurally combined with an IC microprocessor chip

    NASA Technical Reports Server (NTRS)

    Carson, John C. (Inventor); Indin, Ronald J. (Inventor); Shanken, Stuart N. (Inventor)

    1994-01-01

    A computer module is disclosed in which a stack of glued together IC memory chips is structurally integrated with a microprocessor chip. The memory provided by the stack is dedicated to the microprocessor chip. The microprocessor and its memory stack may be connected either by glue and/or by solder bumps. The solder bumps can perform three functions--electrical interconnection, mechanical connection, and heat transfer. The electrical connections in some versions are provided by wire bonding.

  5. Structure Of Ice Crystallized From Supercooled Water: Stacking Disordered Ice

    NASA Astrophysics Data System (ADS)

    Malkin, T. L.; Murray, B. J.; Brukhno, A.; Anwar, J.; Salzmann, C.

    2012-12-01

    At atmospheric pressures ice is thought to exist in two well defined crystalline forms: stable hexagonal ice and metastable cubic ice. A metastable form of ice is thought to form in the atmosphere [1] Using X-ray diffraction data and Monte Carlo simulations; we show that ice that crystallizes both homogeneously and heterogeneously from supercooled water adopts neither of these two phases. The resulting ice is disordered in one dimension and consequently does not possess either cubic or hexagonal symmetry. It is instead composed of randomly stacked layers of cubic and hexagonal sequences. We refer to this ice as stacking-disordered ice I (ice Isd ) [2]. While similar stacking disorder has been reported before, such observations have been restricted to either samples re-crystallised from high-pressure ice phases [3] or ice formation in mesopores [4]. Review of the literature reveals that almost all ice previously identified as cubic ice in diffraction studies, which have used an array of methodologies to generate the ice, were most likely stacking-disordered ice I with varying degrees of stacking disorder. Our results suggest that the initial phase of ice formed when water freezes is the metastable stacking-disordered ice I which forms independent of the method of nucleation. Stacking-disordered ice may be the kinetic product, i.e. the material which forms fastest. Accordingly, we suggest that stacking-disordered ice is always the phase to crystallise when water freezes. In many situations it will relax to the stable hexagonal phase with time. Stacking-disordered ice may persist in the colder parts of the atmosphere and form irregular or rough crystals similar to many smaller quasi spherical ice crystals observed in the earth's atmosphere. [1] B. J. Murray et al., Nature, 2005, 434, 202-205 [2] T. L. Malkin et al., PNAS, 2012, 109 (4): 1041 - 1045 [3] T. C. Hansen et al., J. Phys. Condens. Matter, 2008, 20, 285105. [4] K. Morishige et al., J. Phys. Chem. C, 2009, 113

  6. One-step fabrication of multifunctional silica microbelt with the novel stacked structure by electrospinning technique

    NASA Astrophysics Data System (ADS)

    Yao, Yongtao; Lu, Haibao; Leng, Jinsong; Li, Jianjun

    2014-03-01

    In this study, novel route for the preparation of novel stacked structure and one-step fabrication of electrospun silica microbelt with controllable wettability by a combination of sol-gel chemistry and electrospinning techniques. The application field of the one-dimensional silica in different environmental conditions was controlled by functionalization of the hydroxyl groups and non-polar groups on the backbone. Experimental results reveal that the formation of one-dimensional stacked structure is strongly related to the conductive properties of collective substrate. The exploration of the one-dimensional stacked structure mechanism was also conducted.

  7. Fluorescence turn-on response of a conjugated polyelectrolyte with intramolecular stack structure to biomacromolecules.

    PubMed

    Lee, Wang-Eun; Jin, Young-Jae; Kim, Shin-Il; Kwak, Giseop; Kim, Joon Heon; Sakaguchi, Toshikazu; Lee, Chang-Lyoul

    2013-10-28

    An anionic conjugated polyelectrolyte based on polydiphenylacetylene showed a significant fluorescence turn-on response to positively-charged proteins through a conformational relaxation of its intramolecular stack structure.

  8. Cool white light-emitting three stack OLED structures for AMOLED display applications.

    PubMed

    Springer, Ramon; Kang, Byoung Yeop; Lampande, Raju; Ahn, Dae Hyun; Lenk, Simone; Reineke, Sebastian; Kwon, Jang Hyuk

    2016-11-28

    This paper demonstrates 2-stack and 3-stack white organic light-emitting diodes (WOLEDs) with fluorescent blue and phosphorescent yellow emissive units. The 2-stack and 3-stack WOLED comprises blue-yellow and blue-blue-yellow (blue-yellow-blue) combinations. The position of the yellow emitter and possible cavity lengths in different stack architectures are theoretically and experimentally investigated to reach Commission Internationale de L'Eclairage (CIE) coordinates of near (0.333/0.333). Here, a maximum external quantum efficiency (EQE) of 23.6% and current efficiency of 62.2 cd/A at 1000 cd/m2 as well as suitable CIE color coordinates of (0.335/0.313) for the blue-blue-yellow 3-stack hybrid WOLED structure is reported. In addition, the blue-yellow-blue 3-stack architecture exhibits an improved angular dependence compared to the blue-blue-yellow structure at a decreased EQE of 19.1%.

  9. Stacking fault energies of nondilute binary alloys using special quasirandom structures

    NASA Astrophysics Data System (ADS)

    Kaufman, Jonas L.; Pomrehn, Gregory S.; Pribram-Jones, Aurora; Mahjoub, Reza; Ferry, Michael; Laws, Kevin J.; Bassman, Lori

    2017-03-01

    Generalized stacking fault energies of nondilute binary alloys in the Ag-Au-Pd system are calculated using density functional theory and special quasirandom structures. Supercells containing 90 and 135 atoms are compared for direct calculations of the generalized stacking fault energy, and the axial interaction model is used to estimate the intrinsic stacking fault energy. The axial interaction model approximates the directly calculated energy to within 10% in most cases, but is sensitive to the particular structures used. Increasing the number of atoms used for direct calculations decreases the uncertainty of the calculated stacking fault energies in most cases, and we show that this uncertainty is related to certain correlations between pairs of adjacent layers within the supercell.

  10. Influence of supramolecular structures in crystals on parallel stacking interactions between pyridine molecules.

    PubMed

    Janjić, Goran V; Ninković, Dragan B; Zarić, Snezana D

    2013-08-01

    Parallel stacking interactions between pyridines in crystal structures and the influence of hydrogen bonding and supramolecular structures in crystals on the geometries of interactions were studied by analyzing data from the Cambridge Structural Database (CSD). In the CSD 66 contacts of pyridines have a parallel orientation of molecules and most of these pyridines simultaneously form hydrogen bonds (44 contacts). The geometries of stacked pyridines observed in crystal structures were compared with the geometries obtained by calculations and explained by supramolecular structures in crystals. The results show that the mean perpendicular distance (R) between pyridine rings with (3.48 Å) and without hydrogen bonds (3.62 Å) is larger than that calculated, because of the influence of supramolecular structures in crystals. The pyridines with hydrogen bonds show a pronounced preference for offsets of 1.25-1.75 Å, close to the position of the calculated minimum (1.80 Å). However, stacking interactions of pyridines without hydrogen bonds do not adopt values at or close to that of the calculated offset. This is because stacking interactions of pyridines without hydrogen bonds are less strong, and they are more susceptible to the influence of supramolecular structures in crystals. These results show that hydrogen bonding and supramolecular structures have an important influence on the geometries of stacked pyridines in crystals.

  11. <110> symmetric tilt grain-boundary structures in fcc metals with low stacking-fault energies

    NASA Astrophysics Data System (ADS)

    Rittner, J. D.; Seidman, D. N.

    1996-09-01

    Twenty-one <110> symmetric tilt grain boundaries (GB's) are investigated with atomistic simulations, using an embedded-atom method (EAM) potential for a low stacking-fault energy fcc metal. Lattice statics simulations with a large number of initial configurations are used to identify both the equilibrium and metastable structures at 0 K. The level of difficulty in finding the equilibrium structures is quantitatively assessed. The stability of the structures at an elevated temperature is investigated by Monte Carlo annealing. A form of GB dissociation is identified in a number of the boundaries. These structures are used to develop a dislocation model of GB dissociation by stacking-fault emission. Also, an attempt is made to apply the structural unit model (SUM) to the simulated boundaries and problems that are encountered for GB structures in low stacking-fault energy metals are enumerated and discussed.

  12. Structural and quantum chemical analysis of exciton coupling in homo- and heteroaggregate stacks of merocyanines

    NASA Astrophysics Data System (ADS)

    Bialas, David; Zitzler-Kunkel, André; Kirchner, Eva; Schmidt, David; Würthner, Frank

    2016-09-01

    Exciton coupling is of fundamental importance and determines functional properties of organic dyes in (opto-)electronic and photovoltaic devices. Here we show that strong exciton coupling is not limited to the situation of equal chromophores as often assumed. Quadruple dye stacks were obtained from two bis(merocyanine) dyes with same or different chromophores, respectively, which dimerize in less-polar solvents resulting in the respective homo- and heteroaggregates. The structures of the quadruple dye stacks were assigned by NMR techniques and unambiguously confirmed by single-crystal X-ray analysis. The heteroaggregate stack formed from the bis(merocyanine) bearing two different chromophores exhibits remarkably different ultraviolet/vis absorption bands compared with those of the homoaggregate of the bis(merocyanine) comprising two identical chromophores. Quantum chemical analysis based on an extension of Kasha's exciton theory appropriately describes the absorption properties of both types of stacks revealing strong exciton coupling also between different chromophores within the heteroaggregate.

  13. Structural and quantum chemical analysis of exciton coupling in homo- and heteroaggregate stacks of merocyanines

    PubMed Central

    Bialas, David; Zitzler-Kunkel, André; Kirchner, Eva; Schmidt, David; Würthner, Frank

    2016-01-01

    Exciton coupling is of fundamental importance and determines functional properties of organic dyes in (opto-)electronic and photovoltaic devices. Here we show that strong exciton coupling is not limited to the situation of equal chromophores as often assumed. Quadruple dye stacks were obtained from two bis(merocyanine) dyes with same or different chromophores, respectively, which dimerize in less-polar solvents resulting in the respective homo- and heteroaggregates. The structures of the quadruple dye stacks were assigned by NMR techniques and unambiguously confirmed by single-crystal X-ray analysis. The heteroaggregate stack formed from the bis(merocyanine) bearing two different chromophores exhibits remarkably different ultraviolet/vis absorption bands compared with those of the homoaggregate of the bis(merocyanine) comprising two identical chromophores. Quantum chemical analysis based on an extension of Kasha's exciton theory appropriately describes the absorption properties of both types of stacks revealing strong exciton coupling also between different chromophores within the heteroaggregate. PMID:27680284

  14. Asymmetrical reverse vortex flow due to induced-charge electro-osmosis around carbon stacking structures

    NASA Astrophysics Data System (ADS)

    Sugioka, Hideyuki

    2011-05-01

    Broken symmetry of vortices due to induced-charge electro-osmosis (ICEO) around stacking structures is important for the generation of a large net flow in a microchannel. Following theoretical predictions in our previous study, we herein report experimental observations of asymmetrical reverse vortex flows around stacking structures of carbon posts with a large height (~110 μm) in water, prepared by the pyrolysis of a photoresist film in a reducing gas. Further, by the use of a coupled calculation method that considers boundary effects precisely, the experimental results, except for the problem of anomalous flow reversal, are successfully explained. That is, unlike previous predictions, the precise calculations here show that stacking structures accelerate a reverse flow rather than suppressing it for a microfluidic channel because of the deformation of electric fields near the stacking portions; these structures can also generate a large net flow theoretically in the direction opposite that of a previous prediction for a standard vortex flow. Furthermore, by solving the one-dimensional Poisson-Nernst-Plank (PNP) equations in the presence of ac electric fields, we find that the anomalous flow reversal occurs by the phase retardation between the induced diffuse charge and the tangential electric field. In addition, we successfully explain the nonlinearity of the flow velocity on the applied voltage by the PNP analysis. In the future, we expect to improve the pumping performance significantly by using stacking structures of conductive posts along with a low-cost process.

  15. Reliability prediction of large fuel cell stack based on structure stress analysis

    NASA Astrophysics Data System (ADS)

    Liu, L. F.; Liu, B.; Wu, C. W.

    2017-09-01

    The aim of this paper is to improve the reliability of Proton Electrolyte Membrane Fuel Cell (PEMFC) stack by designing the clamping force and the thickness difference between the membrane electrode assembly (MEA) and the gasket. The stack reliability is directly determined by the component reliability, which is affected by the material property and contact stress. The component contact stress is a random variable because it is usually affected by many uncertain factors in the production and clamping process. We have investigated the influences of parameter variation coefficient on the probability distribution of contact stress using the equivalent stiffness model and the first-order second moment method. The optimal contact stress to make the component stay in the highest level reliability is obtained by the stress-strength interference model. To obtain the optimal contact stress between the contact components, the optimal thickness of the component and the stack clamping force are optimally designed. Finally, a detailed description is given how to design the MEA and gasket dimensions to obtain the highest stack reliability. This work can provide a valuable guidance in the design of stack structure for a high reliability of fuel cell stack.

  16. Structural Analysis for Subsidence of Stacked B-25 Boxes

    SciTech Connect

    Jones, W.E.

    2003-06-25

    The Savannah River Site (SRS) and other U.S. Department of Energy (DOE) sites use shallow land burial facilities (i.e., trenches) to dispose low-level radioactive waste. However, at SRS and other DOE sites, waste containers with up to 90 percent void space are disposed in the shallow land burial facilities. Corrosion and degradation of these containers can result in significant subsidence over time, which can compromise the integrity of the long-term cover. This in turn can lead to increased water infiltration through the long-term cover into the waste and subsequent increased radionuclide transport into the environment. Understanding and predicting shallow-buried, low-level waste subsidence behavior is necessary for evaluating cost-effective and appropriate stabilization required to maintain cover system long-term stability and viability, and to obtain stakeholder acceptance of the long-term implications of waste disposal practices. Two methods (dynamic compaction and static surcharge) have been used at SRS to accelerate waste and container consolidation and reduce potential subsidence prior to long term cover construction. Dynamic compaction comprises repeatedly dropping a heavy (20 ton) weight from about a 40-ft height to consolidate the waste and containers. Static surcharge is the use of a thick (15 ft to 30 ft) soil cover to consolidate the underlying materials over a longer time period (three to six months in this case). Quasi-static modeling of a stack of four B-25 boxes at various stags of corrosion with an applied static surcharge has been conducted and is presented herein.

  17. π-Stacked structure of thiadiazolo-fused benzotriazinyl radical: Crystal structure and magnetic properties

    NASA Astrophysics Data System (ADS)

    Miura, Youhei; Yoshioka, Naoki

    2015-04-01

    A novel benzotriazinyl radical with a 2,1,3-thiadiazolo fused ring (1,3-diphenyl-1,2-dihydro-[1,2,5]thiadiazolo[3‧,4‧:3,4]benzo[1,2-e]-1,2,4-triazine-2-yl; NSNBT) was prepared and characterized by ESR measurement, cyclic voltammetry, and X-ray crystallographic analysis. By a detailed study of bond lengths and angles, it was found that the molecular structure of NSNBT borrows characteristics both from 2,1,3-benzothiadiazole and from the unsubstituted benzotriazinyl radical, and the central phenyl ring presents a phenanthrene-type bond alternation. Molecules were shown to be arranged in a π-stacked columnar structure, with columns connected to each other through sulfur-sulfur interactions in the crystal. It exhibited strong antiferromagnetic interactions (J/kB = -434 K) derived from its dimer structure.

  18. Structure for common access and support of fuel cell stacks

    DOEpatents

    Walsh, Michael M.

    2000-01-01

    A structure provides common support and access to multiple fuel cells externally mounted thereto. The structure has openings leading to passages defined therein for providing the access. Various other fuel cell power system components are connected at the openings, such as reactant and coolant sources.

  19. Analysis of stacking overlap in nucleic acid structures: algorithm and application

    NASA Astrophysics Data System (ADS)

    Pingali, Pavan Kumar; Halder, Sukanya; Mukherjee, Debasish; Basu, Sankar; Banerjee, Rahul; Choudhury, Devapriya; Bhattacharyya, Dhananjay

    2014-08-01

    RNA contains different secondary structural motifs like pseudo-helices, hairpin loops, internal loops, etc. in addition to anti-parallel double helices and random coils. The secondary structures are mainly stabilized by base-pairing and stacking interactions between the planar aromatic bases. The hydrogen bonding strength and geometries of base pairs are characterized by six intra-base pair parameters. Similarly, stacking can be represented by six local doublet parameters. These dinucleotide step parameters can describe the quality of stacking between Watson-Crick base pairs very effectively. However, it is quite difficult to understand the stacking pattern for dinucleotides consisting of non canonical base pairs from these parameters. Stacking interaction is a manifestation of the interaction between two aromatic bases or base pairs and thus can be estimated best by the overlap area between the planar aromatic moieties. We have calculated base pair overlap between two consecutive base pairs as the buried van der Waals surface between them. In general, overlap values show normal distribution for the Watson-Crick base pairs in most double helices within a range from 45 to 50 Å2 irrespective of base sequence. The dinucleotide steps with non-canonical base pairs also are seen to have high overlap value, although their twist and few other parameters are rather unusual. We have analyzed hairpin loops of different length, bulges within double helical structures and pseudo-continuous helices using our algorithm. The overlap area analyses indicate good stacking between few looped out bases especially in GNRA tetraloop, which was difficult to quantitatively characterise from analysis of the base pair or dinucleotide step parameters. This parameter is also seen to be capable to distinguish pseudo-continuous helices from kinked helix junctions.

  20. Improved performance of the microbial electrolysis desalination and chemical-production cell using the stack structure.

    PubMed

    Chen, Shanshan; Liu, Guangli; Zhang, Renduo; Qin, Bangyu; Luo, Yong; Hou, Yanping

    2012-07-01

    The microbial electrolysis desalination and chemical-production cell (MEDCC) is a device to desalinate seawater, and produce acid and alkali. The objective of this study was to enhance the desalination and chemical-production performance of the MEDCC using two types of stack structure. Experiments were conducted with different membrane spacings, numbers of desalination chambers and applied voltages. Results showed that the stack construction in the MEDCC enhanced the desalination and chemical-production rates. The maximal desalination rate of 0.58 ± 0.02 mmol/h, which was 43% higher than that in the MEDCC, was achieved in the four-desalination-chamber MEDCC with the AEM-CEM stack structure and the membrane spacing of 1.5mm. The maximal acid- and alkali-production rates of 0.079 ± 0.006 and 0.13 ± 0.02 mmol/h, which were 46% and 8% higher than that in the MEDCC, respectively, were achieved in the two-desalination-chamber MEDCC with the BPM-AEM-CEM stack structure and the membrane spacing of 3mm. Copyright © 2012 Elsevier Ltd. All rights reserved.

  1. Structural color in porous, superhydrophilic, and self-cleaning SiO2/TiO2 Bragg stacks.

    PubMed

    Wu, Zhizhong; Lee, Daeyeon; Rubner, Michael F; Cohen, Robert E

    2007-08-01

    Thin-film Bragg stacks exhibiting structural color have been fabricated by a layer-by-layer (LbL) deposition process involving the sequential adsorption of nanoparticles and polymers. High- and low-refractive-index regions of quarter-wave stacks were generated by calcining LbL-assembled multilayers containing TiO(2) and SiO(2) nanoparticles, respectively. The physical attributes of each region were characterized by a recently developed ellipsometric method. The structural color characteristics of the resultant nanoporous Bragg stacks could be precisely tuned in the visible region by varying the number of stacks and the thickness of the high- and low-refractive-index stacks. These Bragg stacks also exhibited potentially useful superhydrophilicity and self-cleaning properties.

  2. B3LYP, BLYP and PBE DFT band structures of the nucleotide base stacks

    NASA Astrophysics Data System (ADS)

    Szekeres, Zs; Bogár, F.; Ladik, J.

    DFT crystal orbital (band structure) calculations have been performed for the nucleotide base stacks of cytosine, thymine, adenine, and guanine arranged in DNA B geometry. The band structures obtained with PBE, BLYP, and B3LYP functionals are presented and compared to other related experimental and theoretical results. The influence of the quality of the basis set on the fundamental gap values was also investigated using Clementi's double ζ, 6-31G and 6-31G* basis sets.

  3. Control of interfacial properties of Pr-oxide/Ge gate stack structure by introduction of nitrogen

    NASA Astrophysics Data System (ADS)

    Kato, Kimihiko; Kondo, Hiroki; Sakashita, Mitsuo; Nakatsuka, Osamu; Zaima, Shigeaki

    2011-06-01

    We have demonstrated the control of interfacial properties of Pr-oxide/Ge gate stack structure by the introduction of nitrogen. From C- V characteristics of Al/Pr-oxide/Ge 3N 4/Ge MOS capacitors, the interface state density decreases without the change of the accumulation capacitance after annealing. The TEM and TED measurements reveal that the crystallization of Pr-oxide is enhanced with annealing and the columnar structure of cubic-Pr 2O 3 is formed after annealing. From the depth profiles measured using XPS with Ar sputtering for the Pr-oxide/Ge 3N 4/Ge stack structure, the increase in the Ge component is not observed in a Pr-oxide film and near the interface between a Pr-oxide film and a Ge substrate. In addition, the N component segregates near the interface region, amorphous Pr-oxynitride (PrON) is formed at the interface. As a result, Pr-oxide/PrON/Ge stacked structure without the Ge-oxynitride interlayer is formed.

  4. Stacking structure of confined 1-butanol in SBA-15 investigated by solid-state NMR spectroscopy.

    PubMed

    Lin, Yun-Chih; Chou, Hung-Lung; Sarma, Loka Subramanyam; Hwang, Bing-Joe

    2009-10-12

    Understanding the complex thermodynamic behavior of confined amphiphilic molecules in biological or mesoporous hosts requires detailed knowledge of the stacking structures. Here, we present detailed solid-state NMR spectroscopic investigations on 1-butanol molecules confined in the hydrophilic mesoporous SBA-15 host. A range of NMR spectroscopic measurements comprising of (1)H spin-lattice (T(1)), spin-spin (T(2)) relaxation, (13)C cross-polarization (CP), and (1)H,(1)H two-dimensional nuclear Overhauser enhancement spectroscopy ((1)H,(1)H 2D NOESY) with the magic angle spinning (MAS) technique as well as static wide-line (2)H NMR spectra have been used to investigate the dynamics and to observe the stacking structure of confined 1-butanol in SBA-15. The results suggest that not only the molecular reorientation but also the exchange motions of confined molecules of 1-butanol are extremely restricted in the confined space of the SBA-15 pores. The dynamics of the confined molecules of 1-butanol imply that the (1)H,(1)H 2D NOESY should be an appropriate technique to observe the stacking structure of confined amphiphilc molecules. This study is the first to observe that a significant part of confined 1-butanol molecules are orientated as tilted bilayered structures on the surface of the host SBA-15 pores in a time-average state by solid-state NMR spectroscopy with the (1)H,(1)H 2D NOESY technique.

  5. Two-dimensional self-assembly of 1-pyrylphosphonic acid: transfer of stacks on structured surface.

    PubMed

    Yip, Hin-Lap; Ma, Hong; Jen, Alex K-Y; Dong, Jianchun; Parviz, Babak A

    2006-05-03

    Strong hydrogen bonding and pi-pi stacking between 1-pyrylphosphonic acid (PYPA) molecules were exploited to create self-assembled two-dimensional supramolecular structures. Polycrystalline films of these laminate crystalline PYPA bilayers were easily deposited onto the solid supports through a simple spin-coating technique. Atomic force microscopy (AFM), scanning tunneling microscopy (STM), X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FTIR), UV-vis absorption, and fluorescence spectroscopy reveal that processing parameters, such as solvent, concentration, and surface of the substrate, are critical factors in determining the final morphology of the stacked film. Robust laminate structures could be obtained only when short alkyl chain protic solvents (methanol or ethanol) and a nonhydrophobic substrate surface were used. Polycrystalline films were formed through the nucleation and growth of PYPA molecules into laminate structures at the air/solvent interface before they land on the substrate during the spin-coating process. These films possess good mechanical properties and were easily transferred onto a SiO2/Si substrate that was patterned with Au electrodes without breaking their crystalline structures. The successful transfer of the laminate crystals allows us to probe their electrical properties through a field effect transistor device. A gating effect on the charge transport of the stacked films indicates that PYPA laminate crystal possesses p-typed semiconductor characteristics.

  6. Three-dimensional stacked structured ASIC devices and methods of fabrication thereof

    DOEpatents

    Shinde, Subhash L.; Teifel, John; Flores, Richard S.; Jarecki Jr., Robert L.; Bauer, Todd

    2015-11-19

    A 3D stacked sASIC is provided that includes a plurality of 2D reconfigurable structured structured ASIC (sASIC) levels interconnected through hard-wired arrays of 3D vias. The 2D sASIC levels may contain logic, memory, analog functions, and device input/output pad circuitry. During fabrication, these 2D sASIC levels are stacked on top of each other and fused together with 3D metal vias. Such 3D vias may be fabricated as through-silicon vias (TSVs). They may connect to the back-side of the 2D sASIC level, or they may be connected to top metal pads on the front-side of the 2D sASIC level.

  7. Multi-stacks of epitaxial GeSn self-assembled dots in Si: Structural analysis

    SciTech Connect

    Oliveira, F.; Fischer, I. A.; Schulze, J.; Benedetti, A.; Cerqueira, M. F.; Vasilevskiy, M. I.; Stefanov, S.; Chiussi, S.

    2015-03-28

    We report on the growth and structural and morphologic characterization of stacked layers of self-assembled GeSn dots grown on Si (100) substrates by molecular beam epitaxy at low substrate temperature T = 350 °C. Samples consist of layers (from 1 up to 10) of Ge{sub 0.96}Sn{sub 0.04} self-assembled dots separated by Si spacer layers, 10 nm thick. Their structural analysis was performed based on transmission electron microscopy, atomic force microscopy, and Raman scattering. We found that up to 4 stacks of dots could be grown with good dot layer homogeneity, making the GeSn dots interesting candidates for optoelectronic device applications.

  8. Simultaneous inversion for anisotropic and structural crustal properties by stacking of radial and transverse receiver functions

    NASA Astrophysics Data System (ADS)

    Link, Frederik; Rümpker, Georg; Kaviani, Ayoub; Singh, Manvendra

    2016-04-01

    events on the results. It turns out, that the orientation of the symmetry axis is most sensitive to limitations and gaps in the azimuthal distribution. The extended stacking method provides an average model of the anisotropic crust below a station. Therefore, internal (vertical) variations cannot be resolved. Complex structures, which differ from the assumed single-layer model, will also affect the results. For example, an inclination of the layer boundary may cause an apparent anisotropic effect. We will also show examples for the application of the method to recently obtained data sets.

  9. An extended DNA structure through deoxyribose-base stacking induced by RecA protein

    PubMed Central

    Nishinaka, Taro; Ito, Yutaka; Yokoyama, Shigeyuki; Shibata, Takehiko

    1997-01-01

    The family of proteins that are homologous to RecA protein of Escherichia coli is essential to homologous genetic recombination in various organisms including viruses, bacteria, lower eukaryotes, and mammals. In the presence of ATP (or ATPγS), these proteins form helical filaments containing single-stranded DNA at the center. The single-stranded DNA bound to RecA protein is extended 1.5 times relative to B-form DNA with the same sequence, and the extension is critical to pairing with homologous double-stranded DNA. This pairing reaction, called homologous pairing, is a key reaction in homologous recombination. In this NMR study, we determined a three-dimensional structure of the single-stranded DNA bound to RecA protein. The DNA structure contains novel deoxyribose-base stacking in which the 2′-methylene moiety of each deoxyribose is placed above the base of the following residue, instead of normal stacking of adjacent bases. As a result of this deoxyribose-base stacking, bases of the single-stranded DNA are spaced out nearly 5 Å. Thus, this novel structure well explains the axial extension of DNA in the RecA-filaments relative to B-form DNA and leads to a possible interpretation of the role of this extension in homologous pairing. PMID:9192615

  10. DNA base pair stacks with high electric conductance: a systematic structural search.

    PubMed

    Berlin, Yuri A; Voityuk, Alexander A; Ratner, Mark A

    2012-09-25

    We report a computational search for DNA π-stack structures exhibiting high electric conductance in the hopping regime, based on the INDO/S calculations of electronic coupling and the method of data analysis called k-means clustering. Using homogeneous poly(G)-poly(C) and poly(A)-poly(T) stacks as the simplest structural models, we identify the configurations of neighboring G:C and A:T pairs that allow strong electronic coupling and, therefore, molecular electric conductance much larger than the values reported for the corresponding reference systems in the literature. A computational approach for modeling the impact of thermal fluctuations on the averaged dimer structure was also proposed and applied to the [(G:C),(G:C)] and [(A:T),(A:T)] duplexes. The results of this work may provide guidance for the construction of DNA devices and DNA-based elements of nanoscale molecular circuits. Several factors that cause changes of step parameters favorable to the formation of the predicted stack conformation with high electric conductance of DNA molecules are also discussed; favorable geometries may enhance the conductivity by factors as large as 15.

  11. Constraining crustal structure in sediment dominated regions: An H-k-V stacking method

    NASA Astrophysics Data System (ADS)

    Cunningham, E.; Lekic, V.

    2016-12-01

    The extensive coverage afforded by EarthScope USArray in the lower 48 states provides a unique opportunity to explore crustal variation across a range of tectonic environments and geologic ages. The thickness and average composition of the continental crust are related to its tectonic and geologic history. While crustal thickening or thinning indicate the deformation history, changes in average composition carry information on how crust was formed and reworked through different geologic processes. The most common method of constraining the crustal structure is to calculate H-k stacks (Zhu and Kinamori 2000), which use arrival times of P-to-s converted seismic waves across the Moho together with waves reverberating within the crust. However, when H-k stacking is applied to regions covered with a thick sediment layer, reverberations mask the Moho P-to-s conversions making interpretation of the crustal structure difficult, if not impossible. Furthermore, H-k stacks are constructed for an assumed average crustal P or S velocity. Therefore, inferences of crustal composition must rely on the ratio of P to S wave velocity alone (Vp/Vs ratio), and crustal thickness estimates may be biased. For example, in regions where an assumed Vp is higher than the actual Vp, the crustal thickness will be overestimated and the Vp/Vs ratio will be underestimated. We overcome both limitations of standard H-k analysis by using complementary data: S-to-p conversions and SsPmp phases. Because sedimentary S-to-p reverberations do not contaminate the direct Moho-related S-to-p conversion, we incorporate S-to-p data in our H-k stacks. We shows that doing so is useful in identifying crustal thickness in regions where P-to-s H-k stacks are not sufficient. The large amplitude post-critical S-to-p reflection at the Moho (SsPmp phase) has been used to obtain crustal thickness estimates (see Parker E.H. et al. 2013, Yu et al 2013) in regions where an assumed average Vp is known to be inaccurate. This

  12. Structural and surface analysis of AlInN thin films synthesized by elemental stacks annealing

    NASA Astrophysics Data System (ADS)

    Afzal, Naveed; Devarajan, Mutharasu; Subramani, Shanmugan; Ibrahim, Kamarulazizi

    2014-04-01

    This paper presents the synthesis of AlInN thin films on Si (100) substrates using elemental stacks annealing (ESA) process. Single stack InN films were grown on Si (100) substrates by reactive radiofrequency (RF) magnetron sputtering using pure indium target in Ar-N2 environment and then an Al stack layer was deposited on the InN films by direct current (dc) sputtering of pure aluminum target in Ar atmosphere at room temperature. Annealing of the deposited films was carried out at 400 °C for 2, 4 and 6 h in a tube furnace under N2 atmosphere. X-ray diffraction (XRD) results reveal that annealing for 2 h does not produce a well-defined AlInN film, however, with the increase of annealing time to 4 h and to 6 h, (002) and (103) oriented highly crystalline AlInN films are formed with wurtzite structures. Field emission scanning electron microscopy (FESEM) results indicate a uniform film structure with grains growth by increasing the annealing time. Energy dispersive x-ray (EDX) analysis shows higher Al (atomic %) in the film as compared to In and N. Atomic force microscopy (AFM) results show a decrease in the surface roughness with increase of the annealing time.

  13. Divergent dielectric characteristics in cascaded high-K gate stacks with reverse gradient bandgap structures

    NASA Astrophysics Data System (ADS)

    Tsai, Meng-Chen; Cheng, Po-Hsien; Lee, Min-Hung; Lin, Hsin-Chih; Chen, Miin-Jang

    2016-07-01

    The characteristics of cascaded high-K gate stacks with reverse dielectric sequence, TiO2/ZrO2/Al2O3 and Al2O3/ZrO2/ TiO2, on the Si substrate were investigated. The reverse sequence with different gradient bandgap structure gives rise to distinct conduction pathways, resulting in significant divergence of the leakage current density (J g) and the capacitance equivalent thickness (CET). The trapping sites in the high-permittivity TiO2 layer dominate the leakage current paths and strongly impact the conductance and the capacitance of the cascaded high-K gate stacks. Thus, a low CET of 1.05 nm and a low J g of ˜5  ×  10-4 A cm-2 were achieved due to effective suppression of the leakage current through the traps of TiO2 in the cascaded TiO2/ZrO2/Al2O3 gate stack. In addition, the TiO2 layer gets crystallized in the cascaded TiO2/ZrO2/Al2O3 structure to achieve a higher capacitance because of the intermixing between TiO2 and ZrO2 due to the different reactivity of the precursors for Ti and Zr. This study demonstrates a way to effectively incorporate the high permittivity and low-bandgap materials, such as TiO2, into high-K gate stacks, to further improve device scaling.

  14. Stacking Up

    ERIC Educational Resources Information Center

    Naylor, Jim

    2005-01-01

    Chimneys and stacks appear to be strong and indestructible, but chimneys begin to deteriorate from the moment they are built. Early on, no signs are apparent; but deterioration accelerates in subsequent years, and major repairs are soon needed instead of minor maintenance. With proper attention, most structures can be repaired and continue to…

  15. Stacking Up

    ERIC Educational Resources Information Center

    Naylor, Jim

    2005-01-01

    Chimneys and stacks appear to be strong and indestructible, but chimneys begin to deteriorate from the moment they are built. Early on, no signs are apparent; but deterioration accelerates in subsequent years, and major repairs are soon needed instead of minor maintenance. With proper attention, most structures can be repaired and continue to…

  16. Fine-scale structure of the mid-mantle characterised by global stacks of PP precursors

    NASA Astrophysics Data System (ADS)

    Bentham, H. L. M.; Rost, S.; Thorne, M. S.

    2017-08-01

    Subduction zones are likely a major source of compositional heterogeneities in the mantle, which may preserve a record of the subduction history and mantle convection processes. The fine-scale structure associated with mantle heterogeneities can be studied using the scattered seismic wavefield that arrives as coda to or as energy preceding many body wave arrivals. In this study we analyse precursors to PP by creating stacks recorded at globally distributed stations. We create stacks aligned on the PP arrival in 5° distance bins (with range 70-120°) from 600 earthquakes recorded at 193 stations stacking a total of 7320 seismic records. As the energy trailing the direct P arrival, the P coda, interferes with the PP precursors, we suppress the P coda by subtracting a best fitting exponential curve to this energy. The resultant stacks show that PP precursors related to scattering from heterogeneities in the mantle are present for all distances. Lateral variations are explored by producing two regional stacks across the Atlantic and Pacific hemispheres, but we find only negligible differences in the precursory signature between these two regions. The similarity of these two regions suggests that well mixed subducted material can survive at upper and mid-mantle depth. To describe the scattered wavefield in the mantle, we compare the global stacks to synthetic seismograms generated using a Monte Carlo phonon scattering technique. We propose a best-fitting layered heterogeneity model, BRT2017, characterised by a three layer mantle with a background heterogeneity strength (ɛ = 0.8%) and a depth-interval of increased heterogeneity strength (ɛ = 1%) between 1000 km and 1800 km. The scalelength of heterogeneity is found to be 8 km throughout the mantle. Since mantle heterogeneity of 8 km scale may be linked to subducted oceanic crust, the detection of increased heterogeneity at mid-mantle depths could be associated with stalled slabs due to increases in viscosity

  17. Theoretical study on interfacial impact ionization in AlN/GaN periodically stacked structure

    NASA Astrophysics Data System (ADS)

    Zheng, Jiyuan; Wang, Lai; Wu, Xingzhao; Hao, Zhibiao; Sun, Changzheng; Xiong, Bing; Luo, Yi; Han, Yanjun; Wang, Jian; Li, Hongtao; Li, Mo; Kang, Jianbin; Li, Qian

    2017-07-01

    A theoretical study on interfacial ionization in the AlN/GaN periodically stacked structure (PSS) avalanche photodiode (APD) has been carried out to explain why the experimental electron ionization coefficient is higher than that in the simulation result. Full band structures for GaN and AlN are combined at the heterojunction interface of the PSS APD for the calculation of the suitable initial ionization state in AlN. Many suitable initial states exist in the Γ valley of AlN, where scattering rates are restricted and ultimately result in a higher ionization coefficient.

  18. Laser ablated coupling structures for stacked optical interconnections on printed circuit boards

    NASA Astrophysics Data System (ADS)

    Hendrickx, Nina; Van Steenberge, Geert; Geerinck, Peter; Van Erps, Jürgen; Thienpont, Hugo; Van Daele, Peter

    2006-04-01

    Laser ablation is presented as a versatile technology that can be used for the definition of arrays of multimode waveguides and coupling structures in a stacked two layer optical structure, integrated on a printed circuit board (PCB). The optical material, Truemode Backplane TM Polymer, is fully compatible with standard PCB manufacturing and shows excellent ablation properties. A KrF excimer laser is used for the ablation of both waveguides and coupling structures into the optical layer. The stacking of individual optical layers containing waveguides, that guide the light in the plane of the optical layer, and coupling structures, that provide out-of-plane coupling and coupling between different optical layers, is very interesting since it allows us to increase the integration density and routing possibilities and limit the number of passive components that imply a certain loss. Experimental results are presented, and surface roughness and profile measurements are performed on the structured elements for further characterization. Numerical simulations are presented on the tolerance on the angle of the coupling structures and the influence of tapering on the coupling efficiency of the waveguides.

  19. Porous Structures in Stacked, Crumpled and Pillared Graphene-Based 3D Materials

    PubMed Central

    Guo, Fei; Creighton, Megan; Chen, Yantao; Hurt, Robert; Külaots, Indrek

    2015-01-01

    Graphene, an atomically thin material with the theoretical surface area of 2600 m2g−1, has great potential in the fields of catalysis, separation, and gas storage if properly assembled into functional 3D materials at large scale. In ideal non-interacting ensembles of non-porous multilayer graphene plates, the surface area can be adequately estimated using the simple geometric law ~ 2600 m2g−1/N, where N is the number of graphene sheets per plate. Some processing operations, however, lead to secondary plate-plate stacking, folding, crumpling or pillaring, which give rise to more complex structures. Here we show that bulk samples of multilayer graphene plates stack in an irregular fashion that preserves the 2600/N surface area and creates regular slot-like pores with sizes that are multiples of the unit plate thickness. In contrast, graphene oxide deposits into films with massive area loss (2600 to 40 m2g−1) due to nearly perfect alignment and stacking during the drying process. Pillaring graphene oxide sheets by co-deposition of colloidal-phase particle-based spacers has the potential to partially restore the large monolayer surface. Surface areas as high as 1000 m2g−1 are demonstrated here through colloidal-phase deposition of graphene oxide with water-dispersible aryl-sulfonated ultrafine carbon black as a pillaring agent. PMID:26478597

  20. Porous Structures in Stacked, Crumpled and Pillared Graphene-Based 3D Materials.

    PubMed

    Guo, Fei; Creighton, Megan; Chen, Yantao; Hurt, Robert; Külaots, Indrek

    2014-01-01

    Graphene, an atomically thin material with the theoretical surface area of 2600 m(2)g(-1), has great potential in the fields of catalysis, separation, and gas storage if properly assembled into functional 3D materials at large scale. In ideal non-interacting ensembles of non-porous multilayer graphene plates, the surface area can be adequately estimated using the simple geometric law ~ 2600 m(2)g(-1)/N, where N is the number of graphene sheets per plate. Some processing operations, however, lead to secondary plate-plate stacking, folding, crumpling or pillaring, which give rise to more complex structures. Here we show that bulk samples of multilayer graphene plates stack in an irregular fashion that preserves the 2600/N surface area and creates regular slot-like pores with sizes that are multiples of the unit plate thickness. In contrast, graphene oxide deposits into films with massive area loss (2600 to 40 m(2)g(-1)) due to nearly perfect alignment and stacking during the drying process. Pillaring graphene oxide sheets by co-deposition of colloidal-phase particle-based spacers has the potential to partially restore the large monolayer surface. Surface areas as high as 1000 m(2)g(-1) are demonstrated here through colloidal-phase deposition of graphene oxide with water-dispersible aryl-sulfonated ultrafine carbon black as a pillaring agent.

  1. Stacking-sequence-independent band structure and shear exfoliation of two-dimensional electride materials

    NASA Astrophysics Data System (ADS)

    Yi, Seho; Choi, Jin-Ho; Lee, Kimoon; Kim, Sung Wng; Park, Chul Hong; Cho, Jun-Hyung

    2016-12-01

    The electronic band structure of crystals is generally influenced by the periodic arrangement of their constituent atoms. Specifically, the emerging two-dimensional (2D) layered structures have shown different band structures with respect to their stacking configurations. Here, based on first-principles density-functional theory calculations, we demonstrate that the band structure of the recently synthesized 2D Ca2N electride changes little for the stacking sequence as well as the lateral interlayer shift. This intriguing invariance of band structure with respect to geometrical variations can be attributed to a complete screening of [Ca2N ] + cationic layers by anionic excess electrons delocalized between the cationic layers. The resulting weak interactions between 2D dressed cationic layers give rise to not only a shallow potential barrier for bilayer sliding but also an electron-doping-facilitated shear exfoliation. Our findings open a route for exploration of the peculiar geometry-insensitive electronic properties in 2D electride materials, which will be useful for future thermally stable electronic applications.

  2. Testing of an actively damped boring bar featuring structurally integrated PZT stack actuators

    SciTech Connect

    Redmond, J.; Barney, P.

    1998-06-01

    This paper summarizes the results of cutting tests performed using an actively damped boring bar to minimize chatter in metal cutting. A commercially available 2 inch diameter boring bar was modified to incorporate PZT stack actuators for controlling tool bending vibrations encountered during metal removal. The extensional motion of the actuators induce bending moments in the host structure through a two-point preloaded mounting scheme. Cutting tests performed at various speeds and depths of cuts on a hardened steel workpiece illustrate the bar`s effectiveness toward eliminating chatter vibrations and improving workpiece surface finish.

  3. Long- and Short-Range Constraints for the Structure Determination of Layered Silicates with Stacking Disorder

    SciTech Connect

    Cadars, Sylvian; Allix, mathieu; Brouwer, Darren H.; Shayib, Ramzy; Suchomel, Matthew; Garaga, Mounesha N.; Rakhmatullin, Aydar; Burton, Allen W.; Zones, Stacy I.; Massiot, Dominique; Chmelka, Bradley F.

    2014-12-23

    Layered silicates have important applications as host materials, supports for catalysis, and zeolite precursors. However, their local structures are often challenging to establish due to disorder of the sheet assemblies. We present a new protocol that combines long- and short-range structural constraints from diffraction and solid-state NMR techniques, respectively, to determine the molecular structure of layered silicates in the presence of various extents of stacking disorder. Solid-state 29Si NMR data are largely insensitive to the incomplete extent of three-dimensional (3D) crystallinity that limits the interpretation of diffraction data alone to the identification of possible unit cells and space groups. State-of-the-art NMR crystallography techniques consequently provide a simplified view of materials from which candidate framework structures can be built and evaluated based on local structural constraints, including interatomic distances, Si site numbers and multiplicities, and Si–O–Si connectivities, and refined using density functional theory. This protocol was applied to a new layered silicate material named CLS-1, of composition [Si5O11H][C9N2H15]·1.9(H2O), synthesized by using a fluoride-based protocol and cationic alkylaminopyridinium as a structure-directing agent (SDA). Despite the intrinsic complexity and partial ordering of the intersheet arrangements and organic–inorganic interactions, this led to the identification of a single space group that is compatible with both NMR and diffraction data, from which the silicate framework structure could be established,. The remarkable similarities between the layered framework structures of CLS-1, HUS-2 (Tsunoji et al. J. Mater. Chem.2012, 22, 13682), and another layered silicate material with a radically different morphology and extent of stacking order and interlayer dynamics, established by using a similar approach (Brouwer et al. J. Am. Chem. Soc.2013, 135, 5641), point to the remarkable

  4. Structural investigations of Pt/TiOx electrode stacks for ferroelectric thin film devices

    NASA Astrophysics Data System (ADS)

    Cao, Jiang-Li; Solbach, Axel; Klemradt, Uwe; Weirich, Thomas; Mayer, Joachim; Horn-Solle, Herbert; Böttger, Ulrich; Schorn, Peter J.; Schneller, T.; Waser, Rainer

    2006-06-01

    Effects of the thermal treatment and the fabrication process of Pb(Zr0.3Ti0.7)O3 (PZT) thin films using chemical solution deposition on Pt/TiOx electrode stacks were investigated using complementary analytical techniques including atomic force microscopy (AFM), x-ray photoelectron spectroscopy, high-resolution transmission electron microscopy, and grazing incidence x-ray reflectivity of synchrotron radiation. The surface and interface structures of the Pt/TiOx electrode stacks with different thermal treatments, and the PZT/Pt/TiOx sample were examined. The propagation of Pt hillocks on the bare Pt/TiOx electrode stacks upon the annealing was observed. AFM observations also revealed that the upper surface of the Pt bottom electrode under PZT thin film became rougher than that of the bare Pt electrode with the same thermal history. Global structural information including the density, surface or interface root-mean-square roughness, and thickness of each constituent layer in the samples were determined using x-ray reflectivity. A density decrease of the Pt layer upon the annealing or during the fabrication of PZT thin films was found from fitting the specular reflectivity, and further confirmed by the negative shift of the Yoneda peak of Pt in the diffuse reflectivity. The formation of Pt hillocks on the bare Pt electrodes was attributed to the compressive stress during the high-temperature annealing caused by the limited incorporation of Ti and O into the Pt layer. Roughening of the PZT/Pt interface was ascribed to the interaction between the compressive stress in Pt and the indentation by the PZT crystallization and grain growth during the annealing.

  5. Stacking faults on (001) in transition-metal disilicides with the C11{sub b} structure

    SciTech Connect

    Ito, K.; Nakamoto, T.; Inui, H.; Yamaguchi, M.

    1997-12-31

    Stacking faults on (001) in MoSi{sub 2} and WSi{sub 2} with the C11{sub b} structure have been characterized by transmission electron microscopy (TEM), using their single crystals grown by the floating-zone method. Although WSi{sub 2} contains a high density of stacking faults, only several faults are observed in MoSi{sub 2}. For both crystals, (001) faults are characterized to be of the Frank-type in which two successive (001) Si layers are removed from the lattice, giving rise to a displacement vector parallel to [001]. When the displacement vector of faults is expressed in the form of R = 1/n[001], however, their n values are slightly deviated from the exact value of 3, because of dilatation of the lattice in the direction perpendicular to the fault, which is caused by the repulsive interaction between Mo (W) layers above and below the fault. Matching of experimental high-resolution TEM images with calculated ones indicates n values to be 3.12 {+-} 0.10 and 3.34 {+-} 0.10 for MoSi{sub 2} and WSi{sub 2}, respectively.

  6. Strain-Induced Electronic Structure Changes in Stacked van der Waals Heterostructures.

    PubMed

    He, Yongmin; Yang, Yang; Zhang, Zhuhua; Gong, Yongji; Zhou, Wu; Hu, Zhili; Ye, Gonglan; Zhang, Xiang; Bianco, Elisabeth; Lei, Sidong; Jin, Zehua; Zou, Xiaolong; Yang, Yingchao; Zhang, Yuan; Xie, Erqing; Lou, Jun; Yakobson, Boris; Vajtai, Robert; Li, Bo; Ajayan, Pulickel

    2016-05-11

    Vertically stacked van der Waals heterostructures composed of compositionally different two-dimensional atomic layers give rise to interesting properties due to substantial interactions between the layers. However, these interactions can be easily obscured by the twisting of atomic layers or cross-contamination introduced by transfer processes, rendering their experimental demonstration challenging. Here, we explore the electronic structure and its strain dependence of stacked MoSe2/WSe2 heterostructures directly synthesized by chemical vapor deposition, which unambiguously reveal strong electronic coupling between the atomic layers. The direct and indirect band gaps (1.48 and 1.28 eV) of the heterostructures are measured to be lower than the band gaps of individual MoSe2 (1.50 eV) and WSe2 (1.60 eV) layers. Photoluminescence measurements further show that both the direct and indirect band gaps undergo redshifts with applied tensile strain to the heterostructures, with the change of the indirect gap being particularly more sensitive to strain. This demonstration of strain engineering in van der Waals heterostructures opens a new route toward fabricating flexible electronics.

  7. Magnetic properties and interfacial characteristics of all-epitaxial Heusler-compound stacking structures

    NASA Astrophysics Data System (ADS)

    Yamada, S.; Honda, S.; Hirayama, J.; Kawano, M.; Santo, K.; Tanikawa, K.; Kanashima, T.; Itoh, H.; Hamaya, K.

    2016-09-01

    We study magnetic properties and interfacial characteristics of all-epitaxial D 03-Fe3Si /L 21 - Fe3 -xMnxSi /L 21-Co2FeSi Heusler-compound trilayers grown on Ge(111) by room-temperature molecular beam epitaxy. We find that the magnetization reversal processes can be intentionally designed by changing the chemical composition of the intermediate Fe3 -xMnxSi layers because of their tunable ferromagnetic-paramagnetic phase-transition temperature. From first-principles calculations, interfacial half metallicity in the Co2FeSi layer is nearly expected when the sequence of stacking layers along <111 > of the Fe2MnSi /Co2FeSi interface includes the atomic row of L 21 - or B 2 -ordered structures. We believe that Co2FeSi /Fe2MnSi /Co2FeSi trilayer systems stacked along <111 > will open a new avenue for high-performance current-perpendicular-to-plane giant magnetoresistive devices with Heusler compounds.

  8. Superior unipolar resistive switching in stacked ZrOx/ZrO2/ZrOx structure

    NASA Astrophysics Data System (ADS)

    Lin, Cheng-Li; Lin, Tse-Yu

    2016-03-01

    This study investigates the performance of unipolar-switched ZrO2 RRAM, using an oxygen-deficient and amorphous ZrOx capping in a sandwich stack Al/ZrOx/ZrO2/ZrOx/Al structure. Superior high and low resistance switching and a resistance ratio (HRS/LRS) greater than 10 showed excellent dc endurance of 7378 switching cycles and 3.8 × 104 cycles in pulse switching measurements. Recovery behavior, observed in the I-V curve for the SET process (or HRS), led to HRS fluctuations and instability. A new resistance switching model for the stacked ZrO2 RRAM is proposed in this paper. In this model, oxygen-deficient and amorphous ZrOx film, capped on polycrystalline ZrO2 film, plays a key role and acts as an oxygen reservoir in making the oxygen ions redox easily for the SET process and in facilitating re-oxidation for the RESET process, resulting in excellent endurance. By improving the stability and recovery phenomena, engineering parameters of the current control may play a critical role during switching, and they can be correlated to the film's thickness and the oxygen content of the amorphous ZrOx film.

  9. Trajectory tracking and vibration control in a space frame flexible structure with a PZT stack actuator

    NASA Astrophysics Data System (ADS)

    Garcia-Perez, Oscar A.; Silva-Navarro, G.; Peza-Solís, J. F.; Trujillo-Franco, L. G.

    2015-04-01

    This work deals with the robust asymptotic output tracking control problem of the tip position of a space frame flexible structure, mounted on a rigid revolute servomechanism actuated and controlled with a dc motor. The structure is also affected by undesirable vibrations due to excitation of its first lateral vibration modes and possible variations of the tip mass. The overall flexible structure is modeled by using finite element methods and this is validated via experimental modal analysis techniques. The tip position of the structure is estimated from acceleration and strain gauge measurements. The asymptotic output tracking problem is formulated and solved by means of Passivity-Based and Sliding-Mode Control techniques, applied to the dc motor coupled to the rigid part of the structure, and those undesirable vibrations are simultaneously attenuated by an active vibration control using Positive Position Feedback control schemes implemented on a PZT stack actuator properly located into the mechanical structure. The investigation also addresses the trajectory tracking problem of fast motions, with harmonic excitations close to the first vibration modes of the structure. The overall dynamic performance is evaluated and validated by numerical and experimental results.

  10. Tackling the stacking disorder of melon--structure elucidation in a semicrystalline material.

    PubMed

    Seyfarth, Lena; Seyfarth, Jan; Lotsch, Bettina V; Schnick, Wolfgang; Senker, Jürgen

    2010-03-07

    In this work we tackle the stacking disorder of melon, a layered carbon imide amide polymer with the ideal composition (C(6)N(7)(NH)(NH(2))). Although its existence has been postulated since 1834 the structure of individual melon layers could only recently be solved via electron diffraction and high-resolution (15)N solid-state NMR spectroscopy. With only weak van der Waals interactions between neighboring layers its long range stacking order is poorly defined preventing an efficient use of diffraction techniques. We, therefore, rely on a combination of solid-state NMR experiments and force field calculations. The key information is obtained based on heteronuclear ((1)H-(13)C) and homonuclear ((1)H-(1)H) second moments M(2) acquired from (1)H-(13)C cross polarization experiments. To allow for an interpretation of the polarization transfer rates the resonances in the (13)C MAS spectra have to be assigned and the hydrogen atoms have to be located. The assignment was performed using a two-dimensional (15)N-(13)C iDCP experiment. For the determination of the position of the hydrogen atoms NH and HH distances were measured via(1)H-(15)N Lee-Goldburg CP and (1)H-(1)H double-quantum build-up curves, respectively. Furthermore, the homogeneity of the material under examination was investigated exploiting (15)N spin-diffusion. Based on force field methods 256 structure models with varying lateral arrangements between neighboring layers were created. For each model the M(2) were calculated allowing them to be ranked by comparing calculated and measured M(2) as well as via their force field energies. This allows the creation of markedly structured hypersurfaces with two distinctly favored shift vectors for the displacement of neighboring layers.

  11. A substrate-bound structure of cyanobacterial biliverdin reductase identifies stacked substrates as critical for activity

    PubMed Central

    Takao, Haruna; Hirabayashi, Kei; Nishigaya, Yuki; Kouriki, Haruna; Nakaniwa, Tetsuko; Hagiwara, Yoshinori; Harada, Jiro; Sato, Hideaki; Yamazaki, Toshimasa; Sakakibara, Yoichi; Suiko, Masahito; Asada, Yujiro; Takahashi, Yasuhiro; Yamamoto, Ken; Fukuyama, Keiichi; Sugishima, Masakazu; Wada, Kei

    2017-01-01

    Biliverdin reductase catalyses the last step in haem degradation and produces the major lipophilic antioxidant bilirubin via reduction of biliverdin, using NAD(P)H as a cofactor. Despite the importance of biliverdin reductase in maintaining the redox balance, the molecular details of the reaction it catalyses remain unknown. Here we present the crystal structure of biliverdin reductase in complex with biliverdin and NADP+. Unexpectedly, two biliverdin molecules, which we designated the proximal and distal biliverdins, bind with stacked geometry in the active site. The nicotinamide ring of the NADP+ is located close to the reaction site on the proximal biliverdin, supporting that the hydride directly attacks this position of the proximal biliverdin. The results of mutagenesis studies suggest that a conserved Arg185 is essential for the catalysis. The distal biliverdin probably acts as a conduit to deliver the proton from Arg185 to the proximal biliverdin, thus yielding bilirubin. PMID:28169272

  12. Electronic Structure of ABC-stacked Multilayer Graphene and Trigonal Warping:A First Principles Calculation

    NASA Astrophysics Data System (ADS)

    Yelgel, Celal

    2016-04-01

    We present an extensive density functional theory (DFT) based investigation of the electronic structures of ABC-stacked N-layer graphene. It is found that for such systems the dispersion relations of the highest valence and the lowest conduction bands near the K point in the Brillouin zone are characterised by a mixture of cubic, parabolic, and linear behaviours. When the number of graphene layers is increased to more than three, the separation between the valence and conduction bands decreases up until they touch each other. For five and six layer samples these bands show flat behaviour close to the K point. We note that all states in the vicinity of the Fermi energy are surface states originated from the top and/or bottom surface of all the systems considered. For the trilayer system, N = 3, pronounced trigonal warping of the bands slightly above the Fermi level is directly obtained from DFT calculations.

  13. New structural insights into Golgi Reassembly and Stacking Protein (GRASP) in solution

    PubMed Central

    Mendes, Luís F. S.; Garcia, Assuero F.; Kumagai, Patricia S.; de Morais, Fabio R.; Melo, Fernando A.; Kmetzsch, Livia; Vainstein, Marilene H.; Rodrigues, Marcio L.; Costa-Filho, Antonio J.

    2016-01-01

    Among all proteins localized in the Golgi apparatus, a two-PDZ (PSD95/DlgA/Zo-1) domain protein plays an important role in the assembly of the cisternae. This Golgi Reassembly and Stacking Protein (GRASP) has puzzled researchers due to its large array of functions and relevance in Golgi functionality. We report here a biochemical and biophysical study of the GRASP55/65 homologue in Cryptococcus neoformans (CnGRASP). Bioinformatic analysis, static fluorescence and circular dichroism spectroscopies, calorimetry, small angle X-ray scattering, solution nuclear magnetic resonance, size exclusion chromatography and proteolysis assays were used to unravel structural features of the full-length CnGRASP. We detected the coexistence of regular secondary structures and large amounts of disordered regions. The overall structure is less compact than a regular globular protein and the high structural flexibility makes its hydrophobic core more accessible to solvent. Our results indicate an unusual behavior of CnGRASP in solution, closely resembling a class of intrinsically disordered proteins called molten globule proteins. To the best of our knowledge, this is the first structural characterization of a full-length GRASP and observation of a molten globule-like behavior in the GRASP family. The possible implications of this and how it could explain the multiple facets of this intriguing class of proteins are discussed. PMID:27436376

  14. Single-Crystal X-ray Structures of conductive π-Stacking Dimers of Tetrakis(alkylthio)benzene Radical Cations

    NASA Astrophysics Data System (ADS)

    Chen, Xiaoyu; Gao, Feng; Yang, Wuqin

    2016-07-01

    Salts containing radical cations of 1,2,4,5-tetrakis(isopropylthio)benzene (TPB) and 1,2,4,5-tetrakis(ethylthio) benzene (TEB) have been successfully synthesized with . These newly synthesized salts have been characterized by UV-Vis absorption, EPR spectroscopy, conductivity measurement, single crystal X-ray diffraction analysis as well as DFT calculation. This study raises the first crystal structure of conductive π-stacking radical cation with single phenyl ring and reveals their conductivity has relationship with the stack structure which affected by the substituent.

  15. Single-Crystal X-ray Structures of conductive π-Stacking Dimers of Tetrakis(alkylthio)benzene Radical Cations

    PubMed Central

    Chen, Xiaoyu; Gao, Feng; Yang, Wuqin

    2016-01-01

    Salts containing radical cations of 1,2,4,5-tetrakis(isopropylthio)benzene (TPB) and 1,2,4,5-tetrakis(ethylthio) benzene (TEB) have been successfully synthesized with . These newly synthesized salts have been characterized by UV-Vis absorption, EPR spectroscopy, conductivity measurement, single crystal X-ray diffraction analysis as well as DFT calculation. This study raises the first crystal structure of conductive π-stacking radical cation with single phenyl ring and reveals their conductivity has relationship with the stack structure which affected by the substituent. PMID:27403720

  16. Two-Dimensional Layered Oxide Structures Tailored by Self-Assembled Layer Stacking via Interfacial Strain.

    PubMed

    Zhang, Wenrui; Li, Mingtao; Chen, Aiping; Li, Leigang; Zhu, Yuanyuan; Xia, Zhenhai; Lu, Ping; Boullay, Philippe; Wu, Lijun; Zhu, Yimei; MacManus-Driscoll, Judith L; Jia, Quanxi; Zhou, Honghui; Narayan, Jagdish; Zhang, Xinghang; Wang, Haiyan

    2016-07-06

    Study of layered complex oxides emerge as one of leading topics in fundamental materials science because of the strong interplay among intrinsic charge, spin, orbital, and lattice. As a fundamental basis of heteroepitaxial thin film growth, interfacial strain can be used to design materials that exhibit new phenomena beyond their conventional forms. Here, we report a strain-driven self-assembly of bismuth-based supercell (SC) with a two-dimensional (2D) layered structure. With combined experimental analysis and first-principles calculations, we investigated the full SC structure and elucidated the fundamental growth mechanism achieved by the strain-enabled self-assembled atomic layer stacking. The unique SC structure exhibits room-temperature ferroelectricity, enhanced magnetic responses, and a distinct optical bandgap from the conventional double perovskite structure. This study reveals the important role of interfacial strain modulation and atomic rearrangement in self-assembling a layered singe-phase multiferroic thin film, which opens up a promising avenue in the search for and design of novel 2D layered complex oxides with enormous promise.

  17. Electronic structure of transferred graphene/h-BN van der Waals heterostructures with nonzero stacking angles by nano-ARPES

    NASA Astrophysics Data System (ADS)

    Wang, Eryin; Chen, Guorui; Wan, Guoliang; Lu, Xiaobo; Chen, Chaoyu; Avila, Jose; Fedorov, Alexei V.; Zhang, Guangyu; Asensio, Maria C.; Zhang, Yuanbo; Zhou, Shuyun

    2016-11-01

    In van der Waals heterostructures, the periodic potential from the Moiré superlattice can be used as a control knob to modulate the electronic structure of the constituent materials. Here we present a nanoscale angle-resolved photoemission spectroscopy (nano-ARPES) study of transferred graphene/h-BN heterostructures with two different stacking angles of 2.4° and 4.3° respectively. Our measurements reveal six replicas of graphene Dirac cones at the superlattice Brillouin zone (SBZ) centers. The size of the SBZ and its relative rotation angle to the graphene BZ are in good agreement with Moiré superlattice period extracted from atomic force microscopy (AFM) measurements. Comparison to the epitaxial graphene/h-BN with 0° stacking angles suggests that the interaction between graphene and h-BN decreases with increasing stacking angle.

  18. Two-Dimensional Layered Oxide Structures Tailored by Self-Assembled Layer Stacking via Interfacial Strain

    SciTech Connect

    Zhang, Wenrui; Li, Mingtao; Chen, Aiping; Li, Leigang; Zhu, Yuanyuan; Xia, Zhenhai; Lu, Ping; Boullay, Philippe; Wu, Lijun; Zhu, Yimei; MacManus-Driscoll, Judith L.; Jia, Quanxi; Zhou, Honghui; Narayan, Jagdish; Zhang, Xinghang; Wang, Haiyan

    2016-06-13

    Two-dimensional (2D) nanostructures emerge as one of leading topics in fundamental materials science and could enable next generation nanoelectronic devices. Beyond graphene and molybdenum disulphide, layered complex oxides are another large group of promising 2D candidates because of their strong interplay of intrinsic charge, spin, orbital and lattice. As a fundamental basis of heteroepitaxial thin film growth, interfacial strain can be used to design materials exhibiting new phenomena beyond their conventional form. Here we report the strain-driven self-assembly of Bismuth-based supercells (SC) with a 2D layered structure, and elucidate the fundamental growth mechanism with combined experimental tools and first-principles calculations. The study revealed that the new layered structures were formed by the strain-enabled self-assembled atomic layer stacking, i.e., alternative growth of Bi2O2 layer and [Fe0.5Mn0.5]O6 layer. The strain-driven approach is further demonstrated in other SC candidate systems with promising room-temperature multiferroic properties. This well-integrated theoretical and experimental study inspired by the Materials Genome Initiatives opens up a new avenue in searching and designing novel 2D layered complex oxides with enormous promises.

  19. Two-Dimensional Layered Oxide Structures Tailored by Self-Assembled Layer Stacking via Interfacial Strain

    SciTech Connect

    Zhang, Wenrui; Li, Mingtao; Chen, Aiping; Li, Leigang; Zhu, Yuanyuan; Xia, Zhenhai; Lu, Ping; Boullay, Philippe; Wu, Lijun; Zhu, Yimei; MacManus-Driscoll, Judith L.; Jia, Quanxi; Zhou, Honghui; Narayan, Jagdish; Zhang, Xinghang; Wang, Haiyan

    2016-06-13

    Two-dimensional (2D) nanostructures emerge as one of leading topics in fundamental materials science and could enable next generation nanoelectronic devices. Beyond graphene and molybdenum disulphide, layered complex oxides are another large group of promising 2D candidates because of their strong interplay of intrinsic charge, spin, orbital and lattice. As a fundamental basis of heteroepitaxial thin film growth, interfacial strain can be used to design materials exhibiting new phenomena beyond their conventional form. Here we report the strain-driven self-assembly of Bismuth-based supercells (SC) with a 2D layered structure, and elucidate the fundamental growth mechanism with combined experimental tools and first-principles calculations. The study revealed that the new layered structures were formed by the strain-enabled self-assembled atomic layer stacking, i.e., alternative growth of Bi2O2 layer and [Fe0.5Mn0.5]O6 layer. The strain-driven approach is further demonstrated in other SC candidate systems with promising room-temperature multiferroic properties. This well-integrated theoretical and experimental study inspired by the Materials Genome Initiatives opens up a new avenue in searching and designing novel 2D layered complex oxides with enormous promises.

  20. Two-Dimensional Layered Oxide Structures Tailored by Self-Assembled Layer Stacking via Interfacial Strain

    DOE PAGES

    Zhang, Wenrui; Li, Mingtao; Chen, Aiping; ...

    2016-06-13

    Two-dimensional (2D) nanostructures emerge as one of leading topics in fundamental materials science and could enable next generation nanoelectronic devices. Beyond graphene and molybdenum disulphide, layered complex oxides are another large group of promising 2D candidates because of their strong interplay of intrinsic charge, spin, orbital and lattice. As a fundamental basis of heteroepitaxial thin film growth, interfacial strain can be used to design materials exhibiting new phenomena beyond their conventional form. Here we report the strain-driven self-assembly of Bismuth-based supercells (SC) with a 2D layered structure, and elucidate the fundamental growth mechanism with combined experimental tools and first-principles calculations.more » The study revealed that the new layered structures were formed by the strain-enabled self-assembled atomic layer stacking, i.e., alternative growth of Bi2O2 layer and [Fe0.5Mn0.5]O6 layer. The strain-driven approach is further demonstrated in other SC candidate systems with promising room-temperature multiferroic properties. This well-integrated theoretical and experimental study inspired by the Materials Genome Initiatives opens up a new avenue in searching and designing novel 2D layered complex oxides with enormous promises.« less

  1. Transport in vertically stacked hetero-structures from 2D materials

    NASA Astrophysics Data System (ADS)

    Chen, Fan; Ilatikhameneh, Hesameddin; Tan, Yaohua; Valencia, Daniel; Klimeck, Gerhard; Rahman, Rajib

    2017-06-01

    In this work, the transport of tunnel field-effect transistor (TFET) based on vertically stacked hereto-structures from 2D transition metal dichalcogenide (TMD) materials is investigated by atomistic quantum transport simulations. WTe2-MoS2 combination was chosen due to the formation of a broken gap hetero-junction which is desirable for TFETs. There are two assumptions behind the MoS2-WTe2 hetero-junction tight binding (TB) model: 1) lattice registry. 2) The S - Te parameters being the average of the S - S and Te - Te parameters of bilayer MoS2 and WTe2. The computed TB bandstructure of the hetero-junction agrees well with the bandstructure obtained from density functional theory (DFT) in the energy range of interest for transport. NEGF (Non-Equilibrium Green’s Function) equations within the tight binding description is then utilized for device transfer characteristic calculation. Results show 1) energy filtering is the switching mechanism; 2) the length of the extension region is critical for device to turn off; 3) MoS2-WTe2 interlayer TFET can achieve a large on-current of 1000µA/µm with VDD = 0.3V, which suggests interlayer TFET can solve the low ON current problem of TFETs and can be a promising candidate for low power applications.

  2. Water replacement hypothesis in atomic detail--factors determining the structure of dehydrated bilayer stacks.

    PubMed

    Golovina, Elena A; Golovin, Andrey V; Hoekstra, Folkert A; Faller, Roland

    2009-07-22

    According to the water replacement hypothesis, trehalose stabilizes dry membranes by preventing the decrease of spacing between membrane lipids under dehydration. In this study, we use molecular-dynamics simulations to investigate the influence of trehalose on the area per lipid (APL) and related structural properties of dehydrated bilayers in atomic detail. The starting conformation of a palmitoyloleolylphosphatidylcholine lipid bilayer in excess water was been obtained by self-assembly. A series of molecular-dynamics simulations of palmitoyloleolylphosphatidylcholine with different degrees of dehydration (28.5, 11.7, and 5.4 waters per lipid) and different molar trehalose/lipid ratios (<1:1, 1:1, and >1:1) were carried out in the NPT ensemble. Water removal causes the formation of multilamellar "stacks" through periodic boundary conditions. The headgroups reorient from pointing outward to inward with dehydration. This causes changes in the electrostatic interactions between interfaces, resulting in interface interpenetration. Interpenetration creates self-spacing of the bilayers and prevents gel-phase formation. At lower concentrations, trehalose does not separate the interfaces, and acting together with self-spacing, it causes a considerable increase of APL. APL decreases at higher trehalose concentrations when the layer of sugar physically separates the interfaces. When interfaces are separated, the model confirms the water replacement hypothesis.

  3. Enhanced water removal in a fuel cell stack by droplet atomization using structural and acoustic excitation

    NASA Astrophysics Data System (ADS)

    Palan, Vikrant; Shepard, W. Steve

    This work examines new methods for enhancing product water removal in fuel cell stacks. Vibration and acoustic based methods are proposed to atomize condensed water droplets in the channels of a bipolar plate or on a membrane electrode assembly (MEA). The vibration levels required to atomize water droplets of different sizes are first examined using two different approaches: (1) exciting the droplet at the same energy level required to form that droplet; and (2) by using a method called 'vibration induced droplet atomization', or VIDA. It is shown analytically that a 2 mm radius droplet resting on a bipolar-like plate can be atomized by inducing acceleration levels as low as 250 g at a certain frequency. By modeling the direct structural excitation of a simplified bipolar plate using a realistic source, the response levels that can be achieved are then compared with those required levels. Furthermore, a two-cell fuel cell finite element model and a boundary element model of the MEA were developed to demonstrate that the acceleration levels required for droplet atomization may be achieved in both the bipolar plate as well as the MEA through proper choice of excitation frequency and source strength.

  4. Stacked functionalized silicene: a powerful system to adjust the electronic structure of silicene.

    PubMed

    Denis, Pablo A

    2015-02-21

    Herein, we employed first principle density functional periodic calculations to characterize the silicon counterpart of graphene:silicene. We found that silicene is far more reactive than graphene, very stable and strong Si-X bonds can be formed, where X = H, CH3, OH and F. The Si-F bond is the strongest one, with a binding energy of 114.9 kcal mol(-1). When radicals are agglomerated, the binding energy per functional grows up to 17 kcal mol(-1). The functionalization with OH radicals produces the largest alterations of the structure of silicene, due to the presence of intralayer hydrogen bonds. The covalent addition of H, CH3, OH and F to silicene enables the adjustment of its electronic structure. In effect, functionalized silicene can be a semiconductor or even exhibit metallic properties when the type and concentration of radicals are varied. The most interesting results were obtained when two layers of functionalized silicene were stacked, given that the band gaps experienced a significant reduction with respect to those computed for symmetrically and asymmetrically (Janus) functionalized monolayer silicenes. In the case of fluorine, the largest changes in the electronic structure of bilayer silicene were appreciated when at least one side of silicene was completely fluorinated. In general, the fluorinated side induces metallic properties in a large number of functionalized silicenes. In some cases which presented band gaps as large as 3.2 eV when isolated, the deposition over fluorinated silicene was able to close that gap and induce a metallic character. In addition to this, in four cases small gaps in the range of 0.1-0.6 eV were obtained for bilayer silicenes. Therefore, functionalization of silicene is a powerful method to produce stable two-dimensional silicon based nanomaterials with tunable optical band gaps.

  5. Stacking Structures of Few-Layer Graphene Revealed by Phase-Sensitive Infrared Nanoscopy.

    PubMed

    Kim, Deok-Soo; Kwon, Hyuksang; Nikitin, Alexey Yu; Ahn, Seongjin; Martín-Moreno, Luis; García-Vidal, Francisco J; Ryu, Sunmin; Min, Hongki; Kim, Zee Hwan

    2015-07-28

    The stacking orders in few-layer graphene (FLG) strongly influences the electronic properties of the material. To explore the stacking-specific properties of FLG in detail, one needs powerful microscopy techniques that visualize stacking domains with sufficient spatial resolution. We demonstrate that infrared (IR) scattering scanning near-field optical microscopy (sSNOM) directly maps out the stacking domains of FLG with a nanometric resolution, based on the stacking-specific IR conductivities of FLG. The intensity and phase contrasts of sSNOM are compared with the sSNOM contrast model, which is based on the dipolar tip-sample coupling and the theoretical conductivity spectra of FLG, allowing a clear assignment of each FLG domain as Bernal, rhombohedral, or intermediate stacks for tri-, tetra-, and pentalayer graphene. The method offers 10-100 times better spatial resolution than the far-field Raman and infrared spectroscopic methods, yet it allows far more experimental flexibility than the scanning tunneling microscopy and electron microscopy.

  6. Birnessite-Type MnO 2 Nanosheets with Layered Structures Under High Pressure: Elimination of Crystalline Stacking Faults and Oriented Laminar Assembly

    SciTech Connect

    Sun, Yugang; Wang, Lin; Liu, Yuzi; Ren, Yang

    2014-09-01

    Squeezing out crystalline stacking faults: Birnessite-type δ-phase MnO2 microflowers containing interconnected ultrathin nanosheets are synthesized through a microwave-assisted hydrothermal process and exhibit a layered crystalline structure with significant stacking faults. Compressing these MnO2 nanosheets in a diamond anvil cell with high pressure up to tens of GPa effectively eliminates the crystalline stacking faults.

  7. The impact of sedimentary anisotropy on solute mixing in stacked scour-pool structures

    NASA Astrophysics Data System (ADS)

    Bennett, Jeremy P.; Haslauer, Claus P.; Cirpka, Olaf A.

    2017-04-01

    The spatial variability of hydraulic conductivity is known to have a strong impact on solute spreading and mixing. In most investigations, its local anisotropy has been neglected. Recent studies have shown that spatially varying orientation in sedimentary anisotropy can lead to twisting flow enhancing transverse mixing, but most of these studies used geologically implausible geometries. We use an object-based approach to generate stacked scour-pool structures with either isotropic or anisotropic filling which are typically reported in glacial outwash deposits. We analyze how spatially variable isotropic conductivity and variation of internal anisotropy in these features impacts transverse plume deformation and both longitudinal and transverse spreading and mixing. In five test cases, either the scalar values of conductivity or the spatial orientation of its anisotropy is varied between the scour-pool structures. Based on 100 random configurations, we compare the variability of velocity components, stretching and folding metrics, advective travel-time distributions, one and two-particle statistics in advective-dispersive transport, and the flux-related dilution indices for steady state advective-dispersive transport among the five test cases. Variation in the orientation of internal anisotropy causes strong variability in the lateral velocity components, which leads to deformation in transverse directions and enhances transverse mixing, whereas it hardly affects the variability of the longitudinal velocity component and thus longitudinal spreading and mixing. The latter is controlled by the spatial variability in the scalar values of hydraulic conductivity. Our results demonstrate that sedimentary anisotropy is important for transverse mixing, whereas it may be neglected when considering longitudinal spreading and mixing.

  8. Electronic structure, stacking energy, partial charge, and hydrogen bonding in four periodic B-DNA models

    NASA Astrophysics Data System (ADS)

    Poudel, Lokendra; Rulis, Paul; Liang, Lei; Ching, W. Y.

    2014-08-01

    We present a theoretical study of the electronic structure of four periodic B-DNA models labeled (AT)10,(GC)10, (AT)5(GC)5, and (AT-GC)5 where A denotes adenine, T denotes thymine, G denotes guanine, and C denotes cytosine. Each model has ten base pairs with Na counterions to neutralize the negative phosphate group in the backbone. The (AT)5(GC)5 and (AT-GC)5 models contain two and five AT-GC bilayers, respectively. When compared against the average of the two pure models, we estimate the AT-GC bilayer interaction energy to be 19.015 Kcal/mol, which is comparable to the hydrogen bonding energy between base pairs obtained from the literature. Our investigation shows that the stacking of base pairs plays a vital role in the electronic structure, relative stability, bonding, and distribution of partial charges in the DNA models. All four models show a highest occupied molecular orbital (HOMO) to lowest unoccupied molecular orbital (LUMO) gap ranging from 2.14 to 3.12 eV with HOMO states residing on the PO4 + Na functional group and LUMO states originating from the bases. Our calculation implies that the electrical conductance of a DNA molecule should increase with increased base-pair mixing. Interatomic bonding effects in these models are investigated in detail by analyzing the distributions of the calculated bond order values for every pair of atoms in the four models including hydrogen bonding. The counterions significantly affect the gap width, the conductivity, and the distribution of partial charge on the DNA backbone. We also evaluate quantitatively the surface partial charge density on each functional group of the DNA models.

  9. Data in support of crystal structures of highly-ordered long-period stacking-ordered phases with 18R, 14H and 10H-type stacking sequences in the Mg-Zn-Y system.

    PubMed

    Kishida, Kyosuke; Nagai, Kaito; Matsumoto, Akihide; Inui, Haruyuki

    2015-12-01

    The crystal structures of highly-ordered Mg-Zn-Y long-period stacking-ordered (LPSO) phases with the 18R, 14H and 10H-type stacking sequences have been investigated by atomic-resolution scanning transmission electron microscopy (STEM) and transmission electron microscopy (Kishida et al., 2015) [1]. This data article provides supporting materials for the crystal structure analysis based on the crystallographic theory of the order-disorder (OD) structure and the crystallographic information obtained through the structural optimization for various simple polytypes of the highly-ordered Mg-Zn-Y LPSO phases with the 18R, 14H and 10H-type stacking sequences by first-principles density functional theory (DFT) calculations.

  10. Electronic States of Hafnium and Vanadium oxide in Silicon Gate Stack Structure

    NASA Astrophysics Data System (ADS)

    Zhu, Chiyu; Tang, Fu; Liu, Xin; Yang, Jialing; Nemanich, Robert

    2010-03-01

    Vanadium oxide (VO2) is a narrow band gap material with a metal-insulator transition (MIT) at less than 100C. Hafnium oxide (HfO2) is currently the preferred high-k material for gate dielectrics. To utilize VO2 in a charge storage device, it is necessary to understand the band relationships between VO2, HfO2, and Si substrate. In this study, a 2nm thick VO2 layer is embedded in a dielectric stack structure between an oxidized n-type Si(100) surface and a 2nm HfO2 layer. The in situ experiments are carried out in an UHV multi-chamber system. After each growth step, the surface is characterized using XPS and UPS. After the initial plasma cleaning and oxidation treatment the Si substrate displayed essentially flat bands at the surface. After deposition of the VO2 layer, the Si 2p peak shifted to lower binding energy, and the Si 2p associated with the SiO2 layer also was shifted, indicating an internal field in the SiO2. The VO2 valence band maximum (VBM) was identified at 0.6 eV below the Fermi level (EF). This ultra thin VO2 exhibits the metal-insulator transition at a temperature higher than thicker films. As a comparison, a 100nm thick film of VO2 on Si showed a MIT at 60C. After the HfO2 deposition, the Si 2p substrate feature returned to the initial value indicating a return to flat band conditions. The UPS indicated the VBM of HfO2 at 4.0 eV below EF. This work is supported by the NSF (DMR-0805353).

  11. Fatigue Analysis of Proton Exchange Membrane Fuel Cell Stacks Based on Structural Stress Distribution

    NASA Astrophysics Data System (ADS)

    Wu, C. W.; Liu, B.; Wei, M. Y.; Liu, L. F.

    2017-05-01

    Proton exchange membrane fuel cell (PEMFC) stack usually undergoes various vibrations during packing, transportation and serving time, in particular for those used in the automobiles and portable equipment. Based on the Miner fatigue damage theory, the fatigue lives of the fuel cell components are first assessed. Then the component fatigue life contours of the stack are obtained under four working conditions, i.e. the three single-axial (in X-, Y- and Z-axis separately) and multi-axial random vibrations. Accordingly, the component damage under various vibrations is evaluated. The stress distribution on the gasket and PEM will greatly affect their fatigue lives. Finally, we compare the fatigue lives of 4-bolt- and 6-bolt-clamping stacks under the same total clamping force, and find that increasing the bolt number could improve the bolt fatigue lives.

  12. Structure and stacking-fault energy in metals Al, Pd, Pt, Ir, and Rh

    NASA Astrophysics Data System (ADS)

    Cai, J.; Wang, F.; Lu, C.; Wang, Y. Y.

    2004-06-01

    The generalized stacking faults of Al, Pd, Pt, Ir, and Rh are investigated by a parametrized tight-binding potential. The stacking-fault energies (SFEs) are calculated to be in good agreement with experimental data, except for Al. More important, it is found that the SFE of Pt may be reduced by 14% by atom relaxation while the effect of atom relaxation on the SFEs of Al, Pd, Ir, and Rh are small. Thus, it is concluded that the effect of atom relaxation on SFE should be important, especially for an alloy system where radii difference between two constituting elements is large.

  13. About zone structure of a stack of a cholesteric liquid crystal and isotropic medium layers

    NASA Astrophysics Data System (ADS)

    Gevorgyan, A. H.; Matinyan, G. K.; Harutyunyan, M. Z.; Harutyunyan, E. M.

    2014-05-01

    The optical properties of a stack of metamaterial-based cholesteric liquid crystal (CLC) layers and isotropic medium layers are investigated. CLCs with two types of chiral nihility are defined. The peculiarities of the reflection spectra of this system are investigated and it is shown that the reflection spectra of the stacks of CLC layers of these two types differ from each other. The influence of: the CLC sublayer thicknesses; incidence angle; local dielectric (magnetic) anisotropy of the CLC layers; refraction indices and thicknesses of the isotropic media layers on the reflection spectra and other optical characteristics of the system is investigated.

  14. First-Principles Analysis on π-bonded Chain Structure on Several Polytypes of SiC Surfaces: Importance of Stacking Sequence on Energetics and Electronic Structures

    NASA Astrophysics Data System (ADS)

    Kaneko, Tomoaki; Tajima, Nobuo; Yamasaki, Takahiro; Ohno, Takahisa

    2017-09-01

    Using first principles calculations based on a density functional theory, the energetics and electronic properties of a (2 × 1) π-bonded chain structure in several polytypes of SiC surfaces are discussed with special attention to the stacking sequence of SiC bilayers. We found that the stacking sequence of the topmost two SiC bilayers plays a decisive role for the stability and electronic structures of the π-bonded chain structure. We showed that the homo-elemental bonds in π-bonded chain structures cause alterations in the electronic structures of both the Si- and C-faces. The energetics of π-bonded chain structures on other group IV and IV-IV compound semiconductors were also investigated. We also showed that the buckling structure in the monolayer honeycomb lattice reflects the buckling of the topmost two atoms in the π-bonded chain structure observed in Si(111) and Ge(111).

  15. Structure of kaolinite and influence of stacking faults: reconciling theory and experiment using inelastic neutron scattering analysis.

    PubMed

    White, Claire E; Kearley, Gordon J; Provis, John L; Riley, Daniel P

    2013-05-21

    The structure of kaolinite at the atomic level, including the effect of stacking faults, is investigated using inelastic neutron scattering (INS) spectroscopy and density functional theory (DFT) calculations. The vibrational dynamics of the standard crystal structure of kaolinite, calculated using DFT (VASP) with normal mode analysis, gives good agreement with the experimental INS data except for distinct discrepancies, especially for the low frequency modes (200-400 cm(-1)). By generating several types of stacking faults (shifts in the a,b plane for one kaolinite layer relative to the adjacent layer), it is seen that these low frequency modes are affected, specifically through the emergence of longer hydrogen bonds (O-H⋯O) in one of the models corresponding to a stacking fault of -0.3151a - 0.3151b. The small residual disagreement between observed and calculated INS is assigned to quantum effects (which are not taken into account in the DFT calculations), in the form of translational tunneling of the proton in the hydrogen bonds, which lead to a softening of the low frequency modes. DFT-based molecular dynamics simulations show that anharmonicity does not play an important role in the structural dynamics of kaolinite.

  16. Universal composition-structure-property maps for natural and biomimetic platelet-matrix composites and stacked heterostructures.

    PubMed

    Sakhavand, Navid; Shahsavari, Rouzbeh

    2015-03-16

    Many natural and biomimetic platelet-matrix composites--such as nacre, silk, and clay-polymer-exhibit a remarkable balance of strength, toughness and/or stiffness, which call for a universal measure to quantify this outstanding feature given the structure and material characteristics of the constituents. Analogously, there is an urgent need to quantify the mechanics of emerging electronic and photonic systems such as stacked heterostructures. Here we report the development of a unified framework to construct universal composition-structure-property diagrams that decode the interplay between various geometries and inherent material features in both platelet-matrix composites and stacked heterostructures. We study the effects of elastic and elastic-perfectly plastic matrices, overlap offset ratio and the competing mechanisms of platelet versus matrix failures. Validated by several 3D-printed specimens and a wide range of natural and synthetic materials across scales, the proposed universally valid diagrams have important implications for science-based engineering of numerous platelet-matrix composites and stacked heterostructures.

  17. Universal composition-structure-property maps for natural and biomimetic platelet-matrix composites and stacked heterostructures

    NASA Astrophysics Data System (ADS)

    Sakhavand, Navid; Shahsavari, Rouzbeh

    2015-03-01

    Many natural and biomimetic platelet-matrix composites—such as nacre, silk, and clay-polymer—exhibit a remarkable balance of strength, toughness and/or stiffness, which call for a universal measure to quantify this outstanding feature given the structure and material characteristics of the constituents. Analogously, there is an urgent need to quantify the mechanics of emerging electronic and photonic systems such as stacked heterostructures. Here we report the development of a unified framework to construct universal composition-structure-property diagrams that decode the interplay between various geometries and inherent material features in both platelet-matrix composites and stacked heterostructures. We study the effects of elastic and elastic-perfectly plastic matrices, overlap offset ratio and the competing mechanisms of platelet versus matrix failures. Validated by several 3D-printed specimens and a wide range of natural and synthetic materials across scales, the proposed universally valid diagrams have important implications for science-based engineering of numerous platelet-matrix composites and stacked heterostructures.

  18. Structural Transformation from the Unreconstructed (1×1) Structure to the (7×7) Dimer Adatom Stacking-Fault Structure on Si(111) Studied by Monte Carlo Simulations

    NASA Astrophysics Data System (ADS)

    Itoh, Makoto

    2017-10-01

    Surface reconstruction process from the unreconstructed (1×1) structure to the (7×7) dimer adatom stacking-fault (DAS) structure on Si(111) is studied by Monte Carlo simulations. For this purpose, we have developed a double layer model consisting of adatoms and the three-pointed plane rotors in the first and second layers, respectively. Monte Carlo simulations are carried out to find that creation, annihilation, and coalescence of non-periodic structures frequently occur in the initial stage of the transformation, and the coalescence is found to cause abrupt changes in the sizes of such structures. At later stages, a partial corner hole is created and changes to a proper corner hole when the vertexes of three half cells surrounding it become in phase with each other. Then, there occurs the formation of the (N×N)-DAS structures (N = 5, 7, 9, or 11), among which the (7×7)-DAS structure finally dominates over others.

  19. Pre-stack Reverse-Time Migration Method for Imaging Subsurface Structures of the Himalaya-Tibet Collision Zone

    NASA Astrophysics Data System (ADS)

    Zhu, W.; Ge, Z.; Huang, Q.

    2015-12-01

    We use pre-stack reverse-time migration (RTM) of converted waves to image crust and mantle structures of the Himalaya-Tibet collision zone. Multi-component seismic data are back propagated using FDTD method of elastic wave. P and SV components are separated through the divergence and curl of the reconstructed wave-field. Cross-correlation imaging condition is applied between the back propagated P and SV wave-fields to reconstruct the location of the points where conversion (e.g., P-to-S or S-to-P) occurred. Unlike traditional CCP receiver function stacking, this method does not rely on 1-D assumptions about the geometry of structures, so that it is able to cope with dipping interface, steep faults. Then we applied this method on data of the southern segment of Hi-CLIMB. The chosen seismic array consists of 76 stations and it is 260-kilometer-long extending northward from the Ganges Basin and across the Himalayas. By pre-stack RTM, we have constructed an image of the crust and upper mantle beneath the Himalayas. The image reveals that the Moho dip from a normal depth of 45 km at distance of 120 km ~ 190 km to a much deeper depth of 65 km at 200 km ~ 270 km under southern Tibet. There are also some weak signal in the crust with the same trend of Moho at this region. This may also be related to the underthrusting of Indian plate beneath Tibet. This result of pre-stack RTM consists with previous results obtained by receiver function, but has a steeper change of the depth of Moho.

  20. Inverse scattering pre-stack depth imaging and it's comparison to some depth migration methods for imaging rich fault complex structure

    NASA Astrophysics Data System (ADS)

    Nurhandoko, Bagus Endar B.; Sukmana, Indriani; Mubarok, Syahrul; Deny, Agus; Widowati, Sri; Kurniadi, Rizal

    2012-06-01

    Migration is important issue for seismic imaging in complex structure. In this decade, depth imaging becomes important tools for producing accurate image in depth imaging instead of time domain imaging. The challenge of depth migration method, however, is in revealing the complex structure of subsurface. There are many methods of depth migration with their advantages and weaknesses. In this paper, we show our propose method of pre-stack depth migration based on time domain inverse scattering wave equation. Hopefully this method can be as solution for imaging complex structure in Indonesia, especially in rich thrusting fault zones. In this research, we develop a recent advance wave equation migration based on time domain inverse scattering wave which use more natural wave propagation using scattering wave. This wave equation pre-stack depth migration use time domain inverse scattering wave equation based on Helmholtz equation. To provide true amplitude recovery, an inverse of divergence procedure and recovering transmission loss are considered of pre-stack migration. Benchmarking the propose inverse scattering pre-stack depth migration with the other migration methods are also presented, i.e.: wave equation pre-stack depth migration, waveequation depth migration, and pre-stack time migration method. This inverse scattering pre-stack depth migration could image successfully the rich fault zone which consist extremely dip and resulting superior quality of seismic image. The image quality of inverse scattering migration is much better than the others migration methods.

  1. Microscopically-Tuned Band Structure of Epitaxial Graphene through Interface and Stacking Variations Using Si Substrate Microfabrication

    PubMed Central

    Fukidome, Hirokazu; Ide, Takayuki; Kawai, Yusuke; Shinohara, Toshihiro; Nagamura, Naoka; Horiba, Koji; Kotsugi, Masato; Ohkochi, Takuo; Kinoshita, Toyohiko; Kumighashira, Hiroshi; Oshima, Masaharu; Suemitsu, Maki

    2014-01-01

    Graphene exhibits unusual electronic properties, caused by a linear band structure near the Dirac point. This band structure is determined by the stacking sequence in graphene multilayers. Here we present a novel method of microscopically controlling the band structure. This is achieved by epitaxy of graphene on 3C-SiC(111) and 3C-SiC(100) thin films grown on a 3D microfabricated Si(100) substrate (3D-GOS (graphene on silicon)) by anisotropic etching, which produces Si(111) microfacets as well as major Si(100) microterraces. We show that tuning of the interface between the graphene and the 3C-SiC microfacets enables microscopic control of stacking and ultimately of the band structure of 3D-GOS, which is typified by the selective emergence of semiconducting and metallic behaviours on the (111) and (100) portions, respectively. The use of 3D-GOS is thus effective in microscopically unlocking various potentials of graphene depending on the application target, such as electronic or photonic devices. PMID:24903119

  2. Structural characterization of cup-stacked-type nanofibers with an entirely hollow core

    NASA Astrophysics Data System (ADS)

    Endo, M.; Kim, Y. A.; Hayashi, T.; Fukai, Y.; Oshida, K.; Terrones, M.; Yanagisawa, T.; Higaki, S.; Dresselhaus, M. S.

    2002-02-01

    Straight long carbon nanofibers with a large hollow core obtained by a floating reactant method show a stacking morphology of truncated conical graphene layers, which in turn exhibit a large portion of open edges on the outer surface and also in the inner channels. Through a judicious choice of oxidation conditions, nanofibers with increased active edge sites are obtained without disrupting the fiber's morphology. A graphitization process induces a morphological change from a tubular type to a reversing saw-toothed type and the formation of loops along the inner channel of the nanofibers, accompanied by a decrease in interlayer spacing.

  3. AB stacked few layer graphene growth by chemical vapor deposition on single crystal Rh(1 1 1) and electronic structure characterization

    NASA Astrophysics Data System (ADS)

    Kordatos, Apostolis; Kelaidis, Nikolaos; Giamini, Sigiava Aminalragia; Marquez-Velasco, Jose; Xenogiannopoulou, Evangelia; Tsipas, Polychronis; Kordas, George; Dimoulas, Athanasios

    2016-04-01

    Graphene synthesis on single crystal Rh(1 1 1) catalytic substrates is performed by Chemical Vapor Deposition (CVD) at 1000 °C and atmospheric pressure. Raman analysis shows full substrate coverage with few layer graphene. It is found that the cool-down rate strongly affects the graphene stacking order. When lowered, the percentage of AB (Bernal) -stacked regions increases, leading to an almost full AB stacking order. When increased, the percentage of AB-stacked graphene regions decreases to a point where almost a full non AB-stacked graphene is grown. For a slow cool-down rate, graphene with AB stacking order and good epitaxial orientation with the substrate is achieved. This is indicated mainly by Raman characterization and confirmed by Reflection high-energy electron diffraction (RHEED) imaging. Additional Scanning Tunneling Microscopy (STM) topography data confirm that the grown graphene is mainly an AB-stacked structure. The electronic structure of the graphene/Rh(1 1 1) system is examined by Angle resolved Photo-Emission Spectroscopy (ARPES), where σ and π bands of graphene, are observed. Graphene's ΓK direction is aligned with the ΓK direction of the substrate, indicating no significant contribution from rotated domains.

  4. Intermolecular base stacking mediates RNA-RNA interaction in a crystal structure of the RNA chaperone Hfq.

    PubMed

    Schulz, Eike C; Seiler, Markus; Zuliani, Cecilia; Voigt, Franka; Rybin, Vladimir; Pogenberg, Vivian; Mücke, Norbert; Wilmanns, Matthias; Gibson, Toby J; Barabas, Orsolya

    2017-08-29

    The RNA-chaperone Hfq catalyses the annealing of bacterial small RNAs (sRNAs) with target mRNAs to regulate gene expression in response to environmental stimuli. Hfq acts on a diverse set of sRNA-mRNA pairs using a variety of different molecular mechanisms. Here, we present an unusual crystal structure showing two Hfq-RNA complexes interacting via their bound RNA molecules. The structure contains two Hfq6:A18 RNA assemblies positioned face-to-face, with the RNA molecules turned towards each other and connected via interdigitating base stacking interactions at the center. Biochemical data further confirm the observed interaction, and indicate that RNA-mediated contacts occur between Hfq-RNA complexes with various (ARN)X motif containing RNA sequences in vitro, including the stress response regulator OxyS and its target, fhlA. A systematic computational survey also shows that phylogenetically conserved (ARN)X motifs are present in a subset of sRNAs, some of which share similar modular architectures. We hypothesise that Hfq can co-opt RNA-RNA base stacking, an unanticipated structural trick, to promote the interaction of (ARN)X motif containing sRNAs with target mRNAs on a "speed-dating" fashion, thereby supporting their regulatory function.

  5. Building Extraction Based on an Optimized Stacked Sparse Autoencoder of Structure and Training Samples Using LIDAR DSM and Optical Images.

    PubMed

    Yan, Yiming; Tan, Zhichao; Su, Nan; Zhao, Chunhui

    2017-08-24

    In this paper, a building extraction method is proposed based on a stacked sparse autoencoder with an optimized structure and training samples. Building extraction plays an important role in urban construction and planning. However, some negative effects will reduce the accuracy of extraction, such as exceeding resolution, bad correction and terrain influence. Data collected by multiple sensors, as light detection and ranging (LIDAR), optical sensor etc., are used to improve the extraction. Using digital surface model (DSM) obtained from LIDAR data and optical images, traditional method can improve the extraction effect to a certain extent, but there are some defects in feature extraction. Since stacked sparse autoencoder (SSAE) neural network can learn the essential characteristics of the data in depth, SSAE was employed to extract buildings from the combined DSM data and optical image. A better setting strategy of SSAE network structure is given, and an idea of setting the number and proportion of training samples for better training of SSAE was presented. The optical data and DSM were combined as input of the optimized SSAE, and after training by an optimized samples, the appropriate network structure can extract buildings with great accuracy and has good robustness.

  6. Atomic structure characterization of stacking faults on the { 1 1 ¯00 } plane in α-alumina by scanning transmission electron microscopy

    NASA Astrophysics Data System (ADS)

    Tochigi, Eita; Findlay, Scott D.; Okunishi, Eiji; Mizoguchi, Teruyasu; Nakamura, Atsutomo; Shibata, Naoya; Ikuhara, Yuichi

    2016-08-01

    The structure of a b =<1 1 ¯00 > dislocation formed in the { 1 1 ¯00 } /<112 ¯0> 2° low-angle grain boundary of alumina was observed by scanning transmission electron microscopy (STEM). It was found that the <1 1 ¯00 > dislocation dissociate-s into 1/3<1 1 ¯00 > partial-dislocation triplets with two stacking faults on the { 1 1 ¯00 } plane. The atomic structure of the { 1 1 ¯00 } stacking faults was characterized by annular bright field STEM (ABF-STEM). The two stacking faults were found to have a stacking sequence of …ABCCABC… and …ABCBCAB…, wh-ich is consistent with a former report. ABF-STEM image simulation was performed using structure models with the { 1 1 ¯00 } stacking faults optimized by first-principles calculations. The overall features of the experimental and the simulated results agree with each other. However, slight differences in contrast were recognized in the vicinity of the stacking faults, suggesting that there are small differences between the observed structures and the theoretical models.

  7. {l_angle}110{r_angle} symmetric tilt grain-boundary structures in fcc metals with low stacking-fault energies

    SciTech Connect

    Rittner, J.D.; Seidman, D.N.

    1996-09-01

    Twenty-one {l_angle}110{r_angle} symmetric tilt grain boundaries (GB{close_quote}s) are investigated with atomistic simulations, using an embedded-atom method (EAM) potential for a low stacking-fault energy fcc metal. Lattice statics simulations with a large number of initial configurations are used to identify both the equilibrium and metastable structures at 0 K. The level of difficulty in finding the equilibrium structures is quantitatively assessed. The stability of the structures at an elevated temperature is investigated by Monte Carlo annealing. A form of GB dissociation is identified in a number of the boundaries. These structures are used to develop a dislocation model of GB dissociation by stacking-fault emission. Also, an attempt is made to apply the structural unit model (SUM) to the simulated boundaries and problems that are encountered for GB structures in low stacking-fault energy metals are enumerated and discussed. {copyright} {ital 1996 The American Physical Society.}

  8. Al and Ge simultaneous oxidation using neutral beam post-oxidation for formation of gate stack structures

    SciTech Connect

    Ohno, Takeo; Nakayama, Daiki; Samukawa, Seiji

    2015-09-28

    To obtain a high-quality Germanium (Ge) metal–oxide–semiconductor structure, a Ge gate stacked structure was fabricated using neutral beam post-oxidation. After deposition of a 1-nm-thick Al metal film on a Ge substrate, simultaneous oxidation of Al and Ge was carried out at 300 °C, and a Ge oxide film with 29% GeO{sub 2} content was obtained by controlling the acceleration bias power of the neutral oxygen beam. In addition, the fabricated AlO{sub x}/GeO{sub x}/Ge structure achieved a low interface state density of less than 1 × 10{sup 11 }cm{sup −2 }eV{sup −1} near the midgap.

  9. Designing π-stacked molecular structures to control heat transport through molecular junctions

    SciTech Connect

    Kiršanskas, Gediminas; Li, Qian; Solomon, Gemma C.; Flensberg, Karsten; Leijnse, Martin

    2014-12-08

    We propose and analyze a way of using π stacking to design molecular junctions that either enhance or suppress a phononic heat current, but at the same time remain conductors for an electric current. Such functionality is highly desirable in thermoelectric energy converters, as well as in other electronic components where heat dissipation should be minimized or maximized. We suggest a molecular design consisting of two masses coupled to each other with one mass coupled to each lead. By having a small coupling (spring constant) between the masses, it is possible to either reduce or perhaps more surprisingly enhance the phonon conductance. We investigate a simple model system to identify optimal parameter regimes and then use first principle calculations to extract model parameters for a number of specific molecular realizations, confirming that our proposal can indeed be realized using standard molecular building blocks.

  10. Choice of Design Variables in the Stacking Sequence Optimization for Laminated Structures

    NASA Astrophysics Data System (ADS)

    Muc, A.

    2016-05-01

    A special type of new, continuous design variables is introduced in order to find optimum solutions for discrete fiber orientations. In the buckling analysis, as two or three different fiber orientations are considered, optimum solutions can be found in an analytical way. For a greater number of discrete fiber orientations, a special optimization algorithm based on the evolution strategy is used to solve the combinatorial optimization problems dealing with the optimum design of the laminate stacking sequence. The analysis is conducted with the example of simply supported rectangular multilayered composite plates subjected to buckling and the first-ply-failure constraints. The results demonstrate the effectiveness, simplicity, and advantages of the use of continuous design variables in the discrete optimization problem.

  11. Structural dynamics of a methionine γ-lyase for calicheamicin biosynthesis: Rotation of the conserved tyrosine stacking with pyridoxal phosphate.

    PubMed

    Cao, Hongnan; Tan, Kemin; Wang, Fengbin; Bigelow, Lance; Yennamalli, Ragothaman M; Jedrzejczak, Robert; Babnigg, Gyorgy; Bingman, Craig A; Joachimiak, Andrzej; Kharel, Madan K; Singh, Shanteri; Thorson, Jon S; Phillips, George N

    2016-05-01

    CalE6 from Micromonospora echinospora is a (pyridoxal 5' phosphate) PLP-dependent methionine γ-lyase involved in the biosynthesis of calicheamicins. We report the crystal structure of a CalE6 2-(N-morpholino)ethanesulfonic acid complex showing ligand-induced rotation of Tyr100, which stacks with PLP, resembling the corresponding tyrosine rotation of true catalytic intermediates of CalE6 homologs. Elastic network modeling and crystallographic ensemble refinement reveal mobility of the N-terminal loop, which involves both tetrameric assembly and PLP binding. Modeling and comparative structural analysis of PLP-dependent enzymes involved in Cys/Met metabolism shine light on the functional implications of the intrinsic dynamic properties of CalE6 in catalysis and holoenzyme maturation.

  12. Potential-induced degradation in solar cells: Electronic structure and diffusion mechanism of sodium in stacking faults of silicon

    SciTech Connect

    Ziebarth, Benedikt Gumbsch, Peter; Mrovec, Matous; Elsässer, Christian

    2014-09-07

    Sodium decorated stacking faults (SFs) were recently identified as the primary cause of potential-induced degradation in silicon (Si) solar-cells due to local electrical short-circuiting of the p-n junctions. In the present study, we investigate these defects by first principles calculations based on density functional theory in order to elucidate their structural, thermodynamic, and electronic properties. Our calculations show that the presence of sodium (Na) atoms leads to a substantial elongation of the Si-Si bonds across the SF, and the coverage and continuity of the Na layer strongly affect the diffusion behavior of Na within the SF. An analysis of the electronic structure reveals that the presence of Na in the SF gives rise to partially occupied defect levels within the Si band gap that participate in electrical conduction along the SF.

  13. Structural dynamics of a methionine γ-lyase for calicheamicin biosynthesis: Rotation of the conserved tyrosine stacking with pyridoxal phosphate

    PubMed Central

    Cao, Hongnan; Tan, Kemin; Wang, Fengbin; Bigelow, Lance; Yennamalli, Ragothaman M.; Jedrzejczak, Robert; Babnigg, Gyorgy; Bingman, Craig A.; Joachimiak, Andrzej; Kharel, Madan K.; Singh, Shanteri; Thorson, Jon S.; Phillips, George N.

    2016-01-01

    CalE6 from Micromonospora echinospora is a (pyridoxal 5′ phosphate) PLP-dependent methionine γ-lyase involved in the biosynthesis of calicheamicins. We report the crystal structure of a CalE6 2-(N-morpholino)ethanesulfonic acid complex showing ligand-induced rotation of Tyr100, which stacks with PLP, resembling the corresponding tyrosine rotation of true catalytic intermediates of CalE6 homologs. Elastic network modeling and crystallographic ensemble refinement reveal mobility of the N-terminal loop, which involves both tetrameric assembly and PLP binding. Modeling and comparative structural analysis of PLP-dependent enzymes involved in Cys/Met metabolism shine light on the functional implications of the intrinsic dynamic properties of CalE6 in catalysis and holoenzyme maturation. PMID:27191010

  14. Gaussian beam incident on the one-dimensional diffraction gratings with the high-K metal gate stack structures.

    PubMed

    Kuo, Hung-Fei; Frederick

    2014-04-01

    Optical scatterometry has attracted extensive interest in extracting the geometric shape information of nanolithography patterns because of the trend of shrinking device size and complicated stack structure. RCWA is the numerical algorithm implemented in the current scatterometry tool to calculate the diffraction efficiency. However, the known weakness for the RCWA method is the analysis of metallic gratings illuminated by the TM wave. This research applies the FDTD method using the Gaussian beam excitation source to analyze the diffraction efficiency of HKMG gratings for the use in the optical scatterometry and verifies the numerical diffraction efficiency discrepancy between the Gaussian beam and plane wave excitation methods. The numerical study is carried out with the line/space nanolithography patterns on the HKMG process stacks at 45 nm node technology. The nanolithography patterns are modeled as 1-D surface relief gratings. The 0th order diffraction efficiency is analyzed as a function of CDs, SWAs, incident angles and pitches of the gratings. The study presents the impact of the polarizations of the incident waves on the diffraction efficiency. In addition, this research investigates the phase of the 0th diffraction order as a function of the SWAs and illustrates the corresponding SWA parameter effect on the phase distribution. This research suggests the minimum beam radius to converge the numerical diffraction efficiency using Gaussian beam excitation to it using the plan wave.

  15. Analysis of Tropical Forest Structure Dynamics Using Medium-footprint Lidar and Landsat Time Series Stacks

    NASA Astrophysics Data System (ADS)

    Tang, H.; Huang, C.; Dubayah, R.

    2011-12-01

    Forest often recovers after a disturbance event until it reaches an equilibrium stage. This process can be observed through examining several geophysical parameters (e.g. biomass, canopy height and LAI). Quantifying these parameters at fine scale is important for understanding carbon stocks and fluxes. The La Selva Biological Station in Costa Rica is a good example for studying secondary forest regrowth from disturbance. Since Lidar can provide the most accurate estimate of biomass compared to other remote sensing methods and Landsat has produced the longest imagery record of forest, we will explore the dynamics of tropical forest with both medium footprint lidar and landsat images. LVIS, a medium footprint airborne scanning lidar, has surveyed this area in March of 1998 and 2005. A highly automated algorithm, vegetation change tracker (VCT) has been developed for reconstructing recent forest disturbance history starting from 1984 using Landsat time series stacks (LTSS).Need to discuss what you will do, what are the expected results and their significances. We will try to establish empirical relationship between Lidar and landsat images to analysis tropical forest dynamics from 1984 to 2005.

  16. Characterization of Damage of Al2O3/Ge Gate Stack Structure Induced with Light Radiation during Plasma Nitridation

    NASA Astrophysics Data System (ADS)

    Kusumandari; Takeuchi, Wakana; Kato, Kimihiko; Shibayama, Shigehisa; Sakashita, Mitsuo; Nakatsuka, Osamu; Zaima, Shigeaki

    2012-01-01

    We have investigated the effects of light radiation during plasma nitridation on the electrical properties of an Al2O3/Ge gate stack structure using the pallet for plasma evaluation (PAPE) technique. From the capacitance-voltage characteristics, the flatband voltage shift due to fixed oxide charges significantly increases after light exposure with an energy higher than 7.5 eV. In addition, the density of trapped charges near the interface and the interface state density (Dit) also significantly increase after light exposure with an energy over 11.3 eV. The net density of positive fixed oxide charges, the density of trapped charges near the interface, and Dit can be reduced by post-metallization annealing (PMA) in N2 ambient at 300 °C.

  17. Effects of sub-domain structure on initial magnetization curve and domain size distribution of stacked media

    NASA Astrophysics Data System (ADS)

    Sato, S.; Kumagai, S.; Sugita, R.

    2015-03-01

    In this paper, in order to confirm the sub-domain structure in stacked media demagnetized with in-plane field, initial magnetization curves and magnetic domain size distribution were investigated. Both experimental and simulation results showed that an initial magnetization curve for the medium demagnetized with in-plane field (MDI) initially rose faster than that for the medium demagnetized with perpendicular field (MDP). It is inferred that this is because the MDI has a larger number of domain walls than the MDP due to the existence of the sub-domains, resulting in an increase in the probability of domain wall motion. Dispersion of domain size for the MDI was larger than that for the MDP. This is because sub-domains are formed not only inside the domain but also at the domain boundary region, and they change the position of the domain boundary to affect the domain size.

  18. Tunnel magnetoresistance properties and annealing stability in perpendicular anisotropy MgO-based magnetic tunnel junctions with different stack structures

    NASA Astrophysics Data System (ADS)

    Mizunuma, K.; Ikeda, S.; Sato, H.; Yamanouchi, M.; Gan, H. D.; Miura, K.; Yamamoto, H.; Hayakawa, J.; Matsukura, F.; Ohno, H.

    2011-04-01

    We have investigated the effect of stack structures on tunnel magnetoresistance (TMR) properties in perpendicular anisotropy MgO-based magnetic tunnel junctions (p-MTJs) with CoFe/Pd multilayer and CoFeB insertion. By adopting Ta and Ru cap-layers, the TMR ratios of 113 and 106% are obtained at annealing temperature (Ta) of 325 °C, respectively. Particularly, the Ru cap-layer is effective in realizing a TMR ratio of 100% at Ta = 350 °C. By replacing (Co25Fe75)80B20 with (Co25Fe75)85B15, the TMR ratio increased quickly at low Ta, reaching a maximum of 120% at Ta = 300 °C.

  19. Preparation and Characterization of [pi]-Stacking Quinodimethane Oligothiophenes. Predicting Semiconductor Behavior and Bandwidths from Crystal Structures and Molecular Orbital Calculations

    SciTech Connect

    Janzen, Daron E.; Burand, Michael W.; Ewbank, Paul C.; Pappenfus, Ted M.; Higuchi, Hiroyuki; da Silva, Demetrio A.; Young, Victor G.; Bredas, Jean-Luc; Mann, Kent R.

    2010-11-16

    A series of new quinodimethane-substituted terthiophene and quaterthiophene oligomers has been investigated for comparison with a previously studied quinoid oligothiophene that has demonstrated high mobilities and ambipolar transport behavior in thin-film transistor devices. Each new quinoidal thiophene derivative shows a reversible one-electron oxidation between 0.85 and 1.32 V, a quasi-reversible one-electron second oxidation between 1.37 and 1.96 V, and a reversible two-electron reduction between -0.05 and -0.23 V. The solution UV-vis-NIR spectrum of each compound is dominated by an intense epsilon congruent with 100,000 M{sup -1} cm{sup -1} low energy pi-pi transition that has a lambda(max) ranging between 648 and 790 nm. All X-ray crystal structures exhibit very planar quinoidal backbones and short intermolecular pi-stacking distances (3.335-3.492 A). Structures exhibit a single pi-stacking distance with parallel cofacial stacking (sulfur atoms of equivalent rings pointed in the same direction) or with alternating distances and antiparallel cofacial stacking (sulfur atoms of equivalent rings pointed in the opposite direction). Examples of the layered and herringbone-packing motifs are observed for both the parallel and the antiparallel cofacial stacking. Analysis of the X-ray structures and molecular orbital calculations indicates that all of these compounds have one-dimensional electronic band structures as a result of the pi-stacking. For structures with a unique pi-stacking distance, a simple geometric overlap parameter calculated from the shape of the molecule and the slip from perfect registry in the pi-stack correlates well with the transfer integrals (t) calculated using molecular orbital theory. The calculated valence (633 meV) and conduction (834 meV) bandwidths for a quinoid quaterthiophene structure are similar to those calculated for the benchmark pentacene and indicate that both hole and electron mobilities could be significant.

  20. Zigzag stacks and m-regular linear stacks.

    PubMed

    Chen, William Y C; Guo, Qiang-Hui; Sun, Lisa H; Wang, Jian

    2014-12-01

    The contact map of a protein fold is a graph that represents the patterns of contacts in the fold. It is known that the contact map can be decomposed into stacks and queues. RNA secondary structures are special stacks in which the degree of each vertex is at most one and each arc has length of at least two. Waterman and Smith derived a formula for the number of RNA secondary structures of length n with exactly k arcs. Höner zu Siederdissen et al. developed a folding algorithm for extended RNA secondary structures in which each vertex has maximum degree two. An equation for the generating function of extended RNA secondary structures was obtained by Müller and Nebel by using a context-free grammar approach, which leads to an asymptotic formula. In this article, we consider m-regular linear stacks, where each arc has length at least m and the degree of each vertex is bounded by two. Extended RNA secondary structures are exactly 2-regular linear stacks. For any m ≥ 2, we obtain an equation for the generating function of the m-regular linear stacks. For given m, we deduce a recurrence relation and an asymptotic formula for the number of m-regular linear stacks on n vertices. To establish the equation, we use the reduction operation of Chen, Deng, and Du to transform an m-regular linear stack to an m-reduced zigzag (or alternating) stack. Then we find an equation for m-reduced zigzag stacks leading to an equation for m-regular linear stacks.

  1. Impact of Thermomechanical Stresses on Bumpless Chip in Stacked Wafer Structure

    NASA Astrophysics Data System (ADS)

    Mizushima, Yoriko; Kitada, Hideki; Uchibori, Chihiro J.; Maeda, Nobuhide; Kodama, Shoichi; Kim, Youngsuk; Fujimoto, Koji; Yoshimi, Seiichi; Nakamura, Tomoji; Ohba, Takayuki

    2013-05-01

    Crack formation due to thermomechanical stresses generated by a dielectric polymer thicker than 20 µm and by that with high modulus during the bumpless chip-on-wafer (COW) process has been investigated. According to the stress simulation, thermal stresses increase with polymer thickness where the stress value ranges from 100 to 200 MPa for benzocyclobutene (BCB)-based resin. Thermal stresses in the hybrid structure using epoxy-based resin and BCB-based resin were calculated to be less than 100 MPa. Thus, the reduction of the thicknesses of the polymer as well as the Si chip was found to be effective in avoiding crack formation in the COW structure. Moreover, to investigate the crack driving force, the energy release rate (ERR) was calculated. The crack propagates toward the Si chip corner and the result is consistent with the experiment. On the COW structure, a thin Si chip and a low-modulus polymer expand the process window.

  2. Energetic N-Nitramino/N-Oxyl-Functionalized Pyrazoles with Versatile π-π Stacking: Structure-Property Relationships of High-Performance Energetic Materials.

    PubMed

    Yin, Ping; Mitchell, Lauren A; Parrish, Damon A; Shreeve, Jean'ne M

    2016-11-07

    N-Nitramino/N-oxyl functionalization strategies were employed to investigate structure-property relationships of energetic materials. Based on single-crystal diffraction data, π-π stacking of pyrazole backbones can be tailored effectively by energetic functionalities, thereby resulting in diversified energetic compounds. Among them, hydroxylammonium 4-amino-3,5-dinitro-1H-pyrazol-1-olate and dipotassium N,N'-(3,5-dinitro-1H-pyrazol-1,4-diyl)dinitramidate, with unique face-to-face π-π stacking, can be potentially used as a high-performance explosive and an energetic oxidizer, respectively.

  3. A low-temperature fabricated gate-stack structure for Ge-based MOSFET with ferromagnetic epitaxial Heusler-alloy/Ge electrodes

    NASA Astrophysics Data System (ADS)

    Fujita, Yuichi; Yamada, Michihiro; Nagatomi, Yuta; Yamamoto, Keisuke; Yamada, Shinya; Sawano, Kentarou; Kanashima, Takeshi; Nakashima, Hiroshi; Hamaya, Kohei

    2016-06-01

    A possible low-temperature fabrication process of a gate-stack for Ge-based spin metal-oxide-semiconductor field-effect transistor (MOSFET) is investigated. First, since we use epitaxial ferromagnetic Heusler alloys on top of the phosphorous doped Ge epilayer as spin injector and detector, we need a dry etching process to form Heusler-alloy/n+-Ge Schottky-tunnel contacts. Next, to remove the Ge epilayers damaged by the dry etching process, the fabricated structures are dipped in a 0.03% diluted H2O2 solution. Finally, Al/SiO2/GeO2/Ge gate-stack structures are fabricated at 300 °C as a top gate-stack structure. As a result, the currents in the Ge-MOSFET fabricated here can be modulated by applying gate voltages even by using the low-temperature formed gate-stack structures. This low-temperature fabrication process can be utilized for operating Ge spin MOSFETs with a top gate electrode.

  4. In situ photocurrent spectra measurements during growth of three-dye-stacked structures by the liquid-phase molecular layer deposition

    NASA Astrophysics Data System (ADS)

    Yoshimura, Tetsuzo; Bai, Shi; Tateno, Hiroyuki; Yoshino, Chie

    2017-07-01

    Three-dye-stacked structures were grown on ZnO surfaces by the liquid-phase molecular layer deposition (LP-MLD) using electron-accepting p-type dyes of rose bengal (RB) and eosine (EO), and an electron-donating n-type dye of crystal violet (CV) as source molecules. It was found that the dye adsorption strength is strong for combinations of p-n, and weak for combinations of p-p and n-n, which satisfies requirements for the source molecules in LP-MLD when dyes are provided with a sequence of p-n-p-n- on n-type ZnO. Surface potential and photoluminescence measurements revealed that monomolecular-step growth is achieved in LP-MLD for growth of the three-dye-stacked structure of [ZnO/RB/CV/EO]. To evaluate the sensitization effects of multi-dye-stacked structures, photocurrent spectra induced in the dye-sensitized ZnO layers were measured in situ in each growth step of the dye molecule adsorption. In step 1, p-type RB was adsorbed onto an n-type ZnO surface to induce a photocurrent spectrum in a range of 400-580 nm. In step 2, n-type CV was provided to connect it to p-type RB. Then, photocurrents attributed to CV were superposed to the photocurrent spectrum attributed to RB, raising photocurrents in the longer wavelength region. In step 3, p-type EO was provided to grow the three-dye-stacked structure of [ZnO/RB/CV/EO]. This structure enhanced the photocurrents and, at the same time, widened the photocurrent spectrum extending from 390 nm to 610 nm, which is regarded as a superposition of RB, CV, and EO spectra, suggesting that the multi-dye-stacked structure acts as a light-harvesting antenna to enhance the sensitization effect on ZnO.

  5. Low-temperature-dependent property in an avalanche photodiode based on GaN/AlN periodically-stacked structure

    NASA Astrophysics Data System (ADS)

    Zheng, Jiyuan; Wang, Lai; Yang, Di; Yu, Jiadong; Meng, Xiao; Hao, Zhibiao; Sun, Changzheng; Xiong, Bing; Luo, Yi; Han, Yanjun; Wang, Jian; Li, Hongtao; Li, Mo; Li, Qian

    2016-10-01

    In ultra-high sensitive APDs, a vibrate of temperature might bring a fatal decline of the multiplication performance. Conventional method to realize a temperature-stable APD focuses on the optimization of device structure, which has limited effects. While in this paper, a solution by reducing the carrier scattering rate based on an GaN/AlN periodically-stacked structure (PSS) APD is brought out to improve temperature stability essentially. Transport property is systematically investigated. Compared with conventional GaN homojunction (HJ) APDs, electron suffers much less phonon scatterings before it achieves ionization threshold energy and more electrons occupy high energy states in PSS APD. The temperature dependence of ionization coefficient and energy distribution is greatly reduced. As a result, temperature stability on gain is significantly improved when the ionization happens with high efficiency. The change of gain for GaN (10 nm)/AlN (10 nm) PSS APD from 300 K to 310 K is about 20% lower than that for HJ APD. Additionally, thicker period length is found favorable to ionization coefficient ratio but a bit harmful to temperature stability, while increasing the proportion of AlN at each period in a specific range is found favorable to both ionization coefficient ratio and temperature stability.

  6. Unveiling One-Dimensional Supramolecular Structures Formed Through π-π Stacking of Phenothiazines by Differential Pulse Voltammetry.

    PubMed

    Carvalho, Fernando R; Zampieri, Eduardo H; Caetano, Wilker; Silva, Rafael

    2017-03-09

    Organic based nanomaterials can be self-assembled by strong and directional intermolecular forces as π-π interactions are. Experimental information about the stability, size and geometry of those formed structures are very limited for species which easily aggregates even at very low concentration. Differential pulse voltammetry can unveil the formation, growth and also the stability window of ordered one-dimensional, lamellar, self-aggregates formed by supramolecular π stacking of phenothiazines at micromolar (10-6 mol·L-1) concentration. The self-diffusion features of the species at different concentration were determined by DPV and used to probe the π staking process through the concept of the frictional resistance. It is observed that toluidine blue and methylene blue start to self-aggregate around 9 µmol·L-1 and the self-aggregation process occurs by one-dimensional growth as the concentration of the phenothiazines is increased up to around 170 µmol·L-1 for toluidine blue O and 200 µmol·L-1 for methylene blue. At higher concentration the aggregation process leads to structures with lower anisometry.

  7. Mg-Zn-Y alloys with long-period stacking ordered structure: in vitro assessments of biodegradation behavior.

    PubMed

    Zhao, Xu; Shi, Ling-ling; Xu, Jian

    2013-10-01

    Using Dulbecco's modified eagle medium (DMEM) with 10% fetal bovine serum (FBS) as simulated body fluid, degradation behavior of Mg100-3x(Zn1Y2)x (1≤x≤3) alloy series with long period stacking order (LPSO) structures was investigated. As indicated, with increasing the volume fraction of LPSO phase, degradation rate of the alloys is accelerated. Further refining the grain size by microalloying with zirconium and warm extrusion has a significant effect to mitigate the degradation rate of the Mg97Zn1Y2 alloy. Time-dependent behavior during degradation of the magnesium alloys can be described using an exponential decay function of WR=exp(a+bt+ct(2)), where WR is normalized residual mass/volume of the alloy. A parameter named as degradation half-life period (t0.5) is suggested to quantitatively assess the degradation rate. For the localized-corrosion controlled alloys, the t0.5 parameter physically scales with electrochemical response ΔE which is a range between corrosion potential (Ecorr) and pitting potential (Ept). In comparison with conventional engineering magnesium alloys such as the AZ31, WE43, ZK60 and ZX60 alloys, extruded Mg96.83Zn1Y2Zr0.17 alloy with LPSO structure exhibits a good combination of high mechanical strength, lower biodegradation rate and good biocompatibility.

  8. Low-temperature-dependent property in an avalanche photodiode based on GaN/AlN periodically-stacked structure

    PubMed Central

    Zheng, Jiyuan; Wang, Lai; Yang, Di; Yu, Jiadong; Meng, Xiao; Hao, Zhibiao; Sun, Changzheng; Xiong, Bing; Luo, Yi; Han, Yanjun; Wang, Jian; Li, Hongtao; Li, Mo; Li, Qian

    2016-01-01

    In ultra-high sensitive APDs, a vibrate of temperature might bring a fatal decline of the multiplication performance. Conventional method to realize a temperature-stable APD focuses on the optimization of device structure, which has limited effects. While in this paper, a solution by reducing the carrier scattering rate based on an GaN/AlN periodically-stacked structure (PSS) APD is brought out to improve temperature stability essentially. Transport property is systematically investigated. Compared with conventional GaN homojunction (HJ) APDs, electron suffers much less phonon scatterings before it achieves ionization threshold energy and more electrons occupy high energy states in PSS APD. The temperature dependence of ionization coefficient and energy distribution is greatly reduced. As a result, temperature stability on gain is significantly improved when the ionization happens with high efficiency. The change of gain for GaN (10 nm)/AlN (10 nm) PSS APD from 300 K to 310 K is about 20% lower than that for HJ APD. Additionally, thicker period length is found favorable to ionization coefficient ratio but a bit harmful to temperature stability, while increasing the proportion of AlN at each period in a specific range is found favorable to both ionization coefficient ratio and temperature stability. PMID:27775088

  9. Evidence for structural stacking and repetition in the greenstones of the Kalgoorlie district, western Australia

    NASA Technical Reports Server (NTRS)

    Martyn, J. E.

    1986-01-01

    Most previous stratigraphic interpretations of the southern part of the Norseman-Wiluna Greenstone Belt have proposed polycyclic sequences. These invoked two and sometimes three successive suites of mafic and/or ultimafic volcanics and intrusives separated by felsic volcanics and immature clastic sediments, however no distinctive lithological differences were reported between successive mafic-ultramaic sequences. When interpretations of the area further to the north are integrated, a total of four separate major mafic-ultramafic uites emerges for a large part of the Norseman-Wiluna Belt. Although the author does not intent to imply that all polycyclic stratigraphies are wrong in principle such a situation seems suspiciously over-complex and stimulates the need to look critically at the individual areas where the stratigraphies have seen erected. For the Kalgoorlie area in the south, some of the schemes have already provoked scepticism and a simpler model consisting of one cycle subject to structural repetition has been evolved by workers in the Geological Survey of Western Australia for part of this area. The latter drew attention to the carbon copy similarity between the elements of some polycyclic stratigraphies. Much more regionally extensive integrated structural and stratigraphic data is still required to evaluate the relationship between structure and stratigraphy more fully, an objective substantially limited by poor outcrop and deep weathering, but with due effort, far from unattainable.

  10. Two-bit memory and quantized storage phenomenon in conventional MOS structures with double-stacked Pt-NCs in an HfAlO matrix.

    PubMed

    Zhou, Guangdong; Wu, Bo; Liu, Xiaoqin; Li, Ping; Zhang, Shuangju; Sun, Bai; Zhou, Ankun

    2016-03-07

    A two-bit memory and quantized storage phenomenon are observed at room temperature for a device based on the traditional MOS structure with double-stacked Pt-nanocrystals (Pt-NCs). A 2.68 and 1.72 V flat band voltage shift (memory window) has been obtained when applying a ±7 V programming/erasing voltage to the structures with double-stacked Pt-NCs. The memory windows of 2.40 and 1.44 V can be retained after stress for 10(5) seconds, which correspond to 89.55% and 83.72% stored charges reserved. The quantized charge storage phenomenon characterized by current-voltage (J-V) hysteresis curves was detected at room temperature. The shrinkage of the memory window results from the decreasing tunneling probability, which strongly depends on the number of stacks. The traps, de-traps and quantum confinement effects of Pt-NCs may contribute to the improvement of dielectric characteristics and the two-bit memory behavior. The multi-bit memory and quantized storage behavior observed in the Pt-NCs stacks structure at room temperature might provide a feasible method for realizing the multi-bit storage in non-volatile flash memory devices.

  11. Stacking disorder in ice I.

    PubMed

    Malkin, Tamsin L; Murray, Benjamin J; Salzmann, Christoph G; Molinero, Valeria; Pickering, Steven J; Whale, Thomas F

    2015-01-07

    Traditionally, ice I was considered to exist in two well-defined crystalline forms at ambient pressure: stable hexagonal ice (ice Ih) and metastable cubic ice (ice Ic). However, it is becoming increasingly evident that what has been called cubic ice in the past does not have a structure consistent with the cubic crystal system. Instead, it is a stacking-disordered material containing cubic sequences interlaced with hexagonal sequences, which is termed stacking-disordered ice (ice Isd). In this article, we summarise previous work on ice with stacking disorder including ice that was called cubic ice in the past. We also present new experimental data which shows that ice which crystallises after heterogeneous nucleation in water droplets containing solid inclusions also contains stacking disorder even at freezing temperatures of around -15 °C. This supports the results from molecular simulations, that the structure of ice that crystallises initially from supercooled water is always stacking-disordered and that this metastable ice can transform to the stable hexagonal phase subject to the kinetics of recrystallization. We also show that stacking disorder in ice which forms from water droplets is quantitatively distinct from ice made via other routes. The emerging picture of ice I is that of a very complex material which frequently contains stacking disorder and this stacking disorder can vary in complexity depending on the route of formation and thermal history.

  12. A PMT-like high gain avalanche photodiode based on GaN/AlN periodically stacked structure

    NASA Astrophysics Data System (ADS)

    Zheng, Jiyuan; Wang, Lai; Wu, Xingzhao; Hao, Zhibiao; Sun, Changzheng; Xiong, Bing; Luo, Yi; Han, Yanjun; Wang, Jian; Li, Hongtao; Brault, Julien; Matta, Samuel; Khalfioui, Mohamed Al; Yan, Jianchang; Wei, Tongbo; Zhang, Yun; Wang, Junxi

    2016-12-01

    Avalanche photodiode (APD) has been intensively investigated as a promising candidate to replace the bulky and fragile photomultiplier tube (PMT) for weak light detection. However, the performance of most available APDs is barely satisfactory compared to that of the PMTs because of inter-valley scattering. Here, we demonstrate a PMT-like APD based on GaN/AlN periodically stacked-structure (PSS), in which the electrons encounter a much less inter-valley scattering during transport than holes. Uni-directional avalanche takes place with a high efficiency. According to our simulations based on a PSS with GaN (10 nm)/AlN (10 nm) in each period, the probability for electrons to trigger ionization in each cycle can reach as high as 80%, while that for holes is only 4%. A record high and stable gain (104) with a low ionization coefficient ratio of 0.05 is demonstrated under a constant bias in a prototype device.

  13. Two-bit multi-level phase change random access memory with a triple phase change material stack structure

    NASA Astrophysics Data System (ADS)

    Gyanathan, Ashvini; Yeo, Yee-Chia

    2012-11-01

    This work demonstrates a novel two-bit multi-level device structure comprising three phase change material (PCM) layers, separated by SiN thermal barrier layers. This triple PCM stack consisted of (from bottom to top), Ge2Sb2Te5 (GST), an ultrathin SiN barrier, nitrogen-doped GST, another ultrathin SiN barrier, and Ag0.5In0.5Sb3Te6. The PCM layers can selectively amorphize to form 4 different resistance levels ("00," "01," "10," and "11") using respective voltage pulses. Electrical characterization was extensively performed on these devices. Thermal analysis was also done to understand the physics behind the phase changing characteristics of the two-bit memory devices. The melting and crystallization temperatures of the PCMs play important roles in the power consumption of the multi-level devices. The electrical resistivities and thermal conductivities of the PCMs and the SiN thermal barrier are also crucial factors contributing to the phase changing behaviour of the PCMs in the two-bit multi-level PCRAM device.

  14. Water Replacement Hypothesis in Atomic Detail—Factors Determining the Structure of Dehydrated Bilayer Stacks

    PubMed Central

    Golovina, Elena A.; Golovin, Andrey V.; Hoekstra, Folkert A.; Faller, Roland

    2009-01-01

    Abstract According to the water replacement hypothesis, trehalose stabilizes dry membranes by preventing the decrease of spacing between membrane lipids under dehydration. In this study, we use molecular-dynamics simulations to investigate the influence of trehalose on the area per lipid (APL) and related structural properties of dehydrated bilayers in atomic detail. The starting conformation of a palmitoyloleolylphosphatidylcholine lipid bilayer in excess water was been obtained by self-assembly. A series of molecular-dynamics simulations of palmitoyloleolylphosphatidylcholine with different degrees of dehydration (28.5, 11.7, and 5.4 waters per lipid) and different molar trehalose/lipid ratios (<1:1, 1:1, and >1:1) were carried out in the NPT ensemble. Water removal causes the formation of multilamellar “stacks” through periodic boundary conditions. The headgroups reorient from pointing outward to inward with dehydration. This causes changes in the electrostatic interactions between interfaces, resulting in interface interpenetration. Interpenetration creates self-spacing of the bilayers and prevents gel-phase formation. At lower concentrations, trehalose does not separate the interfaces, and acting together with self-spacing, it causes a considerable increase of APL. APL decreases at higher trehalose concentrations when the layer of sugar physically separates the interfaces. When interfaces are separated, the model confirms the water replacement hypothesis. PMID:19619463

  15. Multi-scale 3D characterization of long period stacking ordered structure in Mg-Zn-Gd cast alloys.

    PubMed

    Ishida, Masahiro; Yoshioka, Satoru; Yamamoto, Tomokazu; Yasuda, Kazuhiro; Matsumura, Syo

    2014-11-01

    Magnesium alloys containing rare earth elements are attractive as lightweight structural materials due to their low density, high-specific strength and recycling efficiency. Mg-Zn-Gd system is one of promising systems because of their high creep-resistant property[1]. It is reported that the coherent precipitation formation of the 14H long period stacking ordered structure (LPSO) in Mg-Zn-Gd system at temperatures higher than 623 K[2,3]. In this study, the 14H LPSO phase formed in Mg-Zn-Gd alloys were investigated by multi-scale characterization with X-ray computer tomography (X-CT), focused ion beam (FIB) tomography and aberration-corrected STEM observation for further understanding of the LPSO formation mechanism.The Mg89.5 Zn4.5 Gd6 alloy ingots were cast using high-frequency induction heating in argon atmosphere. The specimens were aged at 753 K for 24 h in air. The aged specimen were cut and polished mechanically for microstructural analysis. The micrometer resolution X-CT observation was performed by conventional scaner (Bruker SKY- SCAN1172) at 80 kV. The FIB tomography and energy dispersive x-ray spectroscopy (EDS) were carried out by a dual beam FIB-SEM system (Hitachi MI-4000L) with silicon drift detector (SDD) (Oxford X-Max(N)). The electron acceleration voltages were used with 3 kV for SEM observation and 10 kV for EDX spectroscopy. The 3D reconstruction from image series was performed by Avizo Fire 8.0 software (FEI). TEM/STEM observations were also performed by transmission electron microscopes (JEOL JEM 2100, JEM-ARM 200F) at the acceleration voltage of 200 keV.The LPSO phase was observed clearly in SEM image of the Mg89.5Zn4.5Gd6 alloy at 753 K for 2h (Fig.1 (a)). The atomic structure of LPSO phase observed as white gray region of SEM image was also confirmed as 14H LPSO structure by using selected electron diffraction patterns and high-resolution STEM observations. The elemental composition of LPSO phase was determined as Mg97Zn1Gd2 by EDS analyses

  16. Infrared, vibrational circular dichroism, and Raman spectral simulations for β-sheet structures with various isotopic labels, interstrand, and stacking arrangements using density functional theory.

    PubMed

    Welch, William R W; Kubelka, Jan; Keiderling, Timothy A

    2013-09-12

    Infrared (IR), Raman, and vibrational circular dichroism (VCD) spectral variations for different β-sheet structures were studied using simulations based on density functional theory (DFT) force field and intensity computations. The DFT vibrational parameters were obtained for β-sheet fragments containing nine-amides and constrained to a variety of conformations and strand arrangements. These were subsequently transferred onto corresponding larger β-sheet models, normally consisting of five strands with ten amides each, for spectral simulations. Further extension to fibril models composed of multiple stacked β-sheets was achieved by combining the transfer of DFT parameters for each sheet with dipole coupling methods for interactions between sheets. IR spectra of the amide I show different splitting patterns for parallel and antiparallel β-sheets, and their VCD, in the absence of intersheet stacking, have distinct sign variations. Isotopic labeling by (13)C of selected residues yields spectral shifts and intensity changes uniquely sensitive to relative alignment of strands (registry) for antiparallel sheets. Stacking of multiple planar sheets maintains the qualitative spectral character of the single sheet but evidences some reduction in the exciton splitting of the amide I mode. Rotating sheets with respect to each other leads to a significant VCD enhancement, whose sign pattern and intensity is dependent on the handedness and degree of rotation. For twisted β-sheets, a significant VCD enhancement is computed even for sheets stacked with either the same or opposite alignments and the inter-sheet rotation, depending on the sense, can either further increase or weaken the enhanced VCD intensity. In twisted, stacked structures (without rotation), similar VCD amide I patterns (positive couplets) are predicted for both parallel and antiparallel sheets, but different IR intensity distributions still enable their differentiation. Our simulation results prove useful

  17. Effect of the deformation temperature on the structural refinement of BCC metals with a high stacking fault energy during high pressure torsion

    NASA Astrophysics Data System (ADS)

    Voronova, L. M.; Chashchukhina, T. I.; Gapontseva, T. M.; Krasnoperova, Yu. G.; Degtyarev, M. V.; Pilyugin, V. P.

    2016-10-01

    The structural evolution in bcc metals (molybdenum, niobium) with a high stacking fault energy (300 and 200 mJ/m-2, respectively) is studied during high pressure torsion in Bridgman anvils at temperatures of 290 and 80 K. It is established that cryogenic deformation of these metals does not result in twinning; however, banded structures are formed at the initial stage of deformation. Misoriented kink bands, which inhibit the formation of a homogeneous submicrocrystalline structure similarly to twins, form in molybdenum. The banded structures in niobium are characterized by low-angle misorientations; they do not suppress the formation of a submicrocrystalline structure and the refinement of microcrystallites to nanosizes.

  18. Imaging the Structure of Grains, Grain Boundaries, and Stacking Sequences in Single and Multi-Layer Graphene

    NASA Astrophysics Data System (ADS)

    Muller, David

    2012-02-01

    Graphene can be produced by chemical vapor deposition (CVD) on copper substrates on up to meter scales [1, 2], making their polycrystallinity [3,4] almost unavoidable. By combining aberration-corrected scanning transmission electron microscopy and dark-field transmission electron microscopy, we image graphene grains and grain boundaries across six orders of magnitude. Atomic-resolution images of graphene grain boundaries reveal that different grains can stitch together via pentagon-heptagon pairs. We use diffraction-filtered electron imaging to map the shape and orientation of several hundred grains and boundaries over fields of view of a hundred microns. Single, double and multilayer graphene can be differentiated, and the stacking sequence and relative abundance of sequences can be directly imaged. These images reveal an intricate patchwork of grains with structural details depending strongly on growth conditions. The imaging techniques enabled studies of the structure, properties, and control of graphene grains and grain boundaries [5]. [4pt] [1] X. Li et al., Science 324, 1312 (2009).[0pt] [2] S. Bae et al., Nature Nanotechnol. 5, 574 (2010).[0pt] [3] J. M. Wofford, et al., Nano Lett., (2010).[0pt] [4] P. Y. Huang, et al., Nature 469, 389--392 (2011); arXiv:1009.4714, (2010)[0pt] [5] In collaboration with Pinshane Y. Huang, C. S. Ruiz-Vargas, A. M. van der Zande, A. W. Tsen, L. Brown, R. Hovden, F. Ghahari, W. S. Whitney, M.P. Levendorf, J. W. Kevek, S. Garg, J. S. Alden, C. J. Hustedt, Y. Zhu, N. Petrone, J. Hone, J. Park, P. L. McEuen

  19. Impacts of Annealing Conditions on the Flat Band Voltage of Alternate La2O3/Al2O3 Multilayer Stack Structures

    NASA Astrophysics Data System (ADS)

    Feng, Xing-Yao; Liu, Hong-Xia; Wang, Xing; Zhao, Lu; Fei, Chen-Xi; Liu, He-Lei

    2016-09-01

    The mechanism of flat band voltage (VFB) shift for alternate La2O3/Al2O3 multilayer stack structures in different annealing condition is investigated. The samples were prepared for alternate multilayer structures, which were annealed in different conditions. The capacitance-voltage (C-V) measuring results indicate that the VFB of samples shift negatively for thinner bottom Al2O3 layer, increasing annealing temperature or longer annealing duration. Simultaneously, the diffusion of high- k material to interfaces in different multilayer structures and annealing conditions is observed by X-ray photoelectron spectroscopy (XPS). Based on the dipole theory, a correlation between the diffusion effect of La towards bottom Al2O3/Si interface and VFB shift is found. Without changing the dielectric constant k of films, VFB shift can be manipulated by controlling the single-layer cycles and annealing conditions of alternate high- k multilayer stack.

  20. The ELSA - Flood - Stack: A reconstruction from the laminated sediments of Eifel Maar structures during the last 60 000 years

    NASA Astrophysics Data System (ADS)

    Brunck, Heiko; Sirocko, Frank; Albert, Johannes

    2016-04-01

    events from 60 000 years until present times and indicates variable periodicities of flood activity linked to predominant climatic and anthropogenic development. It turns out that low vegetation coverage related to Greenland Stadial phases or anthropogenic impact is the main cause for the development of flood layers in maar sediments, while precipitation plays only a secondary role. References Brunck, H., Albert, J., Sirocko, F., 2015 (in press). The ELSA - Flood - Stack: A reconstruction from the laminated sediments of Eifel Maar structures during the last 60 000 years. Global and Planetary Change, Elsevier. Sirocko, F., Knapp, H., Dreher, F., Förster, M., Albert, J., Brunck, H., Veres, D., Dietrich, S., Zech, M., Hambach, U., Röhner, M., Rudert, S., Schwibus, K., Adams, C., Sigl, P., 2015 (in press). The ELSA-Vegetation-Stack: Reconstruction of Landscape Evolution Zones (LEZ) from laminated Eifel maar sediments of the last 60 000 years. Global and Planetary Change, Elsevier.

  1. The Stack: A New Bacterial Structure Analyzed in the Antarctic Bacterium Pseudomonas deceptionensis M1T by Transmission Electron Microscopy and Tomography

    PubMed Central

    Delgado, Lidia; Carrión, Ornella; Martínez, Gema; López-Iglesias, Carmen; Mercadé, Elena

    2013-01-01

    In recent years, improvements in transmission electron microscopy (TEM) techniques and the use of tomography have provided a more accurate view of the complexity of the ultrastructure of prokaryotic cells. Cryoimmobilization of specimens by rapid cooling followed by freeze substitution (FS) and sectioning, freeze fracture (FF) and observation of replica, or cryoelectron microscopy of vitreous sections (CEMOVIS) now allow visualization of biological samples close to their native state, enabling us to refine our knowledge of already known bacterial structures and to discover new ones. Application of these techniques to the new Antarctic cold-adapted bacterium Pseudomonasdeceptionensis M1T has demonstrated the existence of a previously undescribed cytoplasmic structure that does not correspond to known bacterial inclusion bodies or membranous formations. This structure, which we term a “stack”, was mainly visualized in slow growing cultures of P. deceptionensis M1T and can be described as a set of stacked membranous discs usually arranged perpendicularly to the cell membrane, but not continuous with it, and found in variable number in different locations within the cell. Regardless of their position, stacks were mostly observed very close to DNA fibers. Stacks are not exclusive to P. deceptionensis M1T and were also visualized in slow-growing cultures of other bacteria. This new structure deserves further study using cryoelectron tomography to refine its configuration and to establish whether its function could be related to chromosome dynamics. PMID:24039905

  2. Fuel cell stack arrangements

    DOEpatents

    Kothmann, Richard E.; Somers, Edward V.

    1982-01-01

    Arrangements of stacks of fuel cells and ducts, for fuel cells operating with separate fuel, oxidant and coolant streams. An even number of stacks are arranged generally end-to-end in a loop. Ducts located at the juncture of consecutive stacks of the loop feed oxidant or fuel to or from the two consecutive stacks, each individual duct communicating with two stacks. A coolant fluid flows from outside the loop, into and through cooling channels of the stack, and is discharged into an enclosure duct formed within the loop by the stacks and seals at the junctures at the stacks.

  3. Structural and thermodynamic consideration of metal oxide doped GeO{sub 2} for gate stack formation on germanium

    SciTech Connect

    Lu, Cimang Lee, Choong Hyun; Zhang, Wenfeng; Nishimura, Tomonori; Nagashio, Kosuke; Toriumi, Akira

    2014-11-07

    A systematic investigation was carried out on the material and electrical properties of metal oxide doped germanium dioxide (M-GeO{sub 2}) on Ge. We propose two criteria on the selection of desirable M-GeO{sub 2} for gate stack formation on Ge. First, metal oxides with larger cation radii show stronger ability in modifying GeO{sub 2} network, benefiting the thermal stability and water resistance in M-GeO{sub 2}/Ge stacks. Second, metal oxides with a positive Gibbs free energy for germanidation are required for good interface properties of M-GeO{sub 2}/Ge stacks in terms of preventing the Ge-M metallic bond formation. Aggressive equivalent oxide thickness scaling to 0.5 nm is also demonstrated based on these understandings.

  4. Two-dimensional analytical model for hetero-junction double-gate tunnel field-effect transistor with a stacked gate-oxide structure

    NASA Astrophysics Data System (ADS)

    Xu, Hui Fang; Gui Guan, Bang

    2017-05-01

    A two-dimensional analytical model for hetero-junction double-gate tunnel FETs (DG TFETs) with a stacked gate-oxide structure is proposed in this paper. The effects of both the channel mobile charges and source/drain depletion regions on the channel potential profile are considered for the higher accuracy of the proposed model. Poisson’s equation is solved using the superposition principle and Fourier series solution to model the channel potential. The band-to-band tunneling generation rate is expressed as a function of the channel electric field derived from the channel potential and then integrated analytically to derive the drain current of the hetero-junction DG TFETs with a stacked gate-oxide structure using the shortest tunneling path. The effects of device parameters on the channel potential, drain current, and transconductance are investigated. Very good agreements are observed between the model calculations and the simulated results.

  5. Performance of single-crystal Pb(Mg1/3Nb2/3)-32%PbTiO3 stacked actuators with application to adaptive structures

    NASA Astrophysics Data System (ADS)

    Woody, Shane C.; Smith, Stuart T.; Jiang, Xiaoning; Rehrig, Paul W.

    2005-07-01

    This article presents the performance of ultra-high-strain single-crystal piezoelectric stacked actuators using the composition Pb(Mg1/3Nb2/3)-32%PbTiO3 (PMN-32%PT)for adaptive structures (in particular for space-based applications). Generally, dimensionally adaptive or smart structures often utilize piezoelectric actuators [in particular lead zirconate titanate (PZT) elements] to provide high-frequency response motion. However, most commercial stacks are limited in range (often <0.1% strain) and the motion is further reduced at low or cryogenic temperatures for satellite-based and many other applications. Comparatively, single-crystal actuators such as the ultra-high-strain PMN-32%PT provide greater than a factor of 4 displacement, factor of 2 strain energy density, and cryogenic displacements are comparable to room-temperature conditions for PZT actuators. Nonetheless, there are some technological and fundamental limitations, such as plate thickness, which is generally greater than 0.5mm, low elastic modulus, and low strain at each end of the stacks. Three stack configurations with 3, 5, and 40 active layers are tested and discussed. This report discusses each configuration type as a function of lost motion, obtainable strain rates, preload designs, applied stiffness, stress gradients, electric fields, and bandwidth performances. The results obtained in this study aim to show performance and discuss the relative merits and limitations of using this actuator material for adaptive structures. A case study is presented for a high bandwidth steering mirror using ultra-high-strain single crystals. Closed loop control results from the platform's response are briefly discussed.

  6. Electrochemical cell stack assembly

    DOEpatents

    Jacobson, Craig P.; Visco, Steven J.; De Jonghe, Lutgard C.

    2010-06-22

    Multiple stacks of tubular electrochemical cells having a dense electrolyte disposed between an anode and a cathode preferably deposited as thin films arranged in parallel on stamped conductive interconnect sheets or ferrules. The stack allows one or more electrochemical cell to malfunction without disabling the entire stack. Stack efficiency is enhanced through simplified gas manifolding, gas recycling, reduced operating temperature and improved heat distribution.

  7. Atomic and electronic structure of trilayer graphene/SiC(0001): Evidence of Strong Dependence on Stacking Sequence and charge transfer

    PubMed Central

    Pierucci, Debora; Brumme, Thomas; Girard, Jean-Christophe; Calandra, Matteo; Silly, Mathieu G.; Sirotti, Fausto; Barbier, Antoine; Mauri, Francesco; Ouerghi, Abdelkarim

    2016-01-01

    The transport properties of few-layer graphene are the directly result of a peculiar band structure near the Dirac point. Here, for epitaxial graphene grown on SiC, we determine the effect of charge transfer from the SiC substrate on the local density of states (LDOS) of trilayer graphene using scaning tunneling microscopy/spectroscopy and angle resolved photoemission spectroscopy (ARPES). Different spectra are observed and are attributed to the existence of two stable polytypes of trilayer: Bernal (ABA) and rhomboedreal (ABC) staking. Their electronic properties strongly depend on the charge transfer from the substrate. We show that the LDOS of ABC stacking shows an additional peak located above the Dirac point in comparison with the LDOS of ABA stacking. The observed LDOS features, reflecting the underlying symmetry of the two polytypes, were reproduced by explicit calculations within density functional theory (DFT) including the charge transfer from the substrate. These findings demonstrate the pronounced effect of stacking order and charge transfer on the electronic structure of trilayer or few layer graphene. Our approach represents a significant step toward understand the electronic properties of graphene layer under electrical field. PMID:27629702

  8. Atomic and electronic structure of trilayer graphene/SiC(0001): Evidence of Strong Dependence on Stacking Sequence and charge transfer

    NASA Astrophysics Data System (ADS)

    Pierucci, Debora; Brumme, Thomas; Girard, Jean-Christophe; Calandra, Matteo; Silly, Mathieu G.; Sirotti, Fausto; Barbier, Antoine; Mauri, Francesco; Ouerghi, Abdelkarim

    2016-09-01

    The transport properties of few-layer graphene are the directly result of a peculiar band structure near the Dirac point. Here, for epitaxial graphene grown on SiC, we determine the effect of charge transfer from the SiC substrate on the local density of states (LDOS) of trilayer graphene using scaning tunneling microscopy/spectroscopy and angle resolved photoemission spectroscopy (ARPES). Different spectra are observed and are attributed to the existence of two stable polytypes of trilayer: Bernal (ABA) and rhomboedreal (ABC) staking. Their electronic properties strongly depend on the charge transfer from the substrate. We show that the LDOS of ABC stacking shows an additional peak located above the Dirac point in comparison with the LDOS of ABA stacking. The observed LDOS features, reflecting the underlying symmetry of the two polytypes, were reproduced by explicit calculations within density functional theory (DFT) including the charge transfer from the substrate. These findings demonstrate the pronounced effect of stacking order and charge transfer on the electronic structure of trilayer or few layer graphene. Our approach represents a significant step toward understand the electronic properties of graphene layer under electrical field.

  9. Evolution and dimensional crossover from the bulk subbands in ABC-stacked graphene to a three-dimensional Dirac cone structure in rhombohedral graphite

    NASA Astrophysics Data System (ADS)

    Ho, Ching-Hong; Chang, Cheng-Peng; Lin, Ming-Fa

    2016-02-01

    Rhombohedral graphite behaves like a topological semimetal, possessing flat surface subbands while being semimetallic in the bulk. The bulk-surface correspondence arises from the ABC-stacking configuration of graphene layers. The bulk subbands in rhombohedral graphite can be interpreted as a three-dimensional Dirac cone structure, whose Dirac points form continuous lines spiraling in momentum space. In this paper, we study the evolution of gapped bulk subbands in ABC-stacked N -layer graphene with an increase of N , and their dimensional crossover to the three-dimensional Dirac cone structure in the bulk limit, where the bulk gap closes up at the Dirac-point spirals. To clarify the effect of coupling to the surface subbands, we use a nonperturbative effective Hamiltonian closed in the bulk subspace. As a consequence, the wavelength of the standing-wave function across the stack of layers depends on the in-plane Bloch momentum. In the bulk limit, the coupling vanishes and hence the wavelength is irrelevant to the surface.

  10. Perfect polar stacking of parallel beloamphiphile layers. Synthesis, structure and solid-state optical properties of the unsymmetrical acetophenone azine DCA.

    PubMed

    Glaser, Rainer; Knotts, Nathan; Yu, Ping; Li, Linghui; Chandrasekhar, Meera; Martin, Christopher; Barnes, Charles L

    2006-06-21

    Extraordinary high degrees of polar order can be achieved by a rational design that involves the polar stacking of parallel beloamphiphile monolayers (PBAM). This strategy is exemplified by the acetophenone azines MCA (4-methoxy-4'-chloroacetophenone azine) and DCA (4-decoxy-4'-chloroacetophenone azine). The beloamphiphile design aims to achieve strong lateral interactions by way of arene-arene, azine-azine, arene-azine and halogen-bonding interactions. Dipole-induced interactions and halogen bonding dominate interlayer interactions and halogen bonding is shown to effect the layer stacking. Crystals of DCA contain PBAMs with perfect polar order and perfect polar layer stacking, while crystals of MCA features perfect polar order only in one of two layers and layer stacking is polar but not entirely perfect. We report the synthesis of the beloamphiphile DCA, its crystal structure, and we present a comparative discussion of the structures and intermolecular interactions of MCA and DCA. Absorbance and photoluminescence measurements have been carried out for solutions of DCA and for DCA crystals. DCA exhibits a broad emission centered at 2.5 eV when excited with UV radiation. The nonlinear optical response was studied by measuring second harmonic generation (SHG). Strong SHG signals have been observed due to the polar alignment and the DCA crystal's NLO response is 34 times larger than that of urea. Optimization of the beloamphiphile and systematic SAR studies of the polar organic crystals, which are now possible for the very first time, will further improve the performance of this new class of functional organic materials. The materials are organic semiconductors and show promise as blue emitters, as nonlinear optical materials and as OLED materials.

  11. Lightweight Stacks of Direct Methanol Fuel Cells

    NASA Technical Reports Server (NTRS)

    Narayanan, Sekharipuram; Valdez, Thomas

    2004-01-01

    An improved design concept for direct methanol fuel cells makes it possible to construct fuel-cell stacks that can weigh as little as one-third as much as do conventional bipolar fuel-cell stacks of equal power. The structural-support components of the improved cells and stacks can be made of relatively inexpensive plastics. Moreover, in comparison with conventional bipolar fuel-cell stacks, the improved fuel-cell stacks can be assembled, disassembled, and diagnosed for malfunctions more easily. These improvements are expected to bring portable direct methanol fuel cells and stacks closer to commercialization. In a conventional bipolar fuel-cell stack, the cells are interspersed with bipolar plates (also called biplates), which are structural components that serve to interconnect the cells and distribute the reactants (methanol and air). The cells and biplates are sandwiched between metal end plates. Usually, the stack is held together under pressure by tie rods that clamp the end plates. The bipolar stack configuration offers the advantage of very low internal electrical resistance. However, when the power output of a stack is only a few watts, the very low internal resistance of a bipolar stack is not absolutely necessary for keeping the internal power loss acceptably low.

  12. A bundled-stack discotic columnar liquid crystalline phase with inter-stack electronic coupling

    DOE PAGES

    Wang, Bin; Sun, Runkun; Günbaş, Duygu D.; ...

    2015-06-15

    The first compound proving to be capable of forming a bundled-stack discotic columnar liquid crystalline (BSDCLC) phase was designed and synthesized. Finally, the unique perylene anhydride inter-stack interaction was found to be the key to the formation of the BSDCLC structure and inter-stack electronic coupling (ISEC).

  13. A bundled-stack discotic columnar liquid crystalline phase with inter-stack electronic coupling

    SciTech Connect

    Wang, Bin; Sun, Runkun; Günbaş, Duygu D.; Zhang, Hao; Grozema, Ferdinand C.; Xiao, Kai; Jin, Shi

    2015-06-15

    The first compound proving to be capable of forming a bundled-stack discotic columnar liquid crystalline (BSDCLC) phase was designed and synthesized. Finally, the unique perylene anhydride inter-stack interaction was found to be the key to the formation of the BSDCLC structure and inter-stack electronic coupling (ISEC).

  14. CHSalign: A Web Server That Builds upon Junction-Explorer and RNAJAG for Pairwise Alignment of RNA Secondary Structures with Coaxial Helical Stacking

    PubMed Central

    Kim, Namhee; Laing, Christian; Wang, Jason T. L.; Schlick, Tamar

    2016-01-01

    RNA junctions are important structural elements of RNA molecules. They are formed when three or more helices come together in three-dimensional space. Recent studies have focused on the annotation and prediction of coaxial helical stacking (CHS) motifs within junctions. Here we exploit such predictions to develop an efficient alignment tool to handle RNA secondary structures with CHS motifs. Specifically, we build upon our Junction-Explorer software for predicting coaxial stacking and RNAJAG for modelling junction topologies as tree graphs to incorporate constrained tree matching and dynamic programming algorithms into a new method, called CHSalign, for aligning the secondary structures of RNA molecules containing CHS motifs. Thus, CHSalign is intended to be an efficient alignment tool for RNAs containing similar junctions. Experimental results based on thousands of alignments demonstrate that CHSalign can align two RNA secondary structures containing CHS motifs more accurately than other RNA secondary structure alignment tools. CHSalign yields a high score when aligning two RNA secondary structures with similar CHS motifs or helical arrangement patterns, and a low score otherwise. This new method has been implemented in a web server, and the program is also made freely available, at http://bioinformatics.njit.edu/CHSalign/. PMID:26789998

  15. Enhanced and tunable surface plasmons in two-dimensional Ti3C2 stacks: Electronic structure versus boundary effects

    NASA Astrophysics Data System (ADS)

    Mauchamp, Vincent; Bugnet, Matthieu; Bellido, Edson P.; Botton, Gianluigi A.; Moreau, Philippe; Magne, Damien; Naguib, Michael; Cabioc'h, Thierry; Barsoum, Michel W.

    2014-06-01

    The dielectric response of two-dimensional (2D) Ti3C2 stacked sheets was investigated by high-resolution transmission electron energy-loss spectroscopy and ab initio calculations in the 0.2-30-eV energy range. Intense surface plasmons (SPs), evidenced at the nanometer scale at energies as low as 0.3 eV, are shown to be the dominant screening process up to at least 45-nm-thick stacks. This domination results from a combination of efficient free-electron dynamics, begrenzungs effect, and reduced interband damping. It is shown that, in principle, the SPs energies can be tuned in the mid-infrared, from 0.2 to 0.7 eV, by controlling the sheets' functionalization and/or thickness. This point evidences a new attribute of this new class of 2D materials.

  16. Structural and electronic properties of AB- and AA-stacking bilayer-graphene intercalated by Li, Na, Ca, B, Al, Si, Ge, Ag, and Au atoms

    NASA Astrophysics Data System (ADS)

    Tayran, Ceren; Aydin, Sezgin; Çakmak, Mehmet; Ellialtıoğlu, Şinasi

    2016-04-01

    The structural and electronic properties of X (=Li, Na, Ca, B, Al, Si, Ge, Ag, and Au)-intercalated AB- and AA-stacking bilayer-graphene have been investigated by using ab initio density functional theory. It is shown that Boron (Lithium)-intercalated system is energetically more stable than the others for the AB (AA) stacking bilayer-graphene systems. The structural parameters, electronic band structures, and orbital nature of actual interactions are studied for the relaxed stable geometries. It is seen that the higher the binding energy, the smaller is the distance between the layers, in these systems. The electronic band structures for these systems show that different intercalated atoms can change the properties of bilayer-graphene differently. For qualitative description of the electronic properties, the metallicities of the systems are also calculated and compared with each other. The Mulliken analysis and electron density maps clearly indicate that the interactions inside a single layer (intralayer interactions) are strong and highly covalent, while the interactions between the two layers (interlayer interactions) are much weaker.

  17. Six-band terahertz metamaterial absorber based on the combination of multiple-order responses of metallic patches in a dual-layer stacked resonance structure

    NASA Astrophysics Data System (ADS)

    Wang, Ben-Xin; Wang, Gui-Zhen; Sang, Tian; Wang, Ling-Ling

    2017-01-01

    This paper reports on a numerical study of the six-band metamaterial absorber composed of two alternating stack of metallic-dielectric layers on top of a continuous metallic plane. Six obvious resonance peaks with high absorption performance (average larger than 99.37%) are realized. The first, third, fifth, and the second, fourth, sixth resonance absorption bands are attributed to the multiple-order responses (i.e., the 1-, 3- and 5-order responses) of the bottom- and top-layer of the structure, respectively, and thus the absorption mechanism of six-band absorber is due to the combination of two sets of the multiple-order resonances of these two layers. Besides, the size changes of the metallic layers have the ability to tune the frequencies of the six-band absorber. Employing the results, we also present a six-band polarization tunable absorber through varying the sizes of the structure in two orthogonal polarization directions. Moreover, nine-band terahertz absorber can be achieved by using a three-layer stacked structure. Simulation results indicate that the absorber possesses nine distinct resonance bands, and average absorptivities of them are larger than 94.03%. The six-band or nine-band absorbers obtained here have potential applications in many optoelectronic and engineering technology areas.

  18. Six-band terahertz metamaterial absorber based on the combination of multiple-order responses of metallic patches in a dual-layer stacked resonance structure

    PubMed Central

    Wang, Ben-Xin; Wang, Gui-Zhen; Sang, Tian; Wang, Ling-Ling

    2017-01-01

    This paper reports on a numerical study of the six-band metamaterial absorber composed of two alternating stack of metallic-dielectric layers on top of a continuous metallic plane. Six obvious resonance peaks with high absorption performance (average larger than 99.37%) are realized. The first, third, fifth, and the second, fourth, sixth resonance absorption bands are attributed to the multiple-order responses (i.e., the 1-, 3- and 5-order responses) of the bottom- and top-layer of the structure, respectively, and thus the absorption mechanism of six-band absorber is due to the combination of two sets of the multiple-order resonances of these two layers. Besides, the size changes of the metallic layers have the ability to tune the frequencies of the six-band absorber. Employing the results, we also present a six-band polarization tunable absorber through varying the sizes of the structure in two orthogonal polarization directions. Moreover, nine-band terahertz absorber can be achieved by using a three-layer stacked structure. Simulation results indicate that the absorber possesses nine distinct resonance bands, and average absorptivities of them are larger than 94.03%. The six-band or nine-band absorbers obtained here have potential applications in many optoelectronic and engineering technology areas. PMID:28120897

  19. Zone structure and polarization properties of the stack of a metamaterial-based cholesteric liquid crystal and isotropic medium layers

    NASA Astrophysics Data System (ADS)

    Gevorgyan, A. H.; Matinyan, G. K.

    2014-05-01

    The optical properties of a stack of metamaterial-based cholesteric liquid crystal (CLC) layers and isotropic medium layers are investigated. The problem is solved by a modification of Ambartsumian's layer addition method. CLCs with two types of chiral nihility are defined. The peculiarities of the reflection spectra of this system are investigated and it is shown that the reflection spectra of the stacks of CLC layers of these two types differ from each other. Besides, in contrast to the single CLC layer case, these systems have multiple photonic band gaps. There are two types of such gaps: those selective with respect to polarization of the incident light and nonselective ones. It is shown that the system eigenpolarizations mainly coincide with the quasi-orthogonal, quasi-circular polarizations for normally incident light, except the regions of diffraction reflection selective with respect to the polarization of incident light. The influence of the CLC sublayer thick-nesses, the incidence angle, the local dielectric (magnetic) anisotropy of the CLC layers, and the refractive indices and thicknesses of the isotropic media layers on the reflection spectra and other optical characteristics of the system is investigated.

  20. Seismic and structural characterization of the fluid bypass system using 3D and partial stack seismic from passive margin: inside the plumbing system.

    NASA Astrophysics Data System (ADS)

    Iacopini, David; Maestrelli, Daniele; Jihad, Ali; Bond, Clare; Bonini, Marco

    2017-04-01

    In recent years enormous attention has been paid to the understanding of the process and mechanism controlling the gas seepage and more generally the fluid expulsion affecting the earth system from onshore to offshore environment. This is because of their demonstrated impact to our environment, climate change and during subsea drilling operation. Several example from active and paleo system has been so far characterized and proposed using subsurface exploration, geophysical and geochemical monitoring technology approaches with the aims to explore what trigger and drive the overpressure necessary maintain the fluid/gas/material expulsion and what are the structure that act as a gateway for gaseous fluid and unconsolidated rock. In this contribution we explore a series of fluid escape structure (ranging from seepage pipes to large blowout pipes structure of km length) using 3D and partial stack seismic data from two distinctive passive margin from the north sea (Loyal field, West Shetland) and the Equatorial Brazil (Ceara' Basin). We will focuses on the characterization of the plumbing system internal architecture and, for selected example, exploring the AVO response (using partial stack) of the internal fluid/unconsolidated rock. The detailed seismic mapping and seismic attributes analysis of the conduit system helped us to recover some detail from the signal response of the chimney internal structures. We observed: (1) small to medium seeps and pipes following structural or sedimentary discontinuities (2) large pipes (probably incipient mud volcanoes) and blowup structures propagating upward irrespective of pre-existing fault by hydraulic fracturing and assisted by the buoyancy of a fluidised and mobilised mud-hydrocarbon mixture. The reflector termination observed inside the main conduits, the distribution of stacked bright reflectors and the AVO analysis suggests an evolution of mechanisms (involving mixture of gas, fluid and probably mud) during pipe birth and

  1. Monomer-dimer equilibrium for the 5'-5' stacking of propeller-type parallel-stranded G-quadruplexes: NMR structural study.

    PubMed

    Do, Ngoc Quang; Phan, Anh Tuân

    2012-11-12

    Guanine-rich sequence motifs, which contain tracts of three consecutive guanines connected by single non-guanine nucleotides, are abundant in the human genome and can form a robust G-quadruplex structure with high stability. Herein, by using NMR spectroscopy, we investigate the equilibrium between monomeric and 5'-5' stacked dimeric propeller-type G-quadruplexes that are formed by DNA sequences containing GGGT motifs. We show that the monomer-dimer equilibrium depends on a number of parameters, including the DNA concentration, DNA flanking sequences, the concentration and type of cations, and the temperature. We report on the high-definition structure of a simple monomeric G-quadruplex containing three single-residue loops, which could serve as a reference for propeller-type G-quadruplex structures in solution.

  2. Highly Accurate CCSD(T) and DFT–SAPT Stabilization Energies of H-Bonded and Stacked Structures of the Uracil Dimer

    SciTech Connect

    Pitonak, Michal; Riley, Kevin E.; Neogrady, Pavel; Hobza, Pavel

    2008-06-23

    The CCSD(T) interaction energies for the H-bonded and stacked structures of the uracil dimer are determined at the aug-cc-pVDZ and aug-cc-pVTZ levels. On the basis of these calculations we can construct the CCSD(T) interaction energies at the complete basis set (CBS) limit. The most accurate energies, based either on direct extrapolation of the CCSD(T) correlation energies obtained with the aug-cc-pVDZ and aug-cc-pVTZ basis sets or on the sum of extrapolated MP2 interaction energies (from aug-cc-pVTZ and aug-cc-pVQZ basis sets) and extrapolated ΔCCSD(T) correction terms [difference between CCSD(T) and MP2 interaction energies] differ only slightly, which demonstrates the reliability and robustness of both techniques. The latter values, which represent new standards for the H-bonding and stacking structures of the uracil dimer, differ from the previously published data for the S22 set by a small amount. This suggests that interaction energies of the S22 set are generated with chemical accuracy. The most accurate CCSD(T)/CBS interaction energies are compared with interaction energies obtained from various computational procedures, namely the SCS–MP2 (SCS: spin-component-scaled), SCS(MI)–MP2 (MI: molecular interaction), MP3, dispersion-augmented DFT (DFT–D), M06–2X, and DFT–SAPT (SAPT: symmetry-adapted perturbation theory) methods. Among these techniques, the best results are obtained with the SCS(MI)–MP2 method. Remarkably good binding energies are also obtained with the DFT–SAPT method. Both DFT techniques tested yield similarly good interaction energies. The large magnitude of the stacking energy for the uracil dimer, compared to that of the benzene dimer, is explained by attractive electrostatic interactions present in the stacked uracil dimer. These interactions force both subsystems to approach each other and the dispersion energy benefits from a shorter intersystem separation.

  3. Effect of spacer layer thickness on structural and optical properties of multi-stack InAs/GaAsSb quantum dots

    SciTech Connect

    Kim, Yeongho; Ban, Keun-Yong Honsberg, Christiana B.; Boley, Allison; Smith, David J.

    2015-10-26

    The structural and optical properties of ten-stack InAs/GaAsSb quantum dots (QDs) with different spacer layer thicknesses (d{sub s} = 2, 5, 10, and 15 nm) are reported. X-ray diffraction analysis reveals that the strain relaxation of the GaAsSb spacers increases linearly from 0% to 67% with larger d{sub s} due to higher elastic stress between the spacer and GaAs matrix. In addition, the dislocation density in the spacers with d{sub s} = 10 nm is lowest as a result of reduced residual strain. The photoluminescence peak energy from the QDs does not change monotonically with increasing d{sub s} due to the competing effects of decreased compressive strain and weak electronic coupling of stacked QD layers. The QD structure with d{sub s} = 10 nm is demonstrated to have improved luminescence properties and higher carrier thermal stability.

  4. Effective work function engineering for a TiN/XO(X = La, Zr, Al)/SiO{sub 2} stack structures

    SciTech Connect

    Lee, Dongjin Lee, Jieun; Jung, Kyoungho; Jeong, Moonyoung; Yamada, Satoru; Hong, Hyeongsun; Lee, Kyupil; Cho, Eunae; Heo, Sung Ko, Dongsu; Kim, Yong Su; Kyoung, Yong Koo; Lee, Hyung-Ik; Lee, Hyo Sug; Park, Gyeong-Su; Shin, Jai Kwang

    2016-05-23

    In this study, we demonstrated that work function engineering is possible over a wide range (+200 mV to −430 mV) in a TiN/XO (X = La, Zr, or Al)/SiO{sub 2} stack structures. From ab initio simulations, we selected the optimal material for the work function engineering. The work function engineering mechanism was described by metal diffusion into the TiN film and silicate formation in the TiN/SiO{sub 2} interface. The metal doping and the silicate formation were confirmed by transmission electron microscopy and energy dispersive spectroscopy line profiling, respectively. In addition, the amount of doped metal in the TiN film depended on the thickness of the insertion layer XO. From the work function engineering technique, which can control a variety of threshold voltages (Vth), an improvement in transistors with different V{sub th} values in the TiN/XO/SiO{sub 2} stack structures is expected.

  5. Effect of Pr Valence State on Interfacial Structure and Electrical Properties of Pr Oxide/PrON/Ge Gate Stack Structure

    NASA Astrophysics Data System (ADS)

    Kato, Kimihiko; Sakashita, Mitsuo; Takeuchi, Wakana; Kondo, Hiroki; Nakatsuka, Osamu; Zaima, Shigeaki

    2011-04-01

    In this study, we investigated the valence state and chemical bonding state of Pr in a Pr oxide/PrON/Ge structure. We clarified the relationship between the valence state of Pr and the Pr oxide/Ge interfacial reaction using Pr oxide/Ge and Pr oxide/PrON/Ge samples. We found the formation of three Pr oxide phases in Pr oxide films; hexagonal Pr2O3 (h-Pr2O3) (Pr3+), cubic Pr2O3 (c-Pr2O3) (Pr3+), and c-PrO2 (Pr4+). We also investigated the effect of a nitride interlayer on the interfacial reaction in Pr oxide/Ge gate stacks. In a sample with a nitride interlayer (Pr oxide/PrON/Ge), metallic Pr-Pr bonds are also formed in the c-Pr2O3 film. After annealing in H2 ambient, the diffusion of Ge into Pr oxide is not observed in this sample. Pr-Pr bonds probably prevent the interfacial reaction and Ge oxide formation, considering that the oxygen chemical potential of this film is lower than that of a GeO2/Ge system. On the other hand, the rapid thermal oxidation (RTO) treatment terminates the O vacancies and defects in c-Pr2O3. As a result, c-PrO2 with tetravalent Pr is formed in the Pr oxide/PrON/Ge sample with RTO. In this sample, the leakage current density is effectively decreased in comparison with the sample without RTO. Hydrogen termination works effectively in Pr oxide/PrON/Ge samples with and without RTO, and we can achieve an interface state density of as low as 4 ×1011 eV-1·cm-2.

  6. Stacking with stochastic cooling

    NASA Astrophysics Data System (ADS)

    Caspers, Fritz; Möhl, Dieter

    2004-10-01

    Accumulation of large stacks of antiprotons or ions with the aid of stochastic cooling is more delicate than cooling a constant intensity beam. Basically the difficulty stems from the fact that the optimized gain and the cooling rate are inversely proportional to the number of particles 'seen' by the cooling system. Therefore, to maintain fast stacking, the newly injected batch has to be strongly 'protected' from the Schottky noise of the stack. Vice versa the stack has to be efficiently 'shielded' against the high gain cooling system for the injected beam. In the antiproton accumulators with stacking ratios up to 105 the problem is solved by radial separation of the injection and the stack orbits in a region of large dispersion. An array of several tapered cooling systems with a matched gain profile provides a continuous particle flux towards the high-density stack core. Shielding of the different systems from each other is obtained both through the spatial separation and via the revolution frequencies (filters). In the 'old AA', where the antiproton collection and stacking was done in one single ring, the injected beam was further shielded during cooling by means of a movable shutter. The complexity of these systems is very high. For more modest stacking ratios, one might use azimuthal rather than radial separation of stack and injected beam. Schematically half of the circumference would be used to accept and cool new beam and the remainder to house the stack. Fast gating is then required between the high gain cooling of the injected beam and the low gain stack cooling. RF-gymnastics are used to merge the pre-cooled batch with the stack, to re-create free space for the next injection, and to capture the new batch. This scheme is less demanding for the storage ring lattice, but at the expense of some reduction in stacking rate. The talk reviews the 'radial' separation schemes and also gives some considerations to the 'azimuthal' schemes.

  7. Progress Update: Stack Project Complete

    SciTech Connect

    Cody, Tom

    2010-01-01

    Progress update from the Savannah River Site. The 75 foot 293 F Stack, built for plutonium production, was cut down to size in order to prevent injury or release of toxic material if the structure were to collapse due to harsh weather.

  8. Progress Update: Stack Project Complete

    ScienceCinema

    Cody, Tom

    2016-07-12

    Progress update from the Savannah River Site. The 75 foot 293 F Stack, built for plutonium production, was cut down to size in order to prevent injury or release of toxic material if the structure were to collapse due to harsh weather.

  9. Localized double-array stacking analysis of PcP: D″ and ULVZ structure beneath the Cocos plate, Mexico, central Pacific, and north Pacific

    USGS Publications Warehouse

    Hutko, Alexander R.; Lay, Thorne; Revenaugh, Justin

    2009-01-01

    A large, high quality P-wave data set comprising short-period and broadband signals sampling four separate regions in the lowermost mantle beneath the Cocos plate, Mexico, the central Pacific, and the north Pacific is analyzed using regional one-dimensional double-array stacking and modelling with reflectivity synthetics. A data-screening criterion retains only events with stable PcP energy in the final data stacks used for modelling and interpretation. This significantly improves the signal stacks relative to including unscreened observations, allows confident alignment on the PcP arrival and allows tight bounds to be placed on P-wave velocity structure above the core–mantle boundary (CMB). The PcP reflections under the Cocos plate are well modelled without any ultra-low velocity zone from 5 to 20°N. At latitudes from 15 to 20°N, we find evidence for two P-wave velocity discontinuities in the D″ region. The first is ∼182 km above the CMB with a δln Vp of +1.5%, near the same depth as a weaker discontinuity (<+0.5%) observed from 5 to 15°N in prior work. The other reflector is ∼454 km above the CMB, with a δln Vp of +0.4%; this appears to be a shallower continuation of the joint P- and S-wave discontinuity previously detected south of 15° N, which is presumed to be the perovskite to post-perovskite phase transition. The data stacks for paths bottoming below Mexico have PcP images that are well matched with the simple IASP91 structure, contradicting previous inferences of ULVZ presence in this region. These particular data are not very sensitive to any D″ discontinuities, and simply bound them to be <∼2%, if present. Data sampling the lowermost mantle beneath the central Pacific confirm the presence of a ∼15-km thick ultra-low velocity zone (ULVZ) just above the CMB, with δln Vp and δln Vs of around −3 to −4% and −4 to −8%, respectively. The ULVZ models predict previous S-wave data stacks well. The data for this region

  10. The electronic structure of the four nucleotide bases in DNA, of their stacks, and of their homopolynucleotides in the absence and presence of water

    NASA Astrophysics Data System (ADS)

    Ladik, János; Bende, Attila; Bogár, Ferenc

    2008-03-01

    Using the ab initio Hartree-Fock crystal orbital method in its linear combination of atomic orbital form, the energy band structure of the four homo-DNA-base stacks and those of poly(adenilic acid), polythymidine, and polycytidine were calculated both in the absence and presence of their surrounding water molecules. For these computations Clementi's double ζ basis set was applied. To facilitate the interpretation of the results, the calculations were supplemented by the calculations of the six narrow bands above the conduction band of poly(guanilic acid) with water. Further, the sugar-phosphate chain as well as the water structures around poly(adenilic acid) and polythymidine, respectively, were computed. Three important features have emerged from these calculations. (1) The nonbase-type or water-type bands in the fundamental gap are all close to the corresponding conduction bands. (2) The very broad conduction band (1.70eV) of the guanine stack is split off to seven narrow bands in the case of poly(guanilic acid) (both without and with water) showing that in the energy range of the originally guanine-stack-type conduction band, states belonging to the sugar, to PO4-, to Na+, and to water mix with the guanine-type states. (3) It is apparent that at the homopolynucleotides with water in three cases the valence bands are very similar (polycytidine, because it has a very narrow valence band, does not fall into this category). We have supplemented these calculations by the computation of correlation effects on the band structures of the base stacks by solving the inverse Dyson equation in its diagonal approximation taken for the self-energy the MP2 many body perturbation theory expression. In all cases the too large fundamental gap decreased by 2-3eV. In most cases the widths of the valence and conduction bands, respectively, decreased (but not in all cases). This unusual behavior is most probably due to the rather large complexity of the systems. From all this

  11. Electroabsorption modulators integrated with DFB lasers based on identical active double-stack MQW-layer structure with high-frequency performance

    NASA Astrophysics Data System (ADS)

    Stegmueller, Bernhard; Hanke, Christian

    2003-12-01

    Electro optic modulators are key components for fiber optic transmission at data rates exceeding 10Gbit/s. The monolithic integration of an electroabsorption (EA) modulator applying the quantum confined stark effect with a distributed feedback (DFB) laser diode was demonstrated using a novel approach based on a double-stack multiple quantum well (MQW) structure. This novel approach using an identical MQW layer structure for both devices, the DFB laser diode and the EA modulator, will be described and discussed. Recently, a maximum 3dB-cutoff frequency of 25 GHz was measured. Further experimental results obtained from devices operating at 1.3 μm and 1.55 μm, respectively, exhibit the potential of these devices for high-speed data rate transmission.

  12. Effects of gate stack structural and process defectivity on high-k dielectric dependence of NBTI reliability in 32 nm technology node PMOSFETs.

    PubMed

    Hussin, H; Soin, N; Bukhori, M F; Hatta, S Wan Muhamad; Wahab, Y Abdul

    2014-01-01

    We present a simulation study on negative bias temperature instability (NBTI) induced hole trapping in E' center defects, which leads to depassivation of interface trap precursor in different geometrical structures of high-k PMOSFET gate stacks using the two-stage NBTI model. The resulting degradation is characterized based on the time evolution of the interface and hole trap densities, as well as the resulting threshold voltage shift. By varying the physical thicknesses of the interface silicon dioxide (SiO2) and hafnium oxide (HfO2) layers, we investigate how the variation in thickness affects hole trapping/detrapping at different stress temperatures. The results suggest that the degradations are highly dependent on the physical gate stack parameters for a given stress voltage and temperature. The degradation is more pronounced by 5% when the thicknesses of HfO2 are increased but is reduced by 11% when the SiO2 interface layer thickness is increased during lower stress voltage. However, at higher stress voltage, greater degradation is observed for a thicker SiO2 interface layer. In addition, the existence of different stress temperatures at which the degradation behavior differs implies that the hole trapping/detrapping event is thermally activated.

  13. Direct evidence of flat band voltage shift for TiN/LaO or ZrO/SiO2 stack structure via work function depth profiling

    NASA Astrophysics Data System (ADS)

    Heo, Sung; Park, Hyoungsun; Ko, Dong-Su; Kim, Yong Su; Kyoung, Yong Koo; Lee, Hyung-Ik; Cho, Eunae; Lee, Hyo Sug; Park, Gyung-Su; Shin, Jai Kwang; Lee, Dongjin; Lee, Jieun; Jung, Kyoungho; Jeong, Moonyoung; Yamada, Satoru; Kang, Hee Jae; Choi, Byoung-Deog

    2017-03-01

    We demonstrated that a flat band voltage (VFB) shift could be controlled in TiN/(LaO or ZrO)/SiO2 stack structures. The VFB shift described in term of metal diffusion into the TiN film and silicate formation in the inserted (LaO or ZrO)/SiO2 interface layer. The metal doping and silicate formation confirmed by using transmission electron microscopy (TEM) and energy dispersive spectroscopy (EDS) line profiling, respectively. The direct work function measurement technique allowed us to make direct estimate of a variety of flat band voltages (VFB). As a function of composition ratio of La or Zr to Ti in the region of a TiN/(LaO or ZrO)/SiO2/Si stack, direct work function modulation driven by La and Zr doping was confirmed with the work functions obtained from the cutoff value of secondary electron emission by auger electron spectroscopy (AES). We also suggested an analytical method to determine the interface dipole via work function depth profiling.

  14. Direct evidence of flat band voltage shift for TiN/LaO or ZrO/SiO2 stack structure via work function depth profiling

    PubMed Central

    Heo, Sung; Park, Hyoungsun; Ko, Dong-Su; Kim, Yong Su; Kyoung, Yong Koo; Lee, Hyung-Ik; Cho, Eunae; Lee, Hyo Sug; Park, Gyung-Su; Shin, Jai Kwang; Lee, Dongjin; Lee, Jieun; Jung, Kyoungho; Jeong, Moonyoung; Yamada, Satoru; Kang, Hee Jae; Choi, Byoung-Deog

    2017-01-01

    We demonstrated that a flat band voltage (VFB) shift could be controlled in TiN/(LaO or ZrO)/SiO2 stack structures. The VFB shift described in term of metal diffusion into the TiN film and silicate formation in the inserted (LaO or ZrO)/SiO2 interface layer. The metal doping and silicate formation confirmed by using transmission electron microscopy (TEM) and energy dispersive spectroscopy (EDS) line profiling, respectively. The direct work function measurement technique allowed us to make direct estimate of a variety of flat band voltages (VFB). As a function of composition ratio of La or Zr to Ti in the region of a TiN/(LaO or ZrO)/SiO2/Si stack, direct work function modulation driven by La and Zr doping was confirmed with the work functions obtained from the cutoff value of secondary electron emission by auger electron spectroscopy (AES). We also suggested an analytical method to determine the interface dipole via work function depth profiling. PMID:28252013

  15. Effects of Gate Stack Structural and Process Defectivity on High-k Dielectric Dependence of NBTI Reliability in 32 nm Technology Node PMOSFETs

    PubMed Central

    Hussin, H.; Soin, N.; Bukhori, M. F.; Wan Muhamad Hatta, S.; Abdul Wahab, Y.

    2014-01-01

    We present a simulation study on negative bias temperature instability (NBTI) induced hole trapping in E′ center defects, which leads to depassivation of interface trap precursor in different geometrical structures of high-k PMOSFET gate stacks using the two-stage NBTI model. The resulting degradation is characterized based on the time evolution of the interface and hole trap densities, as well as the resulting threshold voltage shift. By varying the physical thicknesses of the interface silicon dioxide (SiO2) and hafnium oxide (HfO2) layers, we investigate how the variation in thickness affects hole trapping/detrapping at different stress temperatures. The results suggest that the degradations are highly dependent on the physical gate stack parameters for a given stress voltage and temperature. The degradation is more pronounced by 5% when the thicknesses of HfO2 are increased but is reduced by 11% when the SiO2 interface layer thickness is increased during lower stress voltage. However, at higher stress voltage, greater degradation is observed for a thicker SiO2 interface layer. In addition, the existence of different stress temperatures at which the degradation behavior differs implies that the hole trapping/detrapping event is thermally activated. PMID:25221784

  16. Sobol's sensitivity analysis for a fuel cell stack assembly model with the aid of structure-selection techniques

    NASA Astrophysics Data System (ADS)

    Zhang, Wei; Cho, Chongdu; Piao, Changhao; Choi, Hojoon

    2016-01-01

    This paper presents a novel method for identifying the main parameters affecting the stress distribution of the components used in assembly modeling of proton exchange membrane fuel cell (PEMFC) stack. This method is a combination of an approximation model and Sobol's method, which allows a fast global sensitivity analysis for a set of uncertain parameters using only a limited number of calculations. Seven major parameters, i.e., Young's modulus of the end plate and the membrane electrode assembly (MEA), the contact stiffness between the MEA and bipolar plate (BPP), the X and Y positions of the bolts, the pressure of each bolt, and the thickness of the end plate, are investigated regarding their effect on four metrics, i.e., the maximum stresses of the MEA, BPP, and end plate, and the stress distribution percentage of the MEA. The analysis reveals the individual effects of each parameter and its interactions with the other parameters. The results show that the X position of a bolt has a major influence on the maximum stresses of the BPP and end plate, whereas the thickness of the end plate has the strongest effect on both the maximum stress and the stress distribution percentage of the MEA.

  17. Two-dimensionally stacked heterometallic layers hosting a discrete chair dodecameric ring of water clusters: synthesis and structural study.

    PubMed

    Kenfack Tsobnang, Patrice; Wenger, Emmanuel; Biache, Coralie; Lambi Ngolui, John; Ponou, Siméon; Dahaoui, Slimane; Lecomte, Claude

    2014-10-01

    The stacked two-dimensional supramolecular compound catena-{Co(amp)3Cr(ox)3·6H2O} (amp = 2-picolylamine, ox = oxalate) has been synthesized from the bimolecular approach using hydrogen bonds. It is built from layers in which both Co(amp)(3+) (D) and Cr(ox)(3-) (A) ions are bonded in a repeating DADADA… pattern along the a and c axes by multiple hydrogen bonds. These layers host a well resolved R12 dodecameric discrete ring of water clusters built by six independent molecules located around the 2c centrosymmetric Wyckoff positions of the P21/n space group in which the compound crystallizes. These clusters are ranged along the [001] direction, occupy 733.5 Å(3) (22.0%) of the unit cell and have a chair conformation via 12 hydrogen bonds. The water molecules of the cluster are linked with stronger hydrogen bonds than those between the cluster and its host, which explains the single continuous step of the dehydration process of the compound.

  18. Biodegradable Mg-Zn-Y alloys with long-period stacking ordered structure: optimization for mechanical properties.

    PubMed

    Zhao, Xu; Shi, Ling-ling; Xu, Jian

    2013-02-01

    To optimize the mechanical properties for biodegradable orthopedic implant, microstructures and tensile properties of Mg-Zn-Y alloys containing long period stacking ordered (LPSO) phase were investigated. For the as-cast Mg(100-3x)(Zn(1)Y(2))(x) (1 ≤ x ≤ 3) alloys, volume fraction of 18R LPSO phase increases with increasing the contents of Zn and Y. Mg(97)Zn(1)Y(2) alloy exhibits the optimal combination of strength and plasticity. Substitution of bioactive element Ca for Y in the Mg(97)Zn(1)Y(2) does not favor the formation of LPSO phase, but involving the formation of Mg(2)Ca phase. By micro-alloying with Zr as grain refinement agent, morphology of α-Mg in the Mg(96.83)Zn(1)Y(2)Zr(0.17) alloy is changed into the equiaxial shape, together with a significant refinement in grain size to 30 μm. It brings about an improvement not only in strength but also in plasticity, in contrast to the Zr-free alloy. In comparison with the as-cast state, warm-extruded alloys manifest significantly improved properties not only in strength but also in plasticity due to the refinement of α-Mg grain by dynamic recrystallization and the alignment of LPSO phase along extrusion direction.

  19. Effect of Thermal Budget on the Electrical Characterization of Atomic Layer Deposited HfSiO/TiN Gate Stack MOSCAP Structure.

    PubMed

    Khan, Z N; Ahmed, S; Ali, M

    2016-01-01

    Metal Oxide Semiconductor (MOS) capacitors (MOSCAP) have been instrumental in making CMOS nano-electronics realized for back-to-back technology nodes. High-k gate stacks including the desirable metal gate processing and its integration into CMOS technology remain an active research area projecting the solution to address the requirements of technology roadmaps. Screening, selection and deposition of high-k gate dielectrics, post-deposition thermal processing, choice of metal gate structure and its post-metal deposition annealing are important parameters to optimize the process and possibly address the energy efficiency of CMOS electronics at nano scales. Atomic layer deposition technique is used throughout this work because of its known deposition kinetics resulting in excellent electrical properties and conformal structure of the device. The dynamics of annealing greatly influence the electrical properties of the gate stack and consequently the reliability of the process as well as manufacturable device. Again, the choice of the annealing technique (migration of thermal flux into the layer), time-temperature cycle and sequence are key parameters influencing the device's output characteristics. This work presents a careful selection of annealing process parameters to provide sufficient thermal budget to Si MOSCAP with atomic layer deposited HfSiO high-k gate dielectric and TiN gate metal. The post-process annealing temperatures in the range of 600°C -1000°C with rapid dwell time provide a better trade-off between the desirable performance of Capacitance-Voltage hysteresis and the leakage current. The defect dynamics is thought to be responsible for the evolution of electrical characteristics in this Si MOSCAP structure specifically designed to tune the trade-off at low frequency for device application.

  20. Effect of Thermal Budget on the Electrical Characterization of Atomic Layer Deposited HfSiO/TiN Gate Stack MOSCAP Structure

    PubMed Central

    Khan, Z. N.; Ahmed, S.; Ali, M.

    2016-01-01

    Metal Oxide Semiconductor (MOS) capacitors (MOSCAP) have been instrumental in making CMOS nano-electronics realized for back-to-back technology nodes. High-k gate stacks including the desirable metal gate processing and its integration into CMOS technology remain an active research area projecting the solution to address the requirements of technology roadmaps. Screening, selection and deposition of high-k gate dielectrics, post-deposition thermal processing, choice of metal gate structure and its post-metal deposition annealing are important parameters to optimize the process and possibly address the energy efficiency of CMOS electronics at nano scales. Atomic layer deposition technique is used throughout this work because of its known deposition kinetics resulting in excellent electrical properties and conformal structure of the device. The dynamics of annealing greatly influence the electrical properties of the gate stack and consequently the reliability of the process as well as manufacturable device. Again, the choice of the annealing technique (migration of thermal flux into the layer), time-temperature cycle and sequence are key parameters influencing the device’s output characteristics. This work presents a careful selection of annealing process parameters to provide sufficient thermal budget to Si MOSCAP with atomic layer deposited HfSiO high-k gate dielectric and TiN gate metal. The post-process annealing temperatures in the range of 600°C -1000°C with rapid dwell time provide a better trade-off between the desirable performance of Capacitance-Voltage hysteresis and the leakage current. The defect dynamics is thought to be responsible for the evolution of electrical characteristics in this Si MOSCAP structure specifically designed to tune the trade-off at low frequency for device application. PMID:27571412

  1. Receiver-Function Stacking Methods to Infer Crustal Anisotropic Structure with Application to the Turkish-Anatolian Plateau

    NASA Astrophysics Data System (ADS)

    Kaviani, A.; Rumpker, G.

    2015-12-01

    To account for the presence of seismic anisotropy within the crust and to estimate the relevant parameters, we first discuss a robust technique for the analysis of shear-wave splitting in layered anisotropic media by using converted shear phases. We use a combined approach that involves time-shifting and stacking of radial receiver functions and energy-minimization of transverse receiver functions to constrain the splitting parameters (i.e. the fast-polarization direction and the delay time) for an anisotropic layer. In multi-layered anisotropic media, the splitting parameters for the individual layers can be inferred by a layer-stripping approach, where the splitting effects due to shallower layers on converted phases from deeper discontinuities are successively corrected. The effect of anisotropy on the estimates of crustal thickness and average bulk Vp/Vs ratio can be significant. Recently, we extended the approach of Zhu & Kanamori (2000) to include P-to-S converted waves and their crustal reverberations generated in the anisotropic case. The anisotropic parameters of the medium are first estimated using the splitting analysis of the Ps-phase as described above. Then, a grid-search is performed over layer thickness and Vp/Vs ratio, while accounting for all relevant arrivals (up to 20 phases) in the anisotropic medium. We apply these techniques to receiver-function data from seismological stations across the Turkish-Anatolian Plateau to study seismic anisotropy in the crust and its relationship to crustal tectonics. Preliminary results reveal significant crustal anisotropy and indicate that the strength and direction of the anisotropy vary across the main tectonic boundaries. We also improve the estimates of the crustal thickness and the bulk Vp/Vs ratio by accounting for the presence of crustal anisotropy beneath the station. ReferenceZhu, L. & H. Kanamori (2000), Moho depth variation in southern California from teleseismic receiver functions, J. Geophys. Res

  2. An empirical potential approach to the structural stability of InAs stacking-fault tetrahedron in InAs/GaAs(1 1 1)

    NASA Astrophysics Data System (ADS)

    Joe, Hidenori; Akiyama, Toru; Nakamura, Kohji; Kanisawa, Kiyoshi; Ito, Tomonori

    2007-04-01

    The structural stability of InAs stacking-fault tetrahedron (SFT) in InAs/GaAs (1 1 1) is theoretically investigated. Using an empirical interatomic potential, cohesive energies are calculated for the three types of InAs/GaAs(1 1 1) system where coherent InAs and relaxed InAs with the SFT and misfit dislocations (MDs). The calculated results reveal that InAs with the SFT is more favorable beyond the film thickness of 21 monolayers (MLs) than coherent InAs. The critical film thickness of 21 ML is comparable with that of 8 ML for the MDs generation. This suggests that the SFT appears in InAs thin film layers instead of MDs resulting from lowering the strain energy accumulated in InAs thin film layers.

  3. Stack gas treatment

    DOEpatents

    Reeves, Adam A.

    1977-04-12

    Hot stack gases transfer contained heat to a gravity flow of pebbles treated with a catalyst, cooled stacked gases and a sulfuric acid mist is withdrawn from the unit, and heat picked up by the pebbles is transferred to air for combustion or other process. The sulfuric acid (or sulfur, depending on the catalyst) is withdrawn in a recovery unit.

  4. Red Mud Stacking

    NASA Astrophysics Data System (ADS)

    Bélanger, Marie-J.

    The red mud slurry "stacking" method used in many Alcan Plants has been developed in the 1980's. The aim of this technique is to use minimum space for the disposal of the residue and to rapidly obtain consolidated material. The consistency of the mud slurry plays a key role in the steepness (angle) of the stacking slope.

  5. First-principles investigation of strain effects on the stacking fault energies, dislocation core structure, and Peierls stress of magnesium and its alloys

    NASA Astrophysics Data System (ADS)

    Zhang, S. H.; Beyerlein, I. J.; Legut, D.; Fu, Z. H.; Zhang, Z.; Shang, S. L.; Liu, Z. K.; Germann, T. C.; Zhang, R. F.

    2017-06-01

    Taking pure Mg, Mg-Al, and Mg-Zn as prototypes, the effects of strain on the stacking fault energies (SFEs), dislocation core structure, and Peierls stress were systematically investigated by means of density functional theory and the semidiscrete variational Peierls-Nabarro model. Our results suggest that volumetric strain may significantly influence the values of SFEs of both pure Mg and its alloys, which will eventually modify the dislocation core structure, Peierls stress, and preferred slip system, in agreement with recent experimental results. The so-called "strain factor" that was previously proposed for the solute strengthening could be justified as a major contribution to the strain effect on SFEs. Based on multivariate regression analysis, we proposed universal exponential relationships between the dislocation core structure, the Peierls stress, and the stable or unstable SFEs. Electronic structure calculations suggest that the variations of these critical parameters controlling strength and ductility under strain can be attributed to the strain-induced electronic polarization and redistribution of valence charge density at hollow sites. These findings provide a fundamental basis for tuning the strain effect to design novel Mg alloys with both high strength and ductility.

  6. Evolution of lateral structures during the functional stack build-up of P3HT:PCBM-based bulk heterojunction solar cells.

    PubMed

    Guo, Shuai; Ruderer, Matthias A; Rawolle, Monika; Körstgens, Volker; Birkenstock, Christopher; Perlich, Jan; Müller-Buschbaum, Peter

    2013-09-11

    Bulk heterojunction (BHJ) solar cells from 1,2-dichlorobenzene solution processed regioregular poly(3-hexylthiophene-2,5-diyl) (P3HT): phenyl-C61-butyric acid methyl ester (PCBM) are prepared and investigated at different steps of the multilayer stack build-up of the device. The inner structure is probed from the molecular to the mesoscale with grazing incidence small/wide-angle X-ray scattering (GISAXS/GIWAXS) and X-ray reflectivity (XRR). The surface morphology is detected with atomic force microscopy (AFM). Therefore, an in-depth knowledge of the three-dimensional morphology of the bulk heterojunction solar cell, starting from the cleaned ITO substrate up to the final post-treated solar cell, is generated. The active layer structure is influenced by the annealing as well as by the top contact deposition. Structures coarsen during the evaporation of the metal contacts. The P3HT crystal structure strongly depends on the device processing as well. These morphological changes together with the diffusion of aluminum atoms to the active layer are of importance for the device efficiency.

  7. Discrete stacking of aromatic oligoamide macrocycles.

    PubMed

    Wu, Xiangxiang; Liu, Rui; Sathyamoorthy, Bharathwaj; Yamato, Kazuhiro; Liang, Guoxing; Shen, Lin; Ma, Sufang; Sukumaran, Dinesh K; Szyperski, Thomas; Fang, Weihai; He, Lan; Chen, Xuebo; Gong, Bing

    2015-05-13

    Unlike the precise structural control typical of closed assemblies, curbing the stacking of disc- and ring-shaped molecules is quite challenging. Here we report the discrete stacking of rigid aromatic oligoamide macrocycles 1. With increasing concentration, the aggregation of 1 quickly plateaus, forming a discrete oligomer, as suggested by 1D (1)H, 2D nuclear Overhauser effect, and diffusion-ordered NMR spectroscopy. Quantum-chemical calculations indicate that the tetramer of 1 is the most stable among oligomeric stacks. X-ray crystallography revealed a tetrameric stack containing identical molecules adopting two different conformations. With a defined length and an inner pore capable of accommodating distinctly different guests, the tetramers of 1 densely pack into 2D layers. Besides being a rare system of conformation-regulated supramolecular oligomerization, the discrete stacks of 1, along with their higher-order assemblies, may offer new nanotechnological applications.

  8. A series of Cd(II) complexes with {pi}-{pi} stacking and hydrogen bonding interactions: Structural diversities by varying the ligands

    SciTech Connect

    Wang Xiuli; Zhang Jinxia; Liu Guocheng; Lin Hongyan

    2011-02-15

    Seven new Cd(II) complexes consisting of different phenanthroline derivatives and organic acid ligands, formulated as [Cd(PIP){sub 2}(dnba){sub 2}] (1), [Cd(PIP)(ox)].H{sub 2}O (2), [Cd(PIP)(1,4-bdc)(H{sub 2}O)].4H{sub 2}O (3), [Cd(3-PIP){sub 2}(H{sub 2}O){sub 2}].4H{sub 2}O (4), [Cd{sub 2}(3-PIP){sub 4}(4,4'-bpdc)(H{sub 2}O){sub 2}].5H{sub 2}O (5), [Cd(3-PIP)(nip)(H{sub 2}O)].H{sub 2}O (6), [Cd{sub 2}(TIP){sub 4}(4,4'-bpdc)(H{sub 2}O){sub 2}].3H{sub 2}O (7) (PIP=2-phenylimidazo[4,5-f]1,10-phenanthroline, 3-PIP=2-(3-pyridyl)imidazo[4,5-f]1,10-phenanthroline, TIP=2-(2-thienyl)imidazo[4,5-f]1,10-phenanthroline, Hdnba=3,5-dinitrobenzoic acid, H{sub 2}ox=oxalic acid, 1,4-H{sub 2}bdc=benzene-1,4-dicarboxylic acid, 4,4'-H{sub 2}bpdc=biphenyl-4,4'-dicarboxylic acid, H{sub 2}nip=5-nitroisophthalic acid) have been synthesized under hydrothermal conditions. Complexes 1 and 4 possess mononuclear structures; complexes 5 and 7 are isostructural and have dinuclear structures; complexes 2 and 3 feature 1D chain structures; complex 6 contains 1D double chain, which are further extended to a 3D supramolecular structure by {pi}-{pi} stacking and hydrogen bonding interactions. The N-donor ligands with extended {pi}-system and organic acid ligands play a crucial role in the formation of the final supramolecular frameworks. Moreover, thermal properties and fluorescence of 1-7 are also investigated. -- Graphical abstract: Seven new supramolecular architectures have been successfully isolated under hydrothermal conditions by reactions of different phen derivatives and Cd(II) salts together with organic carboxylate anions auxiliary ligands. Display Omitted Research highlights: {yields} Complexes 1-7 are 0D or 1D polymeric structure, the {pi}-{pi} stacking and H-bonding interactions extend the complexes into 3D supramolecular network. To our knowledge, systematic study on {pi}-{pi} stacking and H-bonding interactions in cadmium(II) complexes are still limited. {yields} The structural

  9. Supramolecular self-assembly of a coumarine-based acylthiourea synthon directed by π-stacking interactions: Crystal structure and Hirshfeld surface analysis

    NASA Astrophysics Data System (ADS)

    Saeed, Aamer; Ashraf, Saba; Flörke, Ulrich; Delgado Espinoza, Zuly Yuliana; Erben, Mauricio F.; Pérez, Hiram

    2016-05-01

    The structure of 1-(2-oxo-2H-chromene-3-carbonyl)-3-(2-methoxy-phenyl)thiourea (1) has been determined by single-crystal X-ray crystallography. This compound crystallizes in the monoclinic space group P21/c with a = 7.455 (2) Å, b = 12.744 (3) Å, c = 16.892 (4) Å, β = 90.203 (6)° and Z = 4. Both, the coumarin and the phenyl rings are nearly coplanar with the central 1-acylthiourea group, with the Cdbnd O and Cdbnd S bonds adopting an opposite orientation. Intramolecular N-H···O, C-H···O, and C-H···S hydrogen bonds are favored by the planar conformation. The molecules are packed through C-H···O, C-H···S and C-H···C hydrogen bonds, and two π···π interactions with offset arrangement. Inter-centroid distance of 3.490 (2) Å, slip angles of 18.5 and 20.9°, and vertical displacements of 1.10 and 1.24 Å are the stacking parameters corresponding to the stronger π···π interaction. Hirshfeld surface analysis was performed for visualizing, exploring and quantifying intermolecular interactions in the crystal lattice of compound 1, and compared with two closely related species. Shape index and Curvedness surfaces indicated π-stacking with different features in opposed sides of the molecule. Fingerprint plot showed C···C contacts with similar contributions to the crystal packing in comparison with those associated to hydrogen bonds. Enrichment ratios for H···H, O···H, S···H and C···C contacts revealed a high propensity to form in the crystal.

  10. Crustal Velocity Structure beneath Wonju, Korea Using the H-? Stacking Method and Joint Inversion of Receiver Functions and Surface-wave Dispersion Curves

    NASA Astrophysics Data System (ADS)

    Jeon, T.; Park, Y.; Kang, I.; Kim, K. Y.

    2013-12-01

    To estimate the crustal and upper mantle velocity structure beneath Wonju in the central part of the Korean peninsula, we applied the H-κ stacking method and a joint inversion of the receiver functions and surface-wave dispersion curves using 1,860 teleseismic events (Mw ≥5.5) observed between October 2002 and November 2009 on a Korea Seismic Research Station (KSRS) broadband station, KS31. KSRS is a primary station of the Comprehensive Nuclear-Test-Ban Treaty Organization designated as PS31. Both methods were applied for eight ranges of back-azimuths to estimate crustal VP/VS ratios and Moho depths. In the H-κ stacking method, we determined that the average depth to a nearly flat Moho is 32.4 × 0.5 km within a 7.6 to 16.5 km radius of the seismic station with an estimated average ratio of P- to S-wave velocities of 1.72 × 0.04. Assuming VP of the average crustal P wave equal to 6.3 km/s gave reliable results. In the joint inversion, we estimated the Moho depth is 32 km in average of eight groups and Low Velocity Layer is between 6 and 12 km. A negative phase in the receiver functions at 1 s indicates the presence of a shear-wave low velocity layer in a depth interval of 10 to 18 km in the upper crust beneath the KS31 station. Fig. 1. Plot of inversion results of each group. Average of results represent a Moho discontinuity at 32 km and LVL between 6 and 12 km.

  11. Guanine base stacking in G-quadruplex nucleic acids

    PubMed Central

    Lech, Christopher Jacques; Heddi, Brahim; Phan, Anh Tuân

    2013-01-01

    G-quadruplexes constitute a class of nucleic acid structures defined by stacked guanine tetrads (or G-tetrads) with guanine bases from neighboring tetrads stacking with one another within the G-tetrad core. Individual G-quadruplexes can also stack with one another at their G-tetrad interface leading to higher-order structures as observed in telomeric repeat-containing DNA and RNA. In this study, we investigate how guanine base stacking influences the stability of G-quadruplexes and their stacked higher-order structures. A structural survey of the Protein Data Bank is conducted to characterize experimentally observed guanine base stacking geometries within the core of G-quadruplexes and at the interface between stacked G-quadruplex structures. We couple this survey with a systematic computational examination of stacked G-tetrad energy landscapes using quantum mechanical computations. Energy calculations of stacked G-tetrads reveal large energy differences of up to 12 kcal/mol between experimentally observed geometries at the interface of stacked G-quadruplexes. Energy landscapes are also computed using an AMBER molecular mechanics description of stacking energy and are shown to agree quite well with quantum mechanical calculated landscapes. Molecular dynamics simulations provide a structural explanation for the experimentally observed preference of parallel G-quadruplexes to stack in a 5′–5′ manner based on different accessible tetrad stacking modes at the stacking interfaces of 5′–5′ and 3′–3′ stacked G-quadruplexes. PMID:23268444

  12. The influence of the stacking orientation of C and BN stripes in the structure, energetics, and electronic properties of BC2N nanotubes

    NASA Astrophysics Data System (ADS)

    Machado, M.; Kar, T.; Piquini, P.

    2011-05-01

    Carbon and boron nitride nanotubes present significant differences in their electronics. However, they have isoelectronic bonds and very similar geometrical structures that allow BCN nanotubes to be synthesized. These BCN nanotubes present properties that can vary according to their relative number of B, C, and N atoms, and their atomic distribution on the nanotube surface. Here we employ first-principles density functional theory to study BCN nanotubes with BC2N stoichiometry. These nanotubes are composed of pure BN and C stripes which are stacked (i) in parallel, (ii) perpendicularly, and (iii) forming helicoidal patterns along the nanotube axes. We found that the different strain energies of the curved C and BN arcs in the nanotubes with parallelly aligned stripes can lead to geometries that deviate significantly from the usual circular shape. A sinusoidal shape was predicted for a BC2N nanotube with a helicoidal arrangement of the C and BN stripes due to differences in the C-B and C-N bonds parallel to the tube axis. It was shown that the phase segregation is energetically favoured. Such structural preference and the relative stability of the BC2N nanotubes can be explained in terms of the ratio between the total number of bonds and the number of C-B and C-N bonds in the nanotubes. Finally, we found that one type of BC2N nanotube with helicoidal C and BN stripes, although having a zigzag structure, exhibits a metallic character.

  13. Evolution of magnetic layers stacking sequence within the magnetic structure of Ho(CoxNi1-x)2B2C

    NASA Astrophysics Data System (ADS)

    ElMassalami, M.; Takeya, H.; Ouladdiaf, B.; Gomes, A. M.; Paiva, T.; dos Santos, R. R.

    2014-12-01

    We evaluated the influence of Co substitution on the magnetic structure of Ho(CoxNi1-x)2B2C (x=0.2, 0.4, 0.6, 0.8) using neutron diffraction, magnetization and specific heat studies. Different modes are stabilized: an AFM k=(0,0,1) mode for x=0.2, a spiral k=(0,0,0.49) mode for x=0.4, a spiral k=(0,0,0.26) mode for x=0.6, and a FM k=(0,0,0) mode for x=0.8. Recalling that for x=0.0, k=(0,0,1) while for x=1.0, k=(0,0,0), then all these magnetic structures can be visualized as a variation in the stacking sequence, along the z-axis, of the intra-planar FM-coupled Ho sheets as such Co substitution controls the z-component of the k=(0,0,ux) vector where ux=0,0.26,0.49, or 1. We discuss this inference and the observation that in spite of such a diversity of magnetic structures, the critical temperatures and the saturated moments are only weakly influenced by substitution.

  14. The Four Canonical TPR Subunits of Human APC/C Form Related Homo-Dimeric Structures and Stack in Parallel to Form a TPR Suprahelix☆

    PubMed Central

    Zhang, Ziguo; Chang, Leifu; Yang, Jing; Conin, Nora; Kulkarni, Kiran; Barford, David

    2013-01-01

    The anaphase-promoting complex or cyclosome (APC/C) is a large E3 RING-cullin ubiquitin ligase composed of between 14 and 15 individual proteins. A striking feature of the APC/C is that only four proteins are involved in directly recognizing target proteins and catalyzing the assembly of a polyubiquitin chain. All other subunits, which account for > 80% of the mass of the APC/C, provide scaffolding functions. A major proportion of these scaffolding subunits are structurally related. In metazoans, there are four canonical tetratricopeptide repeat (TPR) proteins that form homo-dimers (Apc3/Cdc27, Apc6/Cdc16, Apc7 and Apc8/Cdc23). Here, we describe the crystal structure of the N-terminal homo-dimerization domain of Schizosaccharomyces pombe Cdc23 (Cdc23Nterm). Cdc23Nterm is composed of seven contiguous TPR motifs that self-associate through a related mechanism to those of Cdc16 and Cdc27. Using the Cdc23Nterm structure, we generated a model of full-length Cdc23. The resultant “V”-shaped molecule docks into the Cdc23-assigned density of the human APC/C structure determined using negative stain electron microscopy (EM). Based on sequence conservation, we propose that Apc7 forms a homo-dimeric structure equivalent to those of Cdc16, Cdc23 and Cdc27. The model is consistent with the Apc7-assigned density of the human APC/C EM structure. The four canonical homo-dimeric TPR proteins of human APC/C stack in parallel on one side of the complex. Remarkably, the uniform relative packing of neighboring TPR proteins generates a novel left-handed suprahelical TPR assembly. This finding has implications for understanding the assembly of other TPR-containing multimeric complexes. PMID:23583778

  15. Hen Egg-White Lysozyme Crystallisation: Protein Stacking and Structure Stability Enhanced by a Tellurium(VI)-Centred Polyoxotungstate

    PubMed Central

    Bijelic, Aleksandar; Molitor, Christian; Mauracher, Stephan G; Al-Oweini, Rami; Kortz, Ulrich; Rompel, Annette

    2015-01-01

    As synchrotron radiation becomes more intense, detectors become faster and structure-solving software becomes more elaborate, obtaining single crystals suitable for data collection is now the bottleneck in macromolecular crystallography. Hence, there is a need for novel and advanced crystallisation agents with the ability to crystallise proteins that are otherwise challenging. Here, an Anderson–Evans-type polyoxometalate (POM), specifically Na6[TeW6O24]⋅22 H2O (TEW), is employed as a crystallisation additive. Its effects on protein crystallisation are demonstrated with hen egg-white lysozyme (HEWL), which co-crystallises with TEW in the vicinity (or within) the liquid–liquid phase separation (LLPS) region. The X-ray structure (PDB ID: 4PHI) determination revealed that TEW molecules are part of the crystal lattice, thus demonstrating specific binding to HEWL with electrostatic interactions and hydrogen bonds. The negatively charged TEW polyoxotungstate binds to sites with a positive electrostatic potential located between two (or more) symmetry-related protein chains. Thus, TEW facilitates the formation of protein–protein interfaces of otherwise repulsive surfaces, and thereby the realisation of a stable crystal lattice. In addition to retaining the isomorphicity of the protein structure, the anomalous scattering of the POMs was used for macromolecular phasing. The results suggest that hexatungstotellurate(VI) has great potential as a crystallisation additive to promote both protein crystallisation and structure elucidation. PMID:25521080

  16. Hen egg-white lysozyme crystallisation: protein stacking and structure stability enhanced by a Tellurium(VI)-centred polyoxotungstate.

    PubMed

    Bijelic, Aleksandar; Molitor, Christian; Mauracher, Stephan G; Al-Oweini, Rami; Kortz, Ulrich; Rompel, Annette

    2015-01-19

    As synchrotron radiation becomes more intense, detectors become faster and structure-solving software becomes more elaborate, obtaining single crystals suitable for data collection is now the bottleneck in macromolecular crystallography. Hence, there is a need for novel and advanced crystallisation agents with the ability to crystallise proteins that are otherwise challenging. Here, an Anderson-Evans-type polyoxometalate (POM), specifically Na6 [TeW6 O24 ]⋅22 H2 O (TEW), is employed as a crystallisation additive. Its effects on protein crystallisation are demonstrated with hen egg-white lysozyme (HEWL), which co-crystallises with TEW in the vicinity (or within) the liquid-liquid phase separation (LLPS) region. The X-ray structure (PDB ID: 4PHI) determination revealed that TEW molecules are part of the crystal lattice, thus demonstrating specific binding to HEWL with electrostatic interactions and hydrogen bonds. The negatively charged TEW polyoxotungstate binds to sites with a positive electrostatic potential located between two (or more) symmetry-related protein chains. Thus, TEW facilitates the formation of protein-protein interfaces of otherwise repulsive surfaces, and thereby the realisation of a stable crystal lattice. In addition to retaining the isomorphicity of the protein structure, the anomalous scattering of the POMs was used for macromolecular phasing. The results suggest that hexatungstotellurate(VI) has great potential as a crystallisation additive to promote both protein crystallisation and structure elucidation.

  17. Molten carbonate fuel cell stack design options

    NASA Astrophysics Data System (ADS)

    Benjamin, T. G.; Petri, R. J.

    Significant strides in molten carbonate fuel cell (MCFC) life and performance were made duing the last 20 years. Results include single cell performance improvement from 10 watts/sq ft to 120 watts/sq ft, testing of several subscale stacks, and significant reductions in cost. In the 1980s, attention has turned toward stack related issues including component dimensional and structural stability, cathode dissolution, sulfur poisoning, hardware design, electrolyte management, carbon dioxide conservation, internal reforming, and systems considerations. The MCFC stack hardware design options are discussed and a brief introduction to MCFC technology is presented.

  18. Stacked base-pair structures of adenine nucleosides stabilized by the formation of hydrogen-bonding network involving the two sugar groups

    NASA Astrophysics Data System (ADS)

    Asami, Hiroya; Yagi, Kiyoshi; Ohba, Masashi; Urashima, Shu-hei; Saigusa, Hiroyuki

    2013-06-01

    We have employed a laser desorption technique combined with supersonic-jet cooling for producing base pairs of adenine nucleosides, adenosine (Ado) and N6,N6-dimethyladenosine (DMAdo) under low-temperature conditions. The resulting base pairs are then ionized through resonant two-photon ionization (R2PI) and analyzed by time-of-flight mass spectrometry. It is found that dimers of these adenine nucleosides are stable, especially in the case of DMAdo, with respect to those of the corresponding bases, i.e., adenine and N6,N6-dimethyladenine. Structural analysis of the DMAdo dimer is performed based on the IR-UV double resonance measurements and theoretical calculations. The result demonstrates that the dimer possesses a stacked structure being stabilized by the formation of hydrogen-bonding network involving the two sugar groups. The occurrence of the frequency shift and broadening is explained satisfactorily based on the anharmonic coupling of the OH stretching modes with specific bending modes and low-frequency modes of base and sugar moieties.

  19. Stacks of Light

    NASA Image and Video Library

    2007-10-25

    These two images show tacked Chandra images for two different classes of distant, massive galaxy detected with NASA Spitzer. Image stacking is a procedure used to detect emission from objects that is too faint to be detected in single images.

  20. PAM stack test utility

    SciTech Connect

    Grondona, Mark A.

    2007-08-22

    The pamtest utility calls the normal PAM hooks using a service and username supplied on the command line. This allows an administratory to test any one of many configured PAM stacks as any existing user on the machine.

  1. Relationship between structural changes, hydrogen content and annealing in stacks of ultrathin Si/Ge amorphous layers

    PubMed Central

    2011-01-01

    Hydrogenated multilayers (MLs) of a-Si/a-Ge have been analysed to establish the reasons of H release during annealing that has been seen to bring about structural modifications even up to well-detectable surface degradation. Analyses carried out on single layers of a-Si and a-Ge show that H is released from its bond to the host lattice atom and that it escapes from the layer much more efficiently in a-Ge than in a-Si because of the smaller binding energy of the H-Ge bond and probably of a greater weakness of the Ge lattice. This should support the previous hypothesis that the structural degradation of a-Si/a-Ge MLs primary starts with the formation of H bubbles in the Ge layers. PMID:21711697

  2. Relationship between structural changes, hydrogen content and annealing in stacks of ultrathin Si/Ge amorphous layers.

    PubMed

    Frigeri, Cesare; Serényi, Miklós; Khánh, Nguyen Quoc; Csik, Attila; Riesz, Ferenc; Erdélyi, Zoltán; Nasi, Lucia; Beke, Dezső László; Boyen, Hans-Gerd

    2011-03-01

    Hydrogenated multilayers (MLs) of a-Si/a-Ge have been analysed to establish the reasons of H release during annealing that has been seen to bring about structural modifications even up to well-detectable surface degradation. Analyses carried out on single layers of a-Si and a-Ge show that H is released from its bond to the host lattice atom and that it escapes from the layer much more efficiently in a-Ge than in a-Si because of the smaller binding energy of the H-Ge bond and probably of a greater weakness of the Ge lattice. This should support the previous hypothesis that the structural degradation of a-Si/a-Ge MLs primary starts with the formation of H bubbles in the Ge layers.

  3. Stacked Buoyant Payload Launcher

    DTIC Science & Technology

    2013-05-14

    reserved for undersea launched missiles. Underwater deployment of smaller payloads has been limited to ejection from torpedo tubes, the trash disposal...COVERED 00-00-2014 to 00-00-2014 4. TITLE AND SUBTITLE Stacked Buoyant Payload Launcher 5a. CONTRACT NUMBER 5b. GRANT NUMBER 5c. PROGRAM...1 of 11 STACKED BUOYANT PAYLOAD LAUNCHER STATEMENT OF GOVERNMENT INTEREST [0001] The invention described herein may be manufactured and

  4. Stacked RADFETs for increased radiation sensitivity

    SciTech Connect

    O`Connell, B.; Kelleher, A.; Lane, W.; Adams, L.

    1996-06-01

    Hitherto, pMOS Radiation Sensitive Field Effect Transistors (RADFETs) have not been able to detect doses in the milli-rad range, which are required for low dose clinical/personnel applications. This paper reports on further investigation of a design approach, where RADFETs are connected in a stacked sequence so that increased radiation sensitivity is obtained. The radiation sensitivity obtained for 40 stacked RADFETs is approximately 220 times the single RADFET sensitivity. This enables radiation sensitivities in the milli-rad range to be measured. Theoretical equations governing the threshold voltage of a MOS device as a function of bulk-source voltage are used to theoretically evaluate the output voltage of the stacked structure. Measurement and theory are found to agree closely in this analysis. Percent drift and % fading of the single RADFET, as a function of total radiation induced shift in V{sub T}, is similar to that of the stacked structure.

  5. Interlocked catenane-like structure predicted in Au24(SR)20: implication to structural evolution of thiolated gold clusters from homoleptic gold(I) thiolates to core-stacked nanoparticles.

    PubMed

    Pei, Yong; Pal, Rhitankar; Liu, Chunyan; Gao, Yi; Zhang, Zhuhua; Zeng, Xiao Cheng

    2012-02-15

    Atomic structure of a recently synthesized ligand-covered cluster Au(24)(SR)(20) [J. Phys. Chem. Lett., 2010, 1, 1003] is resolved based on the developed classical force-field based divide-and-protect approach. The computed UV-vis absorption spectrum and powder X-ray diffraction (XRD) curve for the lowest-energy isomer are in good agreement with experimental measurements. Unique catenane-like staple motifs are predicted for the first time in core-stacked thiolate-group (RS-) covered gold nanoparticles (RS-AuNPs), suggesting the onset of structural transformation in RS-AuNPs at relatively low Au/SR ratio. Since the lowest-energy structure of Au(24)(SR)(20) entails interlocked Au(5)(SR)(4) and Au(7)(SR)(6) oligomers, it supports a recently proposed growth model of RS-AuNPs [J. Phys. Chem. Lett., 2011, 2, 990], that is, Au(n)(SR)(n-1) oligomers are formed during the initial growth of RS-AuNPs. By comparing the Au-core structure of Au(24)(SR)(20) with other structurally resolved RS-AuNPs, we conclude that the tetrahedral Au(4) motif is a prevalent structural unit for small-sized RS-AuNPs with relatively low Au/SR ratio. The structural prediction of Au(24)(SR)(20) offers additional insights into the structural evolution of thiolated gold clusters from homoleptic gold(I) thiolate to core-stacked RS-AuNPs. Specifically, with the increase of interfacial bond length of Au(core)-S in RS-AuNPs, increasingly larger "metallic" Au-core is formed, which results in smaller HOMO-LUMO (or optical) gap. Calculations of electronic structures and UV-vis absorption spectra of Au(24)(SR)(20) and larger RS-AuNPs (up to ~2 nm in size) show that the ligand layer can strongly affect optical absorption behavior of RS-AuNPs.

  6. Wind tunnel investigation of the effect of platform-type structures on dispersion of effluents from short stacks

    SciTech Connect

    Petersen, R.L.

    1986-12-01

    This paper is directed to those persons interested in predicting concentrations downwind of platform-type structures associated with oil or gas facilities that operate on the Outer Continental Shelf. The specific purpose of this study was to determine the effect of platform-type structures on the dispersion of pollutant plumes and to assess the adequacy of the building wake algorithm included in the Offshore and Coastal Dispersion (OCD) Model. To meet the study objectives, a comprehensive wind-tunnel modeling study was conducted. Scale models of three typical oil platforms were positioned in an open-circuit wind tunnel and various source and meteorological conditions were simulated. Concentration and visual measurements were then obtained so that the dispersion characteristics could be quantitatively and qualitatively defined. Prior to conducting the platform wake evaluation, wind tunnel tests were conducted simulating two cases from tracer field experiments conducted in the Gulf of Mexico. The simulations demonstrated that the wind tunnel can adequately simulate dispersion over water.

  7. Stacking fault energy in some single crystals

    NASA Astrophysics Data System (ADS)

    Vora, Aditya M.

    2012-06-01

    The stacking fault energy of single crystals has been reported using the peak shift method. Presently studied all single crystals are grown by using a direct vapor transport (DVT) technique in the laboratory. The structural characterizations of these crystals are made by XRD. Considerable variations are shown in deformation (α) and growth (β) probabilities in single crystals due to off-stoichiometry, which possesses the stacking fault in the single crystal.

  8. Ruthenation of Non‐stacked Guanines in DNA G‐Quadruplex Structures: Enhancement of c‐MYC Expression

    PubMed Central

    Rodríguez, Jéssica; Mosquera, Jesús; Couceiro, José R.

    2016-01-01

    Abstract Guanine quadruplexes (GQs) are compact four‐stranded DNA structures that play a key role in the control of a variety of biological processes, including gene transcription. Bulky ruthenium complexes featuring a bipyridine, a terpyridine, and one exchangeable ligand ([Ru(terpy)(bpy)X]n+) are able to metalate exposed guanines present in the GQ of the c‐MYC promoter region that are not involved in quadruplex base pairing. qRT‐PCR and western‐blot experiments indicated that the complexes promote a remarkable increase in the expression of this oncogene. We also show that exchangeable thioether ligands (X=RSR′, Met) allow regulation of the metalating activity of the complex with visible light. PMID:27860057

  9. Finite-size effects on electronic structure and local properties in passivated AA-stacked bilayer armchair-edge graphene nanoribbons

    NASA Astrophysics Data System (ADS)

    Chen, Xiongwen; Shi, Zhengang; Xiang, Shaohua; Song, Kehui; Zhou, Guanghui

    2017-03-01

    Based on the tight-binding model and dual-probe scanning tunneling microscopy technology, we theoretically investigate the electronic structure and local property in the passivated AA-stacked bilayer armchair-edge graphene nanoribbons (AABLAGNRs). We show that they are highly sensitive to the size of the ribbons, which is evidently different from the single-layer armchair-edge graphene nanoribbons. The ‘3p’ rule only applies to the narrow AABLGNRs. Namely, in the passivated 3p- and (3p  +  1)-AABLGNRs, the narrow ribbons are semiconducting while the medium and wide ribbons are metallic. Although the passivated (3p  +  2)-AABLGNRs are metallic, the ‘3j’ rule only applies to the narrow and medium ribbons. Namely, electrons are in the semiconducting states at sites of line 3j while they are in the metallic states at other sites. This induces a series of parallel and discrete metallic channels, consisting of lines 3j  -  1 and 3j  -  2, for the low-energy electronic transports. In the passivated wide (3p  +  2)-AABLGNRs, all electrons are in the metallic states. Additionally, the ‘3p’ and ‘3j’ rules are controllable to disappear and reappear by applying an external perpendicular electric field. Resultantly, an electric filed-driven current switch can be realized in the passivated narrow and medium (3p  +  2)-AABLGNRs.

  10. Finite-size effects on electronic structure and local properties in passivated AA-stacked bilayer armchair-edge graphene nanoribbons.

    PubMed

    Chen, Xiongwen; Shi, Zhengang; Xiang, Shaohua; Song, Kehui; Zhou, Guanghui

    2017-03-01

    Based on the tight-binding model and dual-probe scanning tunneling microscopy technology, we theoretically investigate the electronic structure and local property in the passivated AA-stacked bilayer armchair-edge graphene nanoribbons (AABLAGNRs). We show that they are highly sensitive to the size of the ribbons, which is evidently different from the single-layer armchair-edge graphene nanoribbons. The '3p' rule only applies to the narrow AABLGNRs. Namely, in the passivated 3p- and (3p  +  1)-AABLGNRs, the narrow ribbons are semiconducting while the medium and wide ribbons are metallic. Although the passivated (3p  +  2)-AABLGNRs are metallic, the '3j' rule only applies to the narrow and medium ribbons. Namely, electrons are in the semiconducting states at sites of line 3j while they are in the metallic states at other sites. This induces a series of parallel and discrete metallic channels, consisting of lines 3j  -  1 and 3j  -  2, for the low-energy electronic transports. In the passivated wide (3p  +  2)-AABLGNRs, all electrons are in the metallic states. Additionally, the '3p' and '3j' rules are controllable to disappear and reappear by applying an external perpendicular electric field. Resultantly, an electric filed-driven current switch can be realized in the passivated narrow and medium (3p  +  2)-AABLGNRs.

  11. Structural and electrical characteristics of ALD-HfO2/n-Si gate stack with SiON interfacial layer for advanced CMOS technology

    NASA Astrophysics Data System (ADS)

    Gupta, Richa; Rajput, Renu; Prasher, Rakesh; Vaid, Rakesh

    2016-09-01

    We report the fabrication of an ultra-thin silicon oxynitride (SiON) as an interfacial layer (IL) for n-Si/ALD-HfO2 gate stack with reduced leakage current. The XRD, AFM, FTIR, FESEM and EDAX characterizations have been performed for structural and morphological studies. Electrical parameters such as dielectric constant (K), interface trap density (Dit), leakage current density (J), effective oxide charge (Qeff), barrier height (Φbo), ideality factor (ƞ), breakdown-voltage (Vbr) and series resistance (Rs) were extracted through C-V, G-V and I-V measurements. The determined values of K, Dit, J, Qeff, Φbo, ƞ, Vbr and Rs are 14.4, 0.5 × 10 11 eV-1 cm-2, 2.2 × 10-9 A/cm2, 0.3 × 1013 cm-2, 0.42, 2.1, -0.33 and 14.5 MΩ respectively. SiON growth prior to HfO2 deposition has curtailed the problem of high leakage current density and interfacial traps due to sufficient amount of N2 incorporated at the interface.

  12. Structural Interpretation of the Large Slowdown of Water Dynamics at Stacked Phospholipid Membranes for Decreasing Hydration Level: All-Atom Molecular Dynamics

    SciTech Connect

    Calero, Carles; Stanley, H.; Franzese, Giancarlo

    2016-04-27

    Hydration water determines the stability and function of phospholipid membranes as well as the interaction of membranes with other molecules. Experiments and simulations have shown that water dynamics slows down dramatically as the hydration decreases, suggesting that the interfacial water that dominates the average dynamics at low hydration is slower than water away from the membrane. Here, based on all-atom molecular dynamics simulations, we provide an interpretation of the slowdown of interfacial water in terms of the structure and dynamics of water–water and water–lipid hydrogen bonds (HBs). We calculate the rotational and translational slowdown of the dynamics of water confined in stacked phospholipid membranes at different levels of hydration, from completely hydrated to poorly hydrated membranes. For all hydrations, we analyze the distribution of HBs and find that water–lipids HBs last longer than water–water HBs and that at low hydration most of the water is in the interior of the membrane. We also show that water–water HBs become more persistent as the hydration is lowered. We attribute this effect (i) to HBs between water molecules that form, in turn, persistent HBs with lipids; (ii) to the hindering of the H-bonding switching between water molecules due to the lower water density at the interface; and (iii) to the higher probability of water–lipid HBs as the hydration decreases. Lastly, our interpretation of the large dynamic slowdown in water under dehydration is potentially relevant in understanding membrane biophysics at different hydration levels.

  13. Photo-induced tunneling currents in MOS structures with various HfO{sub 2}/SiO{sub 2} stacking dielectrics

    SciTech Connect

    Pang, Chin-Sheng; Hwu, Jenn-Gwo

    2014-04-15

    In this study, the current conduction mechanisms of structures with tandem high-k dielectric in illumination are discussed. Samples of Al/SiO{sub 2}/Si (S), Al/HfO{sub 2}/SiO{sub 2}/Si (H), and Al/3HfO{sub 2}/SiO{sub 2}/Si (3H) were examined. The significant observation of electron traps of sample H compares to sample S is found under the double bias capacitance-voltage (C-V) measurements in illumination. Moreover, the photo absorption sensitivity of sample H is higher than S due to the formation of HfO{sub 2} dielectric layer, which leads to larger numbers of carriers crowded through the sweep of V{sub G} before the domination of tunneling current. Additionally, the HfO{sub 2} dielectric layer would block the electrons passing through oxide from valance band, which would result in less electron-hole (e{sup −}-h{sup +}) pairs recombination effect. Also, it was found that both of the samples S and H show perimeter dependency of positive bias currents due to strong fringing field effect in dark and illumination; while sample 3H shows area dependency of positive bias currents in strong illumination. The non-uniform tunneling current through thin dielectric and through HfO{sub 2} stacking layers are importance to MOS(p) tunneling photo diodes.

  14. Composition Control of CuInSe2 Thin Films Using Cu/In Stacked Structure in Coulometric Controlled Electrodeposition Process.

    PubMed

    Kwon, Yong Hun; Do, Hyun Woo; Kim, Hyoungsub; Cho, Hyung Koun

    2015-10-01

    Cu/In bi-metal stacked structures were prepared on Mo coated soda lime glass substrates using electrodeposition method. These metallic precursors were selenized at 550 °C for 60 min to synthesize the CuInSe2 (CIS) thin films in a thermal evaporator chamber with an Se overpressure atmosphere. The composition ratios of CIS thin films were systematically controlled using the coulometric method of the electrodeposition, where the accumulated coulomb of In layers was varied from 1062 to 6375 mC/cm2. As a result, the stoichiometric CIS film was obtained in the Cu/In coulomb ratio of 0.6. Highly crystallized CIS films were produced from the liquid Cu-Se phase in the Cu/In coulomb ratio of ≥0.6. In contrast, the crystallinity and grain size were degraded in the In-rich region. We found that the Cu/In composition ratio of CIS films was linearly proportional to the precursor thickness determined by the coulomb ratio.

  15. Electronic Structure and Charge-Trapping Characteristics of the Al2O3-TiAlO-SiO2 Gate Stack for Nonvolatile Memory Applications

    NASA Astrophysics Data System (ADS)

    Xu, Wenchao; Zhang, Yang; Tang, Zhenjie; Shao, Zhengjie; Zhou, Guofu; Qin, Minghui; Zeng, Min; Wu, Sujuan; Zhang, Zhang; Gao, Jinwei; Lu, Xubing; Liu, Junming

    2017-04-01

    In this work, high- k composite TiAlO film has been investigated as charge-trapping material for nonvolatile memory applications. The annealing formed Al2O3-TiAlO-SiO2 dielectric stack demonstrates significant memory effects and excellent reliability properties. The memory device exhibits a large memory window of 2.6 V under ±8 V sweeping voltage, and it shows only 14% charge loss after more than 10 years' retention, indicating excellent charge retention properties. The electronic structures of the Al2O3-TiAlO-SiO2 have been studied by X-ray photoelectron spectroscopy measurements, and it reveals that the quantum well and the defect traps in TiAlO film can provide a >1.8 eV deep barrier for charge confinement in the TiAlO layer. The mixing between Al2O3 and TiO2 can increase the defects related to the under-coordinated Ti3+ atoms, thereby enhancing the charge-trapping efficiency of the device. Our work implies that high- k TiAlO composite film is promising for applications in future nonvolatile charge-trapping memories.

  16. Structural Interpretation of the Large Slowdown of Water Dynamics at Stacked Phospholipid Membranes for Decreasing Hydration Level: All-Atom Molecular Dynamics.

    PubMed

    Calero, Carles; Stanley, H Eugene; Franzese, Giancarlo

    2016-04-27

    Hydration water determines the stability and function of phospholipid membranes as well as the interaction of membranes with other molecules. Experiments and simulations have shown that water dynamics slows down dramatically as the hydration decreases, suggesting that the interfacial water that dominates the average dynamics at low hydration is slower than water away from the membrane. Here, based on all-atom molecular dynamics simulations, we provide an interpretation of the slowdown of interfacial water in terms of the structure and dynamics of water-water and water-lipid hydrogen bonds (HBs). We calculate the rotational and translational slowdown of the dynamics of water confined in stacked phospholipid membranes at different levels of hydration, from completely hydrated to poorly hydrated membranes. For all hydrations, we analyze the distribution of HBs and find that water-lipids HBs last longer than water-water HBs and that at low hydration most of the water is in the interior of the membrane. We also show that water-water HBs become more persistent as the hydration is lowered. We attribute this effect (i) to HBs between water molecules that form, in turn, persistent HBs with lipids; (ii) to the hindering of the H-bonding switching between water molecules due to the lower water density at the interface; and (iii) to the higher probability of water-lipid HBs as the hydration decreases. Our interpretation of the large dynamic slowdown in water under dehydration is potentially relevant in understanding membrane biophysics at different hydration levels.

  17. Structural Interpretation of the Large Slowdown of Water Dynamics at Stacked Phospholipid Membranes for Decreasing Hydration Level: All-Atom Molecular Dynamics

    PubMed Central

    Calero, Carles; Stanley, H. Eugene; Franzese, Giancarlo

    2016-01-01

    Hydration water determines the stability and function of phospholipid membranes as well as the interaction of membranes with other molecules. Experiments and simulations have shown that water dynamics slows down dramatically as the hydration decreases, suggesting that the interfacial water that dominates the average dynamics at low hydration is slower than water away from the membrane. Here, based on all-atom molecular dynamics simulations, we provide an interpretation of the slowdown of interfacial water in terms of the structure and dynamics of water–water and water–lipid hydrogen bonds (HBs). We calculate the rotational and translational slowdown of the dynamics of water confined in stacked phospholipid membranes at different levels of hydration, from completely hydrated to poorly hydrated membranes. For all hydrations, we analyze the distribution of HBs and find that water–lipids HBs last longer than water–water HBs and that at low hydration most of the water is in the interior of the membrane. We also show that water–water HBs become more persistent as the hydration is lowered. We attribute this effect (i) to HBs between water molecules that form, in turn, persistent HBs with lipids; (ii) to the hindering of the H-bonding switching between water molecules due to the lower water density at the interface; and (iii) to the higher probability of water–lipid HBs as the hydration decreases. Our interpretation of the large dynamic slowdown in water under dehydration is potentially relevant in understanding membrane biophysics at different hydration levels. PMID:28773441

  18. Structural color-tunable mesoporous bragg stack layers based on graft copolymer self-assembly for high-efficiency solid-state dye-sensitized solar cells

    NASA Astrophysics Data System (ADS)

    Lee, Chang Soo; Park, Jung Tae; Kim, Jong Hak

    2016-08-01

    We present a facile fabrication route for structural color-tunable mesoporous Bragg stack (BS) layers based on the self-assembly of a cost-effective graft copolymer. The mesoporous BS layers are prepared through the alternating deposition of organized mesoporous-TiO2 (OM-TiO2) and -SiO2 (OM-SiO2) films on the non-conducting side of the counter electrode in dye-sensitized solar cells (DSSCs). The OM layers with controlled porosity, pore size, and refractive index are templated with amphiphilic graft copolymers consisting of poly(vinyl chloride) backbones and poly(oxyethylene methacrylate) side chains, i.e., PVC-g-POEM. The morphology and properties of the structural color-tunable mesoporous BS-functionalized electrodes are characterized using energy filtered transmission electron microscopy (EF-TEM), field emission-scanning electron microscopy (FE-SEM), spectroscopic ellipsometry, and reflectance spectroscopy. The solid-state DSSCs (ssDSSCs) based on a structural color-tunable mesoporous BS counter electrode with a single-component solid electrolyte show an energy conversion efficiency (η) of 7.1%, which is much greater than that of conventional nanocrystalline TiO2-based cells and one of the highest values for N719 dye-based ssDSSCs. The enhancement of η is due to the enhancement of current density (Jsc), attributed to the improved light harvesting properties without considerable decrease in fill factor (FF) or open-circuit voltage (Voc), as confirmed by incident photon-to-electron conversion efficiency (IPCE) and electrochemical impedance spectroscopy (EIS).

  19. Stacked antiaromatic porphyrins

    PubMed Central

    Nozawa, Ryo; Tanaka, Hiroko; Cha, Won-Young; Hong, Yongseok; Hisaki, Ichiro; Shimizu, Soji; Shin, Ji-Young; Kowalczyk, Tim; Irle, Stephan; Kim, Dongho; Shinokubo, Hiroshi

    2016-01-01

    Aromaticity is a key concept in organic chemistry. Even though this concept has already been theoretically extrapolated to three dimensions, it usually still remains restricted to planar molecules in organic chemistry textbooks. Stacking of antiaromatic π-systems has been proposed to induce three-dimensional aromaticity as a result of strong frontier orbital interactions. However, experimental evidence to support this prediction still remains elusive so far. Here we report that close stacking of antiaromatic porphyrins diminishes their inherent antiaromaticity in the solid state as well as in solution. The antiaromatic stacking furthermore allows a delocalization of the π-electrons, which enhances the two-photon absorption cross-section values of the antiaromatic porphyrins. This feature enables the dynamic switching of the non-linear optical properties by controlling the arrangement of antiaromatic π-systems on the basis of intermolecular orbital interactions. PMID:27901014

  20. Stack filter classifiers

    SciTech Connect

    Porter, Reid B; Hush, Don

    2009-01-01

    Just as linear models generalize the sample mean and weighted average, weighted order statistic models generalize the sample median and weighted median. This analogy can be continued informally to generalized additive modeels in the case of the mean, and Stack Filters in the case of the median. Both of these model classes have been extensively studied for signal and image processing but it is surprising to find that for pattern classification, their treatment has been significantly one sided. Generalized additive models are now a major tool in pattern classification and many different learning algorithms have been developed to fit model parameters to finite data. However Stack Filters remain largely confined to signal and image processing and learning algorithms for classification are yet to be seen. This paper is a step towards Stack Filter Classifiers and it shows that the approach is interesting from both a theoretical and a practical perspective.

  1. Stacked antiaromatic porphyrins

    NASA Astrophysics Data System (ADS)

    Nozawa, Ryo; Tanaka, Hiroko; Cha, Won-Young; Hong, Yongseok; Hisaki, Ichiro; Shimizu, Soji; Shin, Ji-Young; Kowalczyk, Tim; Irle, Stephan; Kim, Dongho; Shinokubo, Hiroshi

    2016-11-01

    Aromaticity is a key concept in organic chemistry. Even though this concept has already been theoretically extrapolated to three dimensions, it usually still remains restricted to planar molecules in organic chemistry textbooks. Stacking of antiaromatic π-systems has been proposed to induce three-dimensional aromaticity as a result of strong frontier orbital interactions. However, experimental evidence to support this prediction still remains elusive so far. Here we report that close stacking of antiaromatic porphyrins diminishes their inherent antiaromaticity in the solid state as well as in solution. The antiaromatic stacking furthermore allows a delocalization of the π-electrons, which enhances the two-photon absorption cross-section values of the antiaromatic porphyrins. This feature enables the dynamic switching of the non-linear optical properties by controlling the arrangement of antiaromatic π-systems on the basis of intermolecular orbital interactions.

  2. Stack Characterization System Development and Testing

    SciTech Connect

    Noakes, Mark W; Lind, Randall F; Lloyd, Peter D; Pin, Francois G; Rowe, John C

    2011-01-01

    Oak Ridge National Laboratory, as well as the rest of the U.S. Department of Energy community, has numerous off-gas stacks that need to be decommissioned, demolished, and packaged for disposal. Disposal requires a waste disposition determination phase. Process knowledge typically makes a worst-case scenario decision that may place lower-level waste into a more expensive higher-level waste disposal category. Truly useful radiological and chemical sampling can be problematic on old stacks due to their inherent height and access hazards, and many of these stacks have begun to deteriorate structurally. A remote stack characterization system (SCS) that can manage sample and data collection removes people from the hazards and provides an opportunity for access to difficult to reach internal stack areas. The SCS is a remotely operated articulated radiological data recovery system designed to deploy down into off-gas stacks from the top via crane. The battery-powered SCS is designed to stabilize itself against the stack walls and move various data recovery systems into areas of interest on the inner stack walls. Stabilization is provided by a tripod structure; sensors are mounted in a rotatable bipod underneath the tripod. Sensors include a beta/gamma/alpha detector, a removable contaminant multi-sample automated sampler, and a multi-core remote core drill. Multiple cameras provide remote task viewing, support for sampling, and video documentation of the process. A delay in funding has delayed project delivery somewhat. Therefore, this paper describes the technology and shows fabrication and testing progress to the extent that data is available.

  3. Laser pulse stacking method

    DOEpatents

    Moses, Edward I.

    1992-01-01

    A laser pulse stacking method is disclosed. A problem with the prior art has been the generation of a series of laser beam pulses where the outer and inner regions of the beams are generated so as to form radially non-synchronous pulses. Such pulses thus have a non-uniform cross-sectional area with respect to the outer and inner edges of the pulses. The present invention provides a solution by combining the temporally non-uniform pulses in a stacking effect to thus provide a more uniform temporal synchronism over the beam diameter.

  4. Laser pulse stacking method

    DOEpatents

    Moses, E.I.

    1992-12-01

    A laser pulse stacking method is disclosed. A problem with the prior art has been the generation of a series of laser beam pulses where the outer and inner regions of the beams are generated so as to form radially non-synchronous pulses. Such pulses thus have a non-uniform cross-sectional area with respect to the outer and inner edges of the pulses. The present invention provides a solution by combining the temporally non-uniform pulses in a stacking effect to thus provide a more uniform temporal synchronism over the beam diameter. 2 figs.

  5. Short protection device for stack of electrolytic cells

    DOEpatents

    Katz, Murray; Schroll, Craig R.

    1985-10-22

    Electrical short protection is provided in an electrolytic cell stack by the combination of a thin, nonporous ceramic shield and a noble metal foil disposed on opposite sides of the sealing medium in a gas manifold gasket. The thin ceramic shield, such as alumina, is placed between the porous gasket and the cell stack face at the margins of the negative end plate to the most negative cells to impede ion current flow. The noble metal foil, for instance gold, is electrically coupled to the negative potential of the stack to collect positive ions at a harmless location away from the stack face. Consequently, corrosion products from the stack structure deposit on the foil rather than on the stack face to eliminate electrical shorting of cells at the negative end of the stack.

  6. A molecular dynamics simulation study of coaxial stacking in RNA.

    PubMed

    Schneider, C; Sühnel, J

    2000-12-01

    We report on unrestrained molecular dynamics simulations of an RNA tetramer binding to a tetra-nucleotide overhang at the 5'-end of an RNA hairpin (nicked structure) and of the corresponding continuous hairpin with Na+ as counterions. The simulations lead to stable structures and in this way a structural model for the coaxially stacked RNA hairpin is generated. The stacking interface in the coaxially stacked nicked hairpin structure is characterized by a reduced twist and shift and a slightly increased propeller twist as compared to the continuous system. This leads to an increased overlap between C22 and G23 in the stacking interface of the nicked structure. In the simulations the continuous RNA hairpin has an almost straight helical axis. On the other hand, the corresponding axis for the nicked structure exhibits a marked kink of 39 degrees. The stacking interface exhibits no increased flexibility as compared to the corresponding base pair step in the continuous structure.

  7. The crystal structure of paramagnetic copper(II) oxalate (CuC₂O₄): formation and thermal decomposition of randomly stacked anisotropic nano-sized crystallites.

    PubMed

    Christensen, Axel Nørlund; Lebech, Bente; Andersen, Niels Hessel; Grivel, Jean-Claude

    2014-11-28

    Synthetic copper(II) oxalate, CuC2O4, was obtained in a precipitation reaction between a copper(II) solution and an aqueous solution of oxalic acid. The product was identified from its conventional X-ray powder patterns which match that of the copper mineral Moolooite reported to have the composition CuC2O4·0.44H2O. Time resolved in situ investigations of the thermal decomposition of copper(II) oxalate using synchrotron X-ray powder diffraction showed that in air the compound converts to Cu2O at 215 °C and oxidizes to CuO at 345 °C. Thermo gravimetric analysis performed in an inert Ar-gas reveals that the material contains no crystal water and reduces to pure Cu at 295 °C. Magnetic susceptibility measurements in the temperature range from 2 K to 300 K show intriguing paramagnetic behaviour with no sign of magnetic order down to 2 K. A crystal structure investigation is made based on powder diffraction data using one neutron diffraction pattern obtained at 5 K (λ = 1.5949(1) Å) combined with one conventional and two synchrotron X-ray diffraction patterns obtained at ambient temperature using λ = 1.54056, 1.0981 and λ = 0.50483(1) Å, respectively. Based on the X-ray synchrotron data the resulting crystal structure is described in the monoclinic space group P2₁/c (#14) in the P12₁/n1 setting with unit cell parameters a = 5.9598(1) Å, b = 5.6089(1) Å, c = 5.1138 (1) Å, β = 115.320(1)°. The composition is CuC2O4 with atomic coordinates determined by FullProf refinement of the neutron diffraction data. The crystal structure consists of a random stacking of CuC2O4 micro-crystallites where half the Cu-atoms are placed at (2a) and the other half at (2b) positions with the corresponding oxalate molecules centred around the corresponding (2b) and (2a) site positions, respectively. The diffraction patterns obtained for both kinds of radiation show considerable broadening of several Bragg peaks caused by highly anisotropic microstructural size and strain

  8. Structural context effects in the oxidation of 8-oxo-7,8-dihydro-2'-deoxyguanosine to hydantoin products: electrostatics, base stacking, and base pairing.

    PubMed

    Fleming, Aaron M; Muller, James G; Dlouhy, Adrienne C; Burrows, Cynthia J

    2012-09-12

    8-Oxo-7,8-dihydroguanine (OG) is the most common base damage found in cells, where it resides in many structural contexts, including the nucleotide pool, single-stranded DNA at transcription forks and replication bubbles, and duplex DNA base-paired with either adenine (A) or cytosine (C). OG is prone to further oxidation to the highly mutagenic hydantoin products spiroiminodihydantoin (Sp) and 5-guanidinohydantoin (Gh) in a sharply pH-dependent fashion within nucleosides. In the present work, studies were conducted to determine how the structural context affects OG oxidation to the hydantoins. These studies revealed a trend in which the Sp yield was greatest in unencumbered contexts, such as nucleosides, while the Gh yield increased in oligodeoxynucleotide (ODN) contexts or at reduced pH. Oxidation of oligomers containing hydrogen-bond modulators (2,6-diaminopurine, N(4)-ethylcytidine) or alteration of the reaction conditions (pH, temperature, and salt) identify base stacking, electrostatics, and base pairing as the drivers of the key intermediate 5-hydroxy-8-oxo-7,8-dihydroguanine (5-HO-OG) partitioning along the two hydantoin pathways, allowing us to propose a mechanism for the observed base-pairing effects. Moreover, these structural effects cause an increase in the effective pK(a) of 5-HO-OG, following an increasing trend from 5.7 in nucleosides to 7.7 in a duplex bearing an OG·C base pair, which supports the context-dependent product yields. The high yield of Gh in ODNs underscores the importance of further study on this lesion. The structural context of OG also determined its relative reactivity toward oxidation, for which the OG·A base pair is ~2.5-fold more reactive than an OG·C base pair, and with the weak one-electron oxidant ferricyanide, the OG nucleoside reactivity is >6000-fold greater than that of OG·C in a duplex, leading to the conclusion that OG in the nucleoside pool should act as a protective agent for OG in the genome.

  9. Fungal melanins differ in planar stacking distances.

    PubMed

    Casadevall, Arturo; Nakouzi, Antonio; Crippa, Pier R; Eisner, Melvin

    2012-01-01

    Melanins are notoriously difficult to study because they are amorphous, insoluble and often associated with other biological materials. Consequently, there is a dearth of structural techniques to study this enigmatic pigment. Current models of melanin structure envision the stacking of planar structures. X ray diffraction has historically been used to deduce stacking parameters. In this study we used X ray diffraction to analyze melanins derived from Cryptococcus neoformans, Aspergillus niger, Wangiella dermatitides and Coprinus comatus. Analysis of melanin in melanized C. neoformans encapsulated cells was precluded by the fortuitous finding that the capsular polysaccharide had a diffraction spectrum that was similar to that of isolated melanin. The capsular polysaccharide spectrum was dominated by a broad non-Bragg feature consistent with origin from a repeating structural motif that may arise from inter-molecular interactions and/or possibly gel organization. Hence, we isolated melanin from each fungal species and compared diffraction parameters. The results show that the inferred stacking distances of fungal melanins differ from that reported for synthetic melanin and neuromelanin, occupying intermediate position between these other melanins. These results suggest that all melanins have a fundamental diffracting unit composed of planar graphitic assemblies that can differ in stacking distance. The stacking peak appears to be a distinguishing universal feature of melanins that may be of use in characterizing these enigmatic pigments.

  10. Fungal Melanins Differ in Planar Stacking Distances

    PubMed Central

    Casadevall, Arturo; Nakouzi, Antonio; Crippa, Pier R.; Eisner, Melvin

    2012-01-01

    Melanins are notoriously difficult to study because they are amorphous, insoluble and often associated with other biological materials. Consequently, there is a dearth of structural techniques to study this enigmatic pigment. Current models of melanin structure envision the stacking of planar structures. X ray diffraction has historically been used to deduce stacking parameters. In this study we used X ray diffraction to analyze melanins derived from Cryptococcus neoformans, Aspergillus niger, Wangiella dermatitides and Coprinus comatus. Analysis of melanin in melanized C. neoformans encapsulated cells was precluded by the fortuitous finding that the capsular polysaccharide had a diffraction spectrum that was similar to that of isolated melanin. The capsular polysaccharide spectrum was dominated by a broad non-Bragg feature consistent with origin from a repeating structural motif that may arise from inter-molecular interactions and/or possibly gel organization. Hence, we isolated melanin from each fungal species and compared diffraction parameters. The results show that the inferred stacking distances of fungal melanins differ from that reported for synthetic melanin and neuromelanin, occupying intermediate position between these other melanins. These results suggest that all melanins have a fundamental diffracting unit composed of planar graphitic assemblies that can differ in stacking distance. The stacking peak appears to be a distinguishing universal feature of melanins that may be of use in characterizing these enigmatic pigments. PMID:22359541

  11. Structural Interpretation of the Large Slowdown of Water Dynamics at Stacked Phospholipid Membranes for Decreasing Hydration Level: All-Atom Molecular Dynamics

    DOE PAGES

    Calero, Carles; Stanley, H.; Franzese, Giancarlo

    2016-04-27

    Hydration water determines the stability and function of phospholipid membranes as well as the interaction of membranes with other molecules. Experiments and simulations have shown that water dynamics slows down dramatically as the hydration decreases, suggesting that the interfacial water that dominates the average dynamics at low hydration is slower than water away from the membrane. Here, based on all-atom molecular dynamics simulations, we provide an interpretation of the slowdown of interfacial water in terms of the structure and dynamics of water–water and water–lipid hydrogen bonds (HBs). We calculate the rotational and translational slowdown of the dynamics of water confinedmore » in stacked phospholipid membranes at different levels of hydration, from completely hydrated to poorly hydrated membranes. For all hydrations, we analyze the distribution of HBs and find that water–lipids HBs last longer than water–water HBs and that at low hydration most of the water is in the interior of the membrane. We also show that water–water HBs become more persistent as the hydration is lowered. We attribute this effect (i) to HBs between water molecules that form, in turn, persistent HBs with lipids; (ii) to the hindering of the H-bonding switching between water molecules due to the lower water density at the interface; and (iii) to the higher probability of water–lipid HBs as the hydration decreases. Lastly, our interpretation of the large dynamic slowdown in water under dehydration is potentially relevant in understanding membrane biophysics at different hydration levels.« less

  12. Gene stacking by recombinases

    USDA-ARS?s Scientific Manuscript database

    Efficient methods of stacking genes into plant genomes are needed to expedite transfer of multigenic traits into diverse crops grown in a variety of environments. Over two decades of research has identified several site-specific recombinases that carry out efficient cis and trans recombination betw...

  13. Stacked Sequential Learning

    DTIC Science & Technology

    2005-07-01

    a constant factor of K + 2. (To see this, note sequential stacking requires training K+2 classifiers: the classifiers f1, . . . , fK used in cross...on the non- sequential learners (ME and VP) but improves per- formance of the sequential learners (CRFs and VPH - MMs) less consistently. This pattern

  14. Stacking interactions in PUF-RNA complexes

    SciTech Connect

    Yiling Koh, Yvonne; Wang, Yeming; Qiu, Chen; Opperman, Laura; Gross, Leah; Tanaka Hall, Traci M; Wickens, Marvin

    2012-07-02

    Stacking interactions between amino acids and bases are common in RNA-protein interactions. Many proteins that regulate mRNAs interact with single-stranded RNA elements in the 3' UTR (3'-untranslated region) of their targets. PUF proteins are exemplary. Here we focus on complexes formed between a Caenorhabditis elegans PUF protein, FBF, and its cognate RNAs. Stacking interactions are particularly prominent and involve every RNA base in the recognition element. To assess the contribution of stacking interactions to formation of the RNA-protein complex, we combine in vivo selection experiments with site-directed mutagenesis, biochemistry, and structural analysis. Our results reveal that the identities of stacking amino acids in FBF affect both the affinity and specificity of the RNA-protein interaction. Substitutions in amino acid side chains can restrict or broaden RNA specificity. We conclude that the identities of stacking residues are important in achieving the natural specificities of PUF proteins. Similarly, in PUF proteins engineered to bind new RNA sequences, the identity of stacking residues may contribute to 'target' versus 'off-target' interactions, and thus be an important consideration in the design of proteins with new specificities.

  15. 1-D "Platinum Wire" Stacking Structure Built of Platinum(II) Diimine Bis(σ-acetylide) Units with Luminescence in the NIR Region.

    PubMed

    Kang, Jiajia; Zhang, Xiaoxin; Zhou, Huajun; Gai, Xuqiao; Jia, Ting; Xu, Liang; Zhang, Jianjun; Li, Yanqin; Ni, Jun

    2016-10-17

    A square-planar platinum(II) complex, Pt(DiBrbpy)(C≡CC6H4Et-4)2 (1) (DiBrbpy = 4,4-dibromo-2,2'-bipyridine), and crystals of its three solvated forms, namely, 1·DMSO, 1·1/2(CH3CN), and 1·1/8(CH2Cl2), were developed and characterized. 1·DMSO and 1·1/2(CH3CN) contain quasi-dimeric and dimeric structures with luminescence in the visible range, whereas 1·1/8(CH2Cl2) exhibits NIR luminescence at 1022 nm due to its intrinsic 1-D "platinum wire" stacking structure with strong Pt-Pt interactions. 1·1/8(CH2Cl2) represents the first compound based on platinum(II) diimine bis(σ-acetylide) molecular units with the NIR luminescence beyond 1000 nm. 1 selectively responds to DMSO and CH3CN by changing its color and luminescence property and the three solvated forms can be reversibly converted to each other upon exposure to corresponding solvent vapors. Their desolvated forms, namely 1a, 1b, and 1c, obtained after heating 1·DMSO, 1·1/2(CH3CN), and 1·1/8(CH2Cl2), respectively, can also be restored to the original solvated forms upon exposure to corresponding solvent vapors. 1a and 1b emit NIR luminescence peaked at 998 and 1018 nm respectively, suggesting indirect synthetic methods as powerful alternatives to achieve NIR luminescence with long wavelength. In contrast, 1c exhibits a red luminescence with a broad unstructured emission band centered at 667 nm. All the responses to organic solvent vapors and heating are due to the structural transformations which result in the conversion of the lowest energy excited states between (3)MLCT/(3)LLCT and (3)MMLCT in solid-state as supported by time-dependent density functional theory (TD-DFT) calculations.

  16. Transformation from a 2D stacked layer to 3D interpenetrated framework by changing the spacer functionality: synthesis, structure, adsorption, and magnetic properties.

    PubMed

    Maji, Tapas Kumar; Ohba, Masaaki; Kitagawa, Susumu

    2005-12-12

    Two novel coordination polymers of Cu(II), viz. [Cu(bipy)(1,4-napdc)(H2O)2]n and {[Cu(bpe)1.5(1,4-napdc)](H2O)}n (bipy=4,4'-bipyridine; bpe=1,2-bis(4-pyridyl)ethane; 1,4-napdc2-=1,4-naphthalenedicarboxylate), have been synthesized and structurally characterized by changing only the pillar motifs. Both the compounds crystallize by slow evaporation from the ammoniacal solution of the as-synthesized solid. Framework 1 crystallizes in monoclinic crystal system, space group P2/n (No. 13), with a=11.028(19) A, b=11.16(3) A, c=7.678(13) A, beta=103.30(5) degrees, and Z=2. Framework 2 crystallizes in triclinic system, space group, P (No. 2), a=10.613(4) A, b=10.828(10) A, c=13.333(9) A, alpha=85.25(9) degrees, beta=82.59(6) degrees, gamma=60.37(5) degrees, and Z=2. The structure determination reveals that has a 2D network based on rectangular grids, where each Cu(II) is in 4+2 coordination mode. The 2D networks stacked in a staggered manner through the pi-pi interaction to form a 3D supramolecular network. In the case of, a {Cu(bpe)1.5}n ladder connected by 1,4-napdc2- results a 2D cuboidal bilayer network and each bilayer network is interlocked by two adjacent identical network (upper and lower) forming 3-fold interpenetrated 3D framework with small channel along the c-axis, which accommodates two water molecules. The TGA and XRPD measurements reveal that both the frameworks are stable after dehydration. Adsorption measurements (N2, CO2, and different solvents, like H2O, MeOH, etc.) were carried out for both frameworks. Framework shows type-II sorption profile with N2 in contrast to H2O and MeOH, which are chemisorbed in the framework. In case of, only H2O molecules can diffuse into the micropore, whereas N2, CO2, and MeOH cannot be adsorbed, as corroborated by the smaller channel aperture. The low-temperature (300-2 K) magnetic measurement of and reveals that both are weakly antiferromagnetically coupled (J=-1.85 cm-1, g=2.02; J=-0.153 cm-1, g=2.07), which is correlated

  17. GENERAL PERSPECTIVE VIEW OF BOTH FURNACE STACKS LOOKING SOUTHWEST (STACK ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    GENERAL PERSPECTIVE VIEW OF BOTH FURNACE STACKS LOOKING SOUTHWEST (STACK NO. 1 TO LEFT, NO. 2 TO RIGHT) - Greenwood Furnace, East of McAlevy's Fort on State Route 305, McAlevys Fort, Huntingdon County, PA

  18. 23. Brick coke quencher, brick stack, metal stack to right, ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    23. Brick coke quencher, brick stack, metal stack to right, coke gas pipe to left; in background, BOF building, limestone piles, Levy's Slag Dump. Looking north/northwest - Rouge Steel Company, 3001 Miller Road, Dearborn, MI

  19. Properties of Ag layered in Te/Cd stack prepared by stacked elemental layer method

    NASA Astrophysics Data System (ADS)

    Subramani, Shanmugan; Devarajan, Mutharasu; Ibrahim, Kamarulazizi

    2012-06-01

    Ag layered Te/Cd stack thin films (<1 µm thick) were prepared by the Stacked Elemental Layer (SEL) method. The XRD results revealed that the synthesized films had a polycrystalline nature. The synthesized films were preferentially oriented with (111) directions with a cubic phase. Structural studies were evidenced the formation of Ag related alloys at high annealing temperatures as a result of thermal diffusion in elemental stack. Optical and photo-resistivity studies revealed the influence of Ag on the CdTe lattice at high annealing temperatures. Surface morphology and the influence of Ag atoms on surface roughness are also presented.

  20. Computer Center: 2 HyperCard Stacks for Biology.

    ERIC Educational Resources Information Center

    Duhrkopf, Richard, Ed.

    1989-01-01

    Two Hypercard stacks are reviewed including "Amino Acids," created to help students associate amino acid names with their structures, and "DNA Teacher," a tutorial on the structure and function of DNA. Availability, functions, hardware requirements, and general comments on these stacks are provided. (CW)

  1. Computer Center: 2 HyperCard Stacks for Biology.

    ERIC Educational Resources Information Center

    Duhrkopf, Richard, Ed.

    1989-01-01

    Two Hypercard stacks are reviewed including "Amino Acids," created to help students associate amino acid names with their structures, and "DNA Teacher," a tutorial on the structure and function of DNA. Availability, functions, hardware requirements, and general comments on these stacks are provided. (CW)

  2. ETR WASTE GAS STACK. ABOVE GROUND DUCTWORK AND ETR STACK, ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    ETR WASTE GAS STACK. ABOVE GROUND DUCTWORK AND ETR STACK, CLOSER VIEW. PERSONNEL LADDER AND CIRCULAR WORK PLATFORM MIDWAY UP STACK. CAMERA FACES NORTH. INL NEGATIVE NO. HD42-7-2. Mike Crane, Photographer, 3/2004 - Idaho National Engineering Laboratory, Test Reactor Area, Materials & Engineering Test Reactors, Scoville, Butte County, ID

  3. GENERAL PERSPECTIVE VIEW OF BOTH FURNACE STACKS LOOKING NORTHEAST (STACK ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    GENERAL PERSPECTIVE VIEW OF BOTH FURNACE STACKS LOOKING NORTHEAST (STACK NO. 2 TO LEFT, REMAINS OF NO. 1 AT CENTER RIGHT) - Greenwood Furnace, Stack No. 2, East of McAlevy's Fort on State Route 305, McAlevys Fort, Huntingdon County, PA

  4. Cassette less SOFC stack and method of assembly

    DOEpatents

    Meinhardt, Kerry D

    2014-11-18

    A cassette less SOFC assembly and a method for creating such an assembly. The SOFC stack is characterized by an electrically isolated stack current path which allows welded interconnection between frame portions of the stack. In one embodiment electrically isolating a current path comprises the step of sealing a interconnect plate to a interconnect plate frame with an insulating seal. This enables the current path portion to be isolated from the structural frame an enables the cell frame to be welded together.

  5. Energy Expenditure of Sport Stacking

    ERIC Educational Resources Information Center

    Murray, Steven R.; Udermann, Brian E.; Reineke, David M.; Battista, Rebecca A.

    2009-01-01

    Sport stacking is an activity taught in many physical education programs. The activity, although very popular, has been studied minimally, and the energy expenditure for sport stacking is unknown. Therefore, the purposes of this study were to determine the energy expenditure of sport stacking in elementary school children and to compare that value…

  6. Energy Expenditure of Sport Stacking

    ERIC Educational Resources Information Center

    Murray, Steven R.; Udermann, Brian E.; Reineke, David M.; Battista, Rebecca A.

    2009-01-01

    Sport stacking is an activity taught in many physical education programs. The activity, although very popular, has been studied minimally, and the energy expenditure for sport stacking is unknown. Therefore, the purposes of this study were to determine the energy expenditure of sport stacking in elementary school children and to compare that value…

  7. Fuel Cell Stacks

    DTIC Science & Technology

    1975-04-01

    AD-A009 587 FUEL CELL STACKS Bernard S. Baker Energy Research Corporation Prepared for: Army Mobility Equipment Research and Development Center April... Mobility Equipment Research and Development Center Unclassified For- Belvoir, Virginia 22060 [15. DE.CLASSIFICATION/L.TWNOGRADING SCREOUJLE 16...the majority of effort has been directed at translating technoilogy for small comn- ponent manufacture on a laboratory scale into large size components

  8. Iridium Interfacial Stack (IRIS)

    NASA Technical Reports Server (NTRS)

    Spry, David James (Inventor)

    2015-01-01

    An iridium interfacial stack ("IrIS") and a method for producing the same are provided. The IrIS may include ordered layers of TaSi.sub.2, platinum, iridium, and platinum, and may be placed on top of a titanium layer and a silicon carbide layer. The IrIS may prevent, reduce, or mitigate against diffusion of elements such as oxygen, platinum, and gold through at least some of its layers.

  9. Pre-stack full-waveform inversion of multichannel seismic data to retrieve thermohaline ocean structure. Application to the Gulf of Cadiz (SW Iberia).

    NASA Astrophysics Data System (ADS)

    Dagnino, Daniel; Jiménez Tejero, Clara-Estela; Meléndez, Adrià; Gras, Clàudia; Sallarès, Valentí; Ranero, César R.

    2016-04-01

    This work demonstrates the feasibility to retrieve high-resolution models of oceanic physical parameters by means of 2D adjoint-state full-waveform inversion (FWI). The proposed method is applied to pre-stack multi-channel seismic (MCS) data acquired in the Gulf of Cadiz (SW Iberia) in the framework of the EU GO (Geophysical Oceanography) project in 2006. We first design and apply a specific data processing flow that allows reducing data noise without modifying trace amplitudes. This step is shown to be essential to obtain accurate results due to the low signal-to-noise ratio (SNR) of water layer reflections, which are typically three-to-four orders of magnitude weaker than those in solid earth. Second, we propose new techniques to improve the inversion results by reducing the artefacts appearing in the gradient and misfit as a consequence of the low SNR. We use a weight and filter operator to focus in the regions where the gradient is reliable. The source wavelet is then inverted together with the sound speed. We demonstrate the efficiency of the proposed method and inversion strategy retrieving a 2D sound speed model along a 50 km-long MCS profile collected in the Gulf of Cadiz during the GO experiment. In this region, the Mediterranean outflow entrains the Atlantic waters, creating a salinity complex thermohaline structure that can be measured by a difference in acoustic impedance. The inverted sound speed model have a resolution of 75m for the horizontal direction, which is two orders of magnitude better than the models obtained using conventional, probe-based oceanographic techniques. In a second step, temperature and salinity are derived from the sound speed by minimizing the difference between the inverted and the theoretical sound speed estimated using the thermodynamic equation of seawater (TEOS-10 software). To apply the TEOS-10 we first calculate a linear-fitting between temperature and salinity using regional data from the National Oceanic and

  10. Performance evaluation of PEFC stack

    SciTech Connect

    Fujita, Jun-ichi; Ohtsuki, Jitsuji; Shindo, Yoshihiko

    1996-12-31

    Polymer electrolyte fuel cells (PEFCs) have many advantages such as high current density, short start-up time and endurance for start-stop cycles. Making use of these advantages, Fuji Electric has been working with the Kansai Electric Power Co., Inc. to explore practical applications of PEFCs for an electric utility use. Since large-sized electrodes are required in the electric utility applications, we have fabricated 600cm{sup 2} membrane-electrode assemblies by using hot-press method. We have also designed a cell structure to realize a uniform reaction over the electrodes. The structure includes a properly-shaped gas flow channel, a temperature-gradient cooling system. Using the 600cm{sup 2} (25x24cm) electrodes, a 30-cell stack (5kW) were constructed and tested.

  11. Conformational Preferences of π-π Stacking Between Ligand and Protein, Analysis Derived from Crystal Structure Data Geometric Preference of π-π Interaction.

    PubMed

    Zhao, Yuan; Li, Jue; Gu, Hui; Wei, Dongqing; Xu, Yao-Chang; Fu, Wei; Yu, Zhengtian

    2015-09-01

    π-π Interaction is a direct attractive non-covalent interaction between aromatic moieties, playing an important role in DNA stabilization, drug intercalation, etc. Aromatic rings interact through several different conformations including face-to-face, T-shaped, and offset stacked conformation. Previous quantum calculations indicated that T-shaped and offset stacked conformations are preferred for their smaller electron repulsions. However, substitution group on aromatic ring could have a great impact on π-π interaction by changing electron repulsion force between two rings. To investigate π-π interaction between ligand and aromatic side chain of protein, Brookhaven Protein Data Bank was analyzed. We extracted isolated dimer pairs with the aim of excluding multiple π-π stacking effects and found that T-shaped conformation is prevalent among aromatic interaction between phenyl ring of ligand and protein, which corresponds with the phenomenon of Phe-Phe interactions in small peptide. Specifically, for the non-substitution model, both Phe-Phe and Phenyl-Phe exhibit a favored T-shaped conformation whose dihedral angle is around 50°-70° and centroid distance is between 5.0 and 5.6 Å. However, it could be changed by substituent effect. The hydroxyl group could contact in the case of Tyr-Tyr pairs, while they point away from phenyl plane in Phe-Tyr pairs.

  12. Contemporary sample stacking in analytical electrophoresis.

    PubMed

    Malá, Zdena; Šlampová, Andrea; Křivánková, Ludmila; Gebauer, Petr; Boček, Petr

    2015-01-01

    This contribution is a methodological review of the publications about the topic from the last 2 years. Therefore, it is primarily organized according to the methods and procedures used in surveyed papers and the origin and type of sample and specification of analytes form the secondary structure. The introductory part about navigation in the architecture of stacking brings a brief characterization of the various stacking methods, with the description of mutual links to each other and important differences among them. The main body of the article brings a survey of publications organized according to main principles of stacking and then according to the origin and type of the sample. Provided that the paper cited gave explicitly the relevant data, information about the BGE(s) used, procedure, detector employed, and reached LOD and/or concentration effect is given. The papers where the procedure used is a combination of diverse fragments and parts of various stacking techniques are mentioned in a special section on combined techniques. The concluding remarks in the final part of the review evaluate present state of art and the trends of sample stacking in CE.

  13. Intracomplex {pi}-{pi} stacking interaction between adjacent phenanthroline molecules in complexes with rare-earth nitrates: Crystal and molecular structures of bis(1,10-Phenanthroline)trinitratoytterbium and bis(1,10-Phenanthroline)trinitratolanthanum

    SciTech Connect

    Sadikov, G. G. Antsyshkina, A. S.; Rodnikova, M. N.; Solonina, I. A.

    2009-01-15

    Crystals of the compounds Yb(NO{sub 3}){sub 3}(Phen){sub 2} and La(NO{sub 3}){sub 3}(Phen){sub 2} (Phen = 1,10-phenanthroline) are investigated using X-ray diffraction. It is established that there exist two different crystalline modifications: the main modification (phase 1) is characteristic of all members of the isostructural series, and the second modification (phase 2) is observed only for the Eu, Er, and Yb elements. It is assumed that the stability and universality of main phase 1 are associated with the occurrence of the nonbonded {pi}-{pi} stacking interactions between the adjacent phenanthroline ligands in the complexes. The indication of the interactions is a distortion of the planar shape of the Phen molecule (the folding of the metallocycle along the N-N line with a folding angle of 11{sup o}-13{sup o} and its 'boomerang' distortion). The assumption regarding the {pi}-{pi} stacking interaction is very consistent with the shape of the ellipsoids of atomic thermal vibrations, as well as with the data obtained from thermography and IR spectroscopy. An analysis of the structures of a number of rare-earth compounds has demonstrated that the intracomplex {pi}-{pi} stacking interactions directly contribute to the formation of supramolecular associates in the crystals, such as molecular dimers, supramolecules, chain and layered ensembles, and framework systems.

  14. Stacked endoplasmic reticulum sheets are connected by helicoidal membrane motifs

    PubMed Central

    Terasaki, Mark; Shemesh, Tom; Kasthuri, Narayanan; Klemm, Robin W.; Schalek, Richard; Hayworth, Kenneth J.; Hand, Arthur R.; Yankova, Maya; Huber, Greg; Lichtman, Jeff W.; Rapoport, Tom A.; Kozlov, Michael M.

    2013-01-01

    The endoplasmic reticulum (ER) often forms stacked membrane sheets, an arrangement that is likely required to accommodate a maximum of membrane-bound polysomes for secretory protein synthesis. How sheets are stacked is unknown. Here, we used novel staining and automated ultra-thin sectioning electron microscopy methods to analyze stacked ER sheets in neuronal cells and secretory salivary gland cells of mice. Our results show that stacked ER sheets form a continuous membrane system in which the sheets are connected by twisted membrane surfaces with helical edges of left- or right-handedness. The three-dimensional structure of tightly stacked ER sheets resembles a parking garage, in which the different levels are connected by helicoidal ramps. A theoretical model explains the experimental observations and indicates that the structure corresponds to a minimum of elastic energy of sheet edges and surfaces. The structure allows the dense packing of ER sheets in the restricted space of a cell. PMID:23870120

  15. Stacked endoplasmic reticulum sheets are connected by helicoidal membrane motifs.

    PubMed

    Terasaki, Mark; Shemesh, Tom; Kasthuri, Narayanan; Klemm, Robin W; Schalek, Richard; Hayworth, Kenneth J; Hand, Arthur R; Yankova, Maya; Huber, Greg; Lichtman, Jeff W; Rapoport, Tom A; Kozlov, Michael M

    2013-07-18

    The endoplasmic reticulum (ER) often forms stacked membrane sheets, an arrangement that is likely required to accommodate a maximum of membrane-bound polysomes for secretory protein synthesis. How sheets are stacked is unknown. Here, we used improved staining and automated ultrathin sectioning electron microscopy methods to analyze stacked ER sheets in neuronal cells and secretory salivary gland cells of mice. Our results show that stacked ER sheets form a continuous membrane system in which the sheets are connected by twisted membrane surfaces with helical edges of left- or right-handedness. The three-dimensional structure of tightly stacked ER sheets resembles a parking garage, in which the different levels are connected by helicoidal ramps. A theoretical model explains the experimental observations and indicates that the structure corresponds to a minimum of elastic energy of sheet edges and surfaces. The structure allows the dense packing of ER sheets in the restricted space of a cell.

  16. Stacked Extreme Learning Machines.

    PubMed

    Zhou, Hongming; Huang, Guang-Bin; Lin, Zhiping; Wang, Han; Soh, Yeng Chai

    2015-09-01

    Extreme learning machine (ELM) has recently attracted many researchers' interest due to its very fast learning speed, good generalization ability, and ease of implementation. It provides a unified solution that can be used directly to solve regression, binary, and multiclass classification problems. In this paper, we propose a stacked ELMs (S-ELMs) that is specially designed for solving large and complex data problems. The S-ELMs divides a single large ELM network into multiple stacked small ELMs which are serially connected. The S-ELMs can approximate a very large ELM network with small memory requirement. To further improve the testing accuracy on big data problems, the ELM autoencoder can be implemented during each iteration of the S-ELMs algorithm. The simulation results show that the S-ELMs even with random hidden nodes can achieve similar testing accuracy to support vector machine (SVM) while having low memory requirements. With the help of ELM autoencoder, the S-ELMs can achieve much better testing accuracy than SVM and slightly better accuracy than deep belief network (DBN) with much faster training speed.

  17. Asymmetric Flexible Supercapacitor Stack

    NASA Astrophysics Data System (ADS)

    Leela Mohana Reddy, A.; Estaline Amitha, F.; Jafri, Imran; Ramaprabhu, S.

    2008-04-01

    Electrical double layer supercapacitor is very significant in the field of electrical energy storage which can be the solution for the current revolution in the electronic devices like mobile phones, camera flashes which needs flexible and miniaturized energy storage device with all non-aqueous components. The multiwalled carbon nanotubes (MWNTs) have been synthesized by catalytic chemical vapor deposition technique over hydrogen decrepitated Mischmetal (Mm) based AB3 alloy hydride. The polymer dispersed MWNTs have been obtained by insitu polymerization and the metal oxide/MWNTs were synthesized by sol-gel method. Morphological characterizations of polymer dispersed MWNTs have been carried out using scanning electron microscopy (SEM), transmission electron microscopy (TEM and HRTEM). An assymetric double supercapacitor stack has been fabricated using polymer/MWNTs and metal oxide/MWNTs coated over flexible carbon fabric as electrodes and nafion® membrane as a solid electrolyte. Electrochemical performance of the supercapacitor stack has been investigated using cyclic voltammetry, galvanostatic charge-discharge, and electrochemical impedance spectroscopy.

  18. EPRI wet stacks design guide

    SciTech Connect

    Weilert, C.V.; Pattison, D.C.; Richart, S.D.

    1995-06-01

    Because of the high cost of reheat, wet stacks are being considered for new or retrofit applications of wet FGD systems in the United States. All retrofit systems designed for compliance with Phase I of the Acid Rain Control program under the Clean Air Act have utilized wet stacks. For Phase II, utilities with existing wet FGD systems would benefit from overscrubbing. For those units which currently use bypass reheat, this could be accomplished by closing the bypass to treat the entire boiler flue gas stream. This would require conversion to wet stack operation. Due to the level of interest in these wet stack scenarios for future FGD applications, EPRI, in a tailored collaboration with NYSEG, retained Bums & McDonnell and DynaFlow Systems to prepare a design guide for wet stacks. This paper provides a brief summary of the wet stacks design guide.

  19. Stacking-dependent transport properties in few-layers graphene

    NASA Astrophysics Data System (ADS)

    Lima, Matheus Paes; Padilha, José Eduardo; Pontes, Renato Borges; Fazzio, Adalberto; Silva, Antônio José Roque da

    2017-01-01

    By performing ab initio electronic structure and transport calculations, we investigated the effects of the stacking order (Bernal (AB) and rhombohedral (ABC)) as well as the number of layers, in the electronic structure and charge transport of few-layers graphene (FLG). We observed that for the ABC stack the transport properties are derived from surface states close to the Fermi level connected to dispersive states with an exponential penetration towards the inner layers, whereas for the AB stacking the transport is distributed over all layers. We present a simple model for the resistances as a function of the number of layers which contemplates the different contribution of the surface and inner layers for the transport. However, even if the stackings AB and ABC present completely different electronic and transport properties, both present the same cohesive energies, showing the absence of a thermodynamical preference for a given kind of stacking.

  20. Crystal structures of five (2-chloro­quinolin-3-yl)methyl ethers: supra­molecular assembly in one and two dimensions mediated by hydrogen bonding and π–π stacking

    PubMed Central

    Sowmya, Haliwana B. V.; Suresha Kumara, Tholappanavara H.; Gopalpur, Nagendrappa; Jasinski, Jerry P.; Millikan, Sean P.; Yathirajan, Hemmige S.; Glidewell, Christopher

    2015-01-01

    In the mol­ecules of the title compounds, methyl 5-bromo-2-[(2-chloro­quinolin-3-yl)meth­oxy]benzoate, C18H13BrClNO3, (I), methyl 5-bromo-2-[(2-chloro-6-methyl­quinolin-3-yl)meth­oxy]benzoate, C19H15BrClNO3, (II), methyl 2-[(2-chloro-6-methyl­quinolin-3-yl)meth­oxy]benzoate, C19H16ClNO3, (III), which crystallizes with Z′ = 4 in space group P212121, and 2-chloro-3-[(naphthalen-1-yl­oxy)meth­yl]quinoline, C20H14ClNO, (IV), the non-H atoms are nearly coplanar, but in {5-[(2-chloro­quinolin-3-yl)meth­oxy]-4-(hy­droxy­meth­yl)-6-methyl­pyridin-3-yl}methanol, C18H17ClN2O3, (V), the planes of the quinoline unit and of the unfused pyridine ring are almost parallel, although not coplanar. The mol­ecules of (I) are linked by two independent π–π stacking inter­actions to form chains, but there are no hydrogen bonds present in the structure. In (II), the mol­ecules are weakly linked into chains by a single type of π–π stacking inter­action. In (III), three of the four independent mol­ecules are linked by π–π stacking inter­actions but the other mol­ecule does not participate in such inter­actions. Weak C—H⋯O hydrogen bonds link the mol­ecules into three types of chains, two of which contain just one type of independent mol­ecule while the third type of chain contains two types of mol­ecule. The mol­ecules of (IV) are linked into chains by a C—H⋯π(arene) hydrogen bond, but π–π stacking inter­actions are absent. In (V), there is an intra­molecular O—H⋯O hydrogen bond, and mol­ecules are linked into sheets by a combination of O—H⋯N hydrogen bonds and π–π stacking inter­actions. PMID:26090133

  1. Thermoacoustic pin stacks. Summary report

    SciTech Connect

    Keolian, R.M.

    1994-07-06

    The construction and testing of a new stack geometry for thermoacoustic engines, called a pin stack, has been started. The stack is at the heart of a class of heat engines that use sound to deliver refrigeration, or use a temperature difference to generate sound. Calculations show that the pin stack should make useful improvements in engine efficiency. About 2000 wires will be hand sewn in a hexagonal lattice between the hot and cold heat exchangers in a sound source using low pressure neon gas between 300 K and 77 K. Thermoacoustics, Refrigeration, Acoustic source, Heat pump.

  2. IAS Stacking Library in IDL

    NASA Astrophysics Data System (ADS)

    Bavouzet, Nicolas; Beelen, Alexandre; Bethermin, Matthieu; Dole, Herve; Ponthieu, Nicolas

    2013-02-01

    This IDL library is designed to be used on astronomical images. Its main aim is to stack data to allow a statistical detection of faint signal, using a prior. For instance, you can stack 160um data using the positions of galaxies detected at 24um or 3.6um, or use WMAP sources to stack Planck data. It can estimate error bars using bootstrap, and it can perform photometry (aperture photometry, or PSF fitting, or other that you can plug). The IAS Stacking Library works with gnomonic projections (RA---TAN), and also with HEALPIX projection.

  3. Stacked insulator induction accelerator gaps

    SciTech Connect

    Houck, T.I.; Westenskow, G.A.; Kim, J.S.; Eylon, S.; Henestroza, E.; Yu, S.S.; Vanecek, D.

    1997-05-01

    Stacked insulators, with alternating layers of insulating material and conducting film, have been shown to support high surface electrical field stresses. We have investigated the application of the stacked insulator technology to the design of induction accelerator modules for the Relativistic-Klystron Two-Beam Accelerator program. The rf properties of the accelerating gaps using stacked insulators, particularly the impedance at frequencies above the beam pipe cutoff frequency, are investigated. Low impedance is critical for Relativistic-Klystron Two-Beam Accelerator applications where a high current, bunched beam is trsnsported through many accelerating gaps. An induction accelerator module designs using a stacked insulator is presented.

  4. Stack Trace Analysis Tool

    SciTech Connect

    2013-02-19

    STAT is a light weight debugging tool that gathers and merges stack traces from all of the processes in a parallell application. STAT uses the MRNet tree based overlay network to broadcast commands from the tool front-end to the STAT daemons and for the front-end to gather the traces from the STAT daemons. As the traces propagate through the MRNet network tree, they are merged across all tasks to from a single call prefix tree. The call prefix tree can be examined to identify tasks with similar function call patterns and to delineate a small set of equivalence slasses. A representative task from each of these classes can then be fed into a full feature debugger like TotalView for root cause analysis.

  5. Reprocessing of seismic reflection data using a macro velocity model independent imaging method - New insight into the crustal structure of northern Germany from Common Reflection Surface stack (CRS) sections.

    NASA Astrophysics Data System (ADS)

    Yoon, M.; Baykulov, M.; Duemmong, S.; Brink, H. J.; Gajewski, D.

    2006-12-01

    In this paper we present new seismic images of the North German Basin that resulted from intensive reprocessing of industrial seismic reflection data. The data sets were already acquired and processed in the early 80ies. The main focus was set on the sedimentary fill of the basin. During reprocessing the focus was moved to lower crustal structures in order to investigate the influence of old deep rooted processes on the evolution of the Central European Basin System (CEBS). During reprocessing the Common Reflection Surface (CRS) stack method was applied. This method is an entirely data-oriented approach which is macro velocity model independent (Mueller et al., 1998; Mueller, 1998). It has already been successfully applied to reflection data from sedimentary basins (Trappe et al., 2001; Menyoli, 2004), but yet it was not used to investigate the crystalline crust and deeper structures. In the reprocessed time sections the image quality of the lower and middle crust as well as the visibility of the Moho could be significantly improved. The latter appears as a flat reflection band contrary to former results where an east dipping Moho was observed. The flat Moho is in conflict with the currently supported extension model of the Glueckstadt Graben. However, the flat Moho topography would be in good agreement with other observations from the CEBS, e.g. DEKORP profiles (DEKORP-BASIN Research Group, 1999) or the Dniepr-Donets basin, Ukraine (Maystrenko et al., 2003). Furthermore, multiples could be succesfully suppressed using a macro velocity model as apriori information during iterative CRS stack procedure. The presented real data examples show that the CRS stack method provides a promising tool for imaging crustal and subcrustal features as well as for multiple suppression.

  6. Stacking of colors in exfoliable plasmonic superlattices.

    PubMed

    Jalali, Mahsa; Yu, Ye; Xu, Kaichen; Ng, Ray J H; Dong, Zhaogang; Wang, Liancheng; Safari Dinachali, Saman; Hong, Minghui; Yang, Joel K W

    2016-10-27

    Color printing with plasmonic resonators can overcome limitations in pigment-based printing approaches. While layering in pigment-based prints results in familiar color mixing effects, the color effects of stacking plasmonic resonator structures have not been investigated. Here, we demonstrate an experimental strategy to fabricate a 3-tiered complex superlattice of nanostructures with multiple sets of building blocks. Laser interference lithography was used to fabricate the nanostructures and a thin-layer of aluminum was deposited to introduce plasmonic colors. Interestingly, the structures exhibited drastic color changes when the layers of structures were sequentially exfoliated. Our theoretical analysis shows that the colors of the superlattice nanostructure were predominantly determined by the plasmonic properties of the two topmost layers. These results suggest the feasibility of the sub-wavelength vertical stacking of multiple plasmonic colors for applications in sensitive tamper-evident seals, dense 3D barcoding, and substrates for plasmonic color laser printing.

  7. Predicting coaxial helical stacking in RNA junctions

    PubMed Central

    Laing, Christian; Wen, Dongrong; Wang, Jason T. L.; Schlick, Tamar

    2012-01-01

    RNA junctions are important structural elements that form when three or more helices come together in space in the tertiary structures of RNA molecules. Determining their structural configuration is important for predicting RNA 3D structure. We introduce a computational method to predict, at the secondary structure level, the coaxial helical stacking arrangement in junctions, as well as classify the junction topology. Our approach uses a data mining approach known as random forests, which relies on a set of decision trees trained using length, sequence and other variables specified for any given junction. The resulting protocol predicts coaxial stacking within three- and four-way junctions with an accuracy of 81% and 77%, respectively; the accuracy increases to 83% and 87%, respectively, when knowledge from the junction family type is included. Coaxial stacking predictions for the five to ten-way junctions are less accurate (60%) due to sparse data available for training. Additionally, our application predicts the junction family with an accuracy of 85% for three-way junctions and 74% for four-way junctions. Comparisons with other methods, as well applications to unsolved RNAs, are also presented. The web server Junction-Explorer to predict junction topologies is freely available at: http://bioinformatics.njit.edu/junction. PMID:21917853

  8. FUNDAMENTAL AREAS OF PHENOMENOLOGY (INCLUDING APPLICATIONS): Spectral Analysis using Linearly Chirped Gaussian Pulse Stacking

    NASA Astrophysics Data System (ADS)

    Zheng, Huan; Wang, An-Ting; Xu, Li-Xin; Ming, Hai

    2009-07-01

    We analyze the spectrum of a stacked pulse with the technique of linearly chirped Gaussian pulse stacking. Our results show that there are modulation structures in the spectrum of the stacked pulse. The modulation frequencies are discussed in detail. By applying spectral analysis, we find that the intensity fluctuation cannot be smoothed by introducing an optical amplitude filter.

  9. Crustal structure of the Churchill-Superior boundary zone between 80 and 98 deg W longitude from Magsat anomaly maps and stacked passes

    NASA Technical Reports Server (NTRS)

    Hall, D. H.; Millar, T. W.; Noble, I. A.

    1985-01-01

    A modeling technique using spherical shell elements and equivalent dipole sources has been applied to Magsat signatures at the Churchill-Superior boundary in Manitoba, Ontario, and Ungava. A large satellite magnetic anomaly (12 nT amplitude) on POGO and Magsat maps near the Churchill-Superior boundary was found to be related to the Richmond Gulf aulacogen. The averaged crustal magnetization in the source region is 5.2 A/m. Stacking of the magnetic traces from Magsat passes reveals a magnetic signature (10 nT amplitude) at the Churchill-Superior boundary in an area studied between 80 deg W and 98 deg W. Modeling suggests a steplike thickening of the crust on the Churchill side of the boundary in a layer with a magnetization of 5 A/m. Signatures on aeromagnetic maps are also found in the source areas for both of these satellite anomalies.

  10. Magnetic multilayer structure

    DOEpatents

    Herget, Philipp; O'Sullivan, Eugene J.; Romankiw, Lubomyr T.; Wang, Naigang; Webb, Bucknell C.

    2017-03-21

    A mechanism is provided for an integrated laminated magnetic device. A substrate and a multilayer stack structure form the device. The multilayer stack structure includes alternating magnetic layers and diode structures formed on the substrate. Each magnetic layer in the multilayer stack structure is separated from another magnetic layer in the multilayer stack structure by a diode structure.

  11. Magnetic multilayer structure

    SciTech Connect

    Herget, Philipp; O'Sullivan, Eugene J.; Romankiw, Lubomyr T.; Wang, Naigang; Webb, Bucknell C.

    2016-07-05

    A mechanism is provided for an integrated laminated magnetic device. A substrate and a multilayer stack structure form the device. The multilayer stack structure includes alternating magnetic layers and diode structures formed on the substrate. Each magnetic layer in the multilayer stack structure is separated from another magnetic layer in the multilayer stack structure by a diode structure.

  12. 49 CFR 178.815 - Stacking test.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 49 Transportation 3 2013-10-01 2013-10-01 false Stacking test. 178.815 Section 178.815... Stacking test. (a) General. The stacking test must be conducted for the qualification of all IBC design types intended to be stacked. (b) Special preparation for the stacking test. (1) All IBCs...

  13. Structure and U-Pb zircon geochronology of an Alpine nappe stack telescoped by extensional detachment faulting (Kulidzhik area, Eastern Rhodopes, Bulgaria)

    NASA Astrophysics Data System (ADS)

    Georgiev, Neven; Froitzheim, Nikolaus; Cherneva, Zlatka; Frei, Dirk; Grozdev, Valentin; Jahn-Awe, Silke; Nagel, Thorsten J.

    2016-10-01

    The Rhodope Metamorphic Complex is a stack of allochthons assembled during obduction, subduction, and collision processes from Jurassic to Paleogene and overprinted by extensional detachment faults since Middle Eocene. In the study area, the following nappes occur in superposition (from base to top): an orthogneiss-dominated unit (Unit I), garnet-bearing schist with amphibolite and serpentinite lenses (Unit II), greenschist, phyllite, and calcschist with reported Jurassic microfossils (Unit III), and muscovite-rich orthogneiss (Unit IV). U-Pb dating of zircons from a K-feldspar augengneiss (Unit I) yielded a protolith age of ca. 300 Ma. Garnet-bearing metasediment from Unit II yielded an age spectrum with distinct populations between 310 and 250 Ma (detrital), ca. 150 Ma, and ca. 69 Ma (the last two of high-grade metamorphic origin). An orthogneiss from Unit IV yielded a wide spectrum of ages. The youngest population gives a concordia age of 581 ± 5 Ma, interpreted as the age of the granitic protolith. Unit I represents the Lower Allochthon (Byala Reka-Kechros Dome), Unit II the Upper Allochthon (Krumovitsa-Kimi Unit), Unit III the Uppermost Allochthon (Circum-Rhodope Belt), and Unit IV a still higher, far-travelled unit of unknown provenance. Telescoping of the entire Rhodope nappe stack to a thickness of only a few 100 m is due to Late Eocene north directed extensional shearing along the newly defined Kulidzhik Detachment which is part of a major detachment system along the northern border of the Rhodopes. Older top-to-the south mylonites in Unit I indicate that Tertiary extension evolved from asymmetric (top-to-the-south) to symmetric (top-to-the-south and top-to-the-north), bivergent unroofing.

  14. Polycrystallinity and stacking in CVD graphene.

    PubMed

    Tsen, Adam W; Brown, Lola; Havener, Robin W; Park, Jiwoong

    2013-10-15

    Graphene, a truly two-dimensional hexagonal lattice of carbon atoms, possesses remarkable properties not seen in any other material, including ultrahigh electron mobility, high tensile strength, and uniform broadband optical absorption. While scientists initially studied its intrinsic properties with small, mechanically exfoliated graphene crystals found randomly, applying this knowledge would require growing large-area films with uniform structural and physical properties. The science of graphene has recently experienced revolutionary change, mainly due to the development of several large-scale growth methods. In particular, graphene synthesis by chemical vapor deposition (CVD) on copper is a reliable method to obtain films with mostly monolayer coverage. These films are also polycrystalline, consisting of multiple graphene crystals joined by grain boundaries. In addition, portions of these graphene films contain more than one layer, and each layer can possess a different crystal orientation and stacking order. In this Account, we review the structural and physical properties that originate from polycrystallinity and stacking in CVD graphene. To begin, we introduce dark-field transmission electron microscopy (DF-TEM), a technique which allows rapid and accurate imaging of key structural properties, including the orientation of individual domains and relative stacking configurations. Using DF-TEM, one can easily identify "lateral junctions," or grain boundaries between adjacent domains, as well as "vertical junctions" from the stacking of graphene multilayers. With this technique, we can distinguish between oriented (Bernal or rhombohedral) and misoriented (twisted) configurations. The structure of lateral junctions in CVD graphene is sensitive to growth conditions and is reflected in the material's electrical and mechanical properties. In particular, grain boundaries in graphene grown under faster reactant flow conditions have no gaps or overlaps, unlike more

  15. Ribosomes in a Stacked Array

    PubMed Central

    Yamashita, Yui; Kadokura, Yoshitomo; Sotta, Naoyuki; Fujiwara, Toru; Takigawa, Ichigaku; Satake, Akiko; Onouchi, Hitoshi; Naito, Satoshi

    2014-01-01

    Expression of CGS1, which codes for an enzyme of methionine biosynthesis, is feedback-regulated by mRNA degradation in response to S-adenosyl-l-methionine (AdoMet). In vitro studies revealed that AdoMet induces translation arrest at Ser-94, upon which several ribosomes stack behind the arrested one, and mRNA degradation occurs at multiple sites that presumably correspond to individual ribosomes in a stacked array. Despite the significant contribution of stacked ribosomes to inducing mRNA degradation, little is known about the ribosomes in the stacked array. Here, we assigned the peptidyl-tRNA species of the stacked second and third ribosomes to their respective codons and showed that they are arranged at nine-codon intervals behind the Ser-94 codon, indicating tight stacking. Puromycin reacts with peptidyl-tRNA in the P-site, releasing the nascent peptide as peptidyl-puromycin. This reaction is used to monitor the activity of the peptidyltransferase center (PTC) in arrested ribosomes. Puromycin reaction of peptidyl-tRNA on the AdoMet-arrested ribosome, which is stalled at the pre-translocation step, was slow. This limited reactivity can be attributed to the peptidyl-tRNA occupying the A-site at this step rather than to suppression of PTC activity. In contrast, puromycin reactions of peptidyl-tRNA with the stacked second and third ribosomes were slow but were not as slow as pre-translocation step ribosomes. We propose that the anticodon end of peptidyl-tRNA resides in the A-site of the stacked ribosomes and that the stacked ribosomes are stalled at an early step of translocation, possibly at the P/E hybrid state. PMID:24652291

  16. Novel Stack Structure of Magnetic Tunnel Junction with MgO Tunnel Barrier Prepared by Oxidation Methods: Preferred Grain Growth Promotion Seed Layers and Bi-layered Pinned Layer

    NASA Astrophysics Data System (ADS)

    Choi, Young-suk; Tsunematsu, Hiroshi; Yamagata, Shinji; Okuyama, Hiroki; Nagamine, Yoshinori; Tsunekawa, Koji

    2009-12-01

    Despite superior compatibility to mass-production, magnetic tunnel junction (MTJ) with MgO barrier prepared by oxidation process (MgOx) has shown unacceptable magnetotransport properties for proper operation of spintronics devices because poor crystalline MgOx cannot properly provide a template for crystallization of amorphous CoFeB layers, thus lack of pseudo-epitaxy in overall. We report novel stack structure for MgOx-based MTJ to assure acceptable magnetotransport properties: insertion of preferred-grain-growth-promotion (PGGP) seed layer and bi-layered ferromagnetic pinned layer (bi-PL) to induce preferred grain growth in MgOx and crystallization of CoFeB layers at higher temperature annealing. Microstructure analysis confirms highly crystalline MgOx in pseudo-epitaxy with fully crystallized CoFeB via PGGP by high temperature annealing, attributed to enhanced thermal stability of bi-PL. Tunneling magnetoresistance (TMR) 132.6% at resistance-area product (RA) 1.2 Ω µm2 and 253% at 5.9 Ω µm2 from novel MTJ stack successfully satisfy specifications for spintronics devices.

  17. Stacking Faults in Cotton Fibers

    NASA Astrophysics Data System (ADS)

    Divakara, S.; Niranjana, A. R.; Siddaraju, G. N.; Somashekar, R.

    2011-07-01

    The stacking faults in different variety of cotton fibers have been quantified using wide-angle X-ray scattering (WAXS) data. Exponential functions for the column length distribution have been used for the determination of microstructural parameters. The crystal imperfection parameters like crystal size , lattice strain (g in %), stacking faults (αd) and twin faults (β) have been determined by profile analysis using Fourier method of Warren. We examined different variety of raw cotton fibers using WAXS techniques. In all these cases we note that, the stacking faults are quite significant in determining the property of cotton fibers.

  18. PieceStack: Toward Better Understanding of Stacked Graphs.

    PubMed

    Wu, Tongshuang; Wu, Yingcai; Shi, Conglei; Qu, Huamin; Cui, Weiwei

    2016-02-24

    Stacked graphs have been widely adopted in various fields, because they are capable of hierarchically visualizing a set of temporal sequences as well as their aggregation. However, because of visual illusion issues, connections between overly-detailed individual layers and overly-generalized aggregation are intercepted. Consequently, information in this area has yet to be fully excavated. Thus, we present PieceStack in this paper, to reveal the relevance of stacked graphs in understanding intrinsic details of their displayed shapes. This new visual analytic design interprets the ways through which aggregations are generated with individual layers by interactively splitting and re-constructing the stacked graphs. A clustering algorithm is designed to partition stacked graphs into sub-aggregated pieces based on trend similarities of layers. We then visualize the pieces with augmented encoding to help analysts decompose and explore the graphs with respect to their interests. Case studies and a user study are conducted to demonstrate the usefulness of our technique in understanding the formation of stacked graphs.

  19. Enhanced photocatalytic activity over Cd0.5Zn0.5S with stacking fault structure combined with Cu2+ modified carbon nanotubes

    NASA Astrophysics Data System (ADS)

    Gong, Beini; Lu, Yonghong; Wu, Pingxiao; Huang, Zhujian; Zhu, Yajie; Dang, Zhi; Zhu, Nengwu; Lu, Guining; Huang, Junyi

    2016-03-01

    For enhanced photocatalytic performance of visible light responsive CdZnS, a series of Cd0.5Zn0.5S solid solutions were fabricated by different methods. It was found that the semiconductor obtained through the precipitation-hydrothermal method (CZS-PH) exhibited the highest photocatalytic hydrogen production rate of 2154 μmol h-1 g-1. The enhanced photocatalytic hydrogen production of CZS-PH was probably due to stacking fault formation as well as narrow bandgap, a large surface area and a small crystallite size. Based on this, carbon nanotubes modified with Cu2+ (CNTs (Cu)) were used as a cocatalyst for CZS-PH. The addition of CNTs (Cu) enhanced notably the absorption of the composites for visible light. The highest photocatalytic hydrogen production rate of the Cd0.5Zn0.5S-CNTs (Cu) composite was 2995 μmol h-1 g-1 with 1.0 wt.% of CNTs (Cu). The improvement of the photocatalytic activity by loading of CNTs (Cu) was not due to alteration of bandgap energy or surface area, and was probably attributed to suppression of the electron-hole recombination by the CNTs, with Cu2+ anchored in the interface optimizing the photogenerated electron transfer pathway between the semiconductor and CNTs. We report here the successful combination of homojunction and heterojunction in CdZnS semiconductor, which resulted in promotion of charge separation and enhanced photocatalytic activity.

  20. Coexistence of diode-like volatile and multilevel nonvolatile resistive switching in a ZrO2/TiO2 stack structure.

    PubMed

    Li, Yingtao; Yuan, Peng; Fu, Liping; Li, Rongrong; Gao, Xiaoping; Tao, Chunlan

    2015-10-02

    Diode-like volatile resistive switching as well as nonvolatile resistive switching behaviors in a Cu/ZrO₂/TiO₂/Ti stack are investigated. Depending on the current compliance during the electroforming process, either volatile resistive switching or nonvolatile resistive switching is observed. With a lower current compliance (<10 μA), the Cu/ZrO₂/TiO₂/Ti device exhibits diode-like volatile resistive switching with a rectifying ratio over 10(6). The permanent transition from volatile to nonvolatile resistive switching can be obtained by applying a higher current compliance of 100 μA. Furthermore, by using different reset voltages, the Cu/ZrO₂/TiO₂/Ti device exhibits multilevel memory characteristics with high uniformity. The coexistence of nonvolatile multilevel memory and diode-like volatile resistive switching behaviors in the same Cu/ZrO₂/TiO₂/Ti device opens areas of applications in high-density storage, logic circuits, neural networks, and passive crossbar memory selectors.

  1. Fabrication of high gradient insulators by stack compression

    DOEpatents

    Harris, John Richardson; Sanders, Dave; Hawkins, Steven Anthony; Norona, Marcelo

    2014-04-29

    Individual layers of a high gradient insulator (HGI) are first pre-cut to their final dimensions. The pre-cut layers are then stacked to form an assembly that is subsequently pressed into an HGI unit with the desired dimension. The individual layers are stacked, and alignment is maintained, using a sacrificial alignment tube that is removed after the stack is hot pressed. The HGI's are used as high voltage vacuum insulators in energy storage and transmission structures or devices, e.g. in particle accelerators and pulsed power systems.

  2. Stack sampling apparatus

    DOEpatents

    Lind, Randall F; Lloyd, Peter D; Love, Lonnie J; Noakes, Mark W; Pin, Francois G; Richardson, Bradley S; Rowe, John C

    2014-09-16

    An apparatus for obtaining samples from a structure includes a support member, at least one stabilizing member, and at least one moveable member. The stabilizing member has a first portion coupled to the support member and a second portion configured to engage with the structure to restrict relative movement between the support member and the structure. The stabilizing member is radially expandable from a first configuration where the second portion does not engage with a surface of the structure to a second configuration where the second portion engages with the surface of the structure.

  3. Converting factors for stacked wood

    Treesearch

    C. A. Bickford

    1957-01-01

    Though the "cord" is used as a standard unit of measure for stacked wood, there is much confusion as to what a cord is and how it can be properly converted to other units of measure. The amount of solid wood in a pile varies greatly depending on the size, straightness, and evenness of the material in the pile, and also on the closeness of stacking.

  4. GINSU: Guaranteed Internet Stack Utilization

    DTIC Science & Technology

    2005-11-01

    Exokernel (logical stack encapsulation and dynamic packet classification), and NAI Labs’ AMP Channel Stack (traffic isolation) and combines and extends...using an efficient tri-based approach pioneered in the Exokernel and ported to the Linux platform as part of this research. Tries are populated on...filtering subsystem of the MIT Exokernel . Accordingly it has its strengths – simplicity and efficiency – and its weaknesses – lack of support for

  5. Multistage Force Amplification of Piezoelectric Stacks

    NASA Technical Reports Server (NTRS)

    Xu, Tian-Bing (Inventor); Siochi, Emilie J. (Inventor); Zuo, Lei (Inventor); Jiang, Xiaoning (Inventor); Kang, Jin Ho (Inventor)

    2015-01-01

    Embodiments of the disclosure include an apparatus and methods for using a piezoelectric device, that includes an outer flextensional casing, a first cell and a last cell serially coupled to each other and coupled to the outer flextensional casing such that each cell having a flextensional cell structure and each cell receives an input force and provides an output force that is amplified based on the input force. The apparatus further includes a piezoelectric stack coupled to each cell such that the piezoelectric stack of each cell provides piezoelectric energy based on the output force for each cell. Further, the last cell receives an input force that is the output force from the first cell and the last cell provides an output apparatus force In addition, the piezoelectric energy harvested is based on the output apparatus force. Moreover, the apparatus provides displacement based on the output apparatus force.

  6. Fabrication of Ta2O5/GeNx gate insulator stack for Ge metal-insulator-semiconductor structures by electron-cyclotron-resonance plasma nitridation and sputtering deposition techniques

    NASA Astrophysics Data System (ADS)

    Otani, Yohei; Itayama, Yasuhiro; Tanaka, Takuo; Fukuda, Yukio; Toyota, Hiroshi; Ono, Toshiro; Mitsui, Minoru; Nakagawa, Kiyokazu

    2007-04-01

    The authors have fabricated germanium (Ge) metal-insulator-semiconductor (MIS) structures with a 7-nm-thick tantalum pentaoxide (Ta2O5)/2-nm-thick germanium nitride (GeNx) gate insulator stack by electron-cyclotron-resonance plasma nitridation and sputtering deposition. They found that pure GeNx ultrathin layers can be formed by the direct plasma nitridation of the Ge surface without substrate heating. X-ray photoelectron spectroscopy revealed no oxidation of the GeNx layer after the Ta2O5 sputtering deposition. The fabricated MIS capacitor with a capacitance equivalent thickness of 4.3nm showed excellent leakage current characteristics. The interface trap density obtained by the modified conductance method was 4×1011cm-2eV-1 at the midgap.

  7. Soft x-ray reflectometry, hard x-ray photoelectron spectroscopy and transmission electron microscopy investigations of the internal structure of TiO2(Ti)/SiO2/Si stacks

    PubMed Central

    Filatova, Elena O; Kozhevnikov, Igor V; Sokolov, Andrey A; Ubyivovk, Evgeniy V; Yulin, Sergey; Gorgoi, Mihaela; Schäfers, Franz

    2012-01-01

    We developed a mathematical analysis method of reflectometry data and used it to characterize the internal structure of TiO2/SiO2/Si and Ti/SiO2/Si stacks. Atomic concentration profiles of all the chemical elements composing the samples were reconstructed from the analysis of the reflectivity curves measured versus the incidence angle at different soft x-ray reflection (SXR) photon energies. The results were confirmed by the conventional techniques of hard x-ray photoelectron spectroscopy (HXPES) and high-resolution transmission electron microscopy (HRTEM). The depth variation of the chemical composition, thicknesses and densities of individual layers extracted from SXR and HXPES measurements are in close agreement and correlate well with the HRTEM images. PMID:27877468

  8. Study of ZrO2/Al2O3/ZrO2 and Al2O3/ZrO2/Al2O3 stack structures deposited by sol-gel method on Si

    NASA Astrophysics Data System (ADS)

    Vitanov, P.; Harizanova, A.; Ivanova, T.; Dimitrova, T.

    2010-02-01

    Based on our previous experience with pseudobinary alloys of (Al2O3)x(ZrO2)1-x as high-k materials and passivating coatings for solar cells, stack systems of ZrO2/Al2O3/ZrO2and Al2O3/ZrO2/Al2O3, deposited by simple and low cost sol-gel technology have been studied. The thin films of ZrO2 and Al2O3 were sequentially obtained on Si substrates including spin coating deposition from stable solutions. High resolution scanning electron microscopy (HRSEM) was used to compare the morphology of the nanolaminates. The layers were optically characterized by UV-VIS spectrophotometry. The electrical measurements were carried out on metal-insulator-semiconductor (MIS) structures. Their leakage current and relative permittivity were determined.

  9. Quantum Hall Effect in Bernal-stacked tetralayer graphene

    NASA Astrophysics Data System (ADS)

    Shi, Yanmeng; Che, Shi; Espiritu, Timothy; Pi, Ziqi; Taniguchi, Takashi; Watanabe, Kenji; Lau, Chun Ning

    Bernal-stacked few layer graphene is of particular interest due to its unique tunable band structure. Here we study the electric transport of Bernal-stack tetralayer graphene that are encapsulated by boron nitride sheets. The device shows a clear Landau fan with multiple Landau level crossing features. We will present the dependence of its quantum Hall properties on electric and magnetic fields, and compare with theoretical calculations.

  10. Field-induced stacking transition of biofunctionalized trilayer graphene

    NASA Astrophysics Data System (ADS)

    Masato Nakano, C.; Sajib, Md Symon Jahan; Samieegohar, Mohammadreza; Wei, Tao

    2016-02-01

    Trilayer graphene (TLG) is attracting a lot of attention as their stacking structures (i.e., rhombohedral vs. Bernal) drastically affect electronic and optical properties. Based on full-atom molecular dynamics simulations, we here predict electric field-induced rhombohedral-to-Bernal transition of TLG tethered with proteins. Furthermore, our simulations show that protein's electrophoretic mobility and diffusivity are enhanced on TLG surface. This phenomenon of controllable TLG stacking transition will contribute to various applications including biosensing.

  11. Generalization of the H - κ stacking method to anisotropic media

    NASA Astrophysics Data System (ADS)

    Kaviani, Ayoub; Rümpker, Georg

    2015-04-01

    The effect of anisotropy on the estimates of crustal thickness H and average bulk vP/vS-ratio κ can be significant in the presence of strong seismic anisotropy. Here we extend the stacking approach of Zhu and Kanamori (2000) to include all twenty P-to-S converted phases and their crustal reverberations that are generated in the anisotropic case - instead of only five phases in the isotropic case. The ray-based algorithm of Frederiksen and Bostock (2000) is used to calculate the amplitude and arrival time of each phase. Synthetic tests are performed to investigate the feasibility and robustness of the stacking approach. For simplicity, we assume hexagonal symmetry and a horizontal symmetry axis but more general anisotropy may be considered. The tests reveal that the estimates of H and κ can be significantly affected by the presence of crustal anisotropy. We verify the feasibility of the stacking approach for real data by applying the method to examples from three different tectonic regions. The results show that the anisotropic stacking scheme presented here can provide much better constraints on the estimation of H and κ in comparison to the isotropic stacking. The anisotropic stacking can also help to resolve ambiguities in the determination of H and κ when several maxima of stacked receiver-function amplitudes arise in cases of complex crustal structure.

  12. 30 CFR 77.302 - Bypass stacks.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ....302 Bypass stacks. Thermal dryer systems shall include a bypass stack, relief stack or individual discharge stack provided with automatic venting which will permit gases from the dryer heating unit to bypass the heating chamber and vent to the outside atmosphere during any shutdown operation. ...

  13. 30 CFR 77.302 - Bypass stacks.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ....302 Bypass stacks. Thermal dryer systems shall include a bypass stack, relief stack or individual discharge stack provided with automatic venting which will permit gases from the dryer heating unit to bypass the heating chamber and vent to the outside atmosphere during any shutdown operation. ...

  14. 49 CFR 178.1055 - Stacking test.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 49 Transportation 3 2013-10-01 2013-10-01 false Stacking test. 178.1055 Section 178.1055... Containers § 178.1055 Stacking test. (a) General. The stacking test must be conducted for the qualification of all Flexible Bulk Containers design types. (b) Special preparation for the stacking test....

  15. Fuel cell stack compressive loading system

    DOEpatents

    Fahle, Ronald W.; Reiser, Carl A.

    1982-01-01

    A fuel cell module comprising a stack of fuel cells with reactant gas manifolds sealed against the external surfaces of the stack includes a constraint system for providing a compressive load on the stack wherein the constraint system maintains the stack at a constant height (after thermal expansion) and allows the compressive load to decrease with time as a result of the creep characteristics of the stack. Relative motion between the manifold sealing edges and the stack surface is virtually eliminated by this constraint system; however it can only be used with a stack having considerable resiliency and appropriate thermal expansion and creep characteristics.

  16. Thyristor stack for pulsed inductive plasma generation

    SciTech Connect

    Teske, C.; Jacoby, J.; Schweizer, W.; Wiechula, J.

    2009-03-15

    A thyristor stack for pulsed inductive plasma generation has been developed and tested. The stack design includes a free wheeling diode assembly for current reversal. Triggering of the device is achieved by a high side biased, self supplied gate driver unit using gating energy derived from a local snubber network. The structure guarantees a hard firing gate pulse for the required high dI/dt application. A single fiber optic command is needed to achieve a simultaneous turn on of the thyristors. The stack assembly is used for switching a series resonant circuit with a ringing frequency of 30 kHz. In the prototype pulsed power system described here an inductive discharge has been generated with a pulse duration of 120 {mu}s and a pulse energy of 50 J. A maximum power transfer efficiency of 84% and a peak power of 480 kW inside the discharge were achieved. System tests were performed with a purely inductive load and an inductively generated plasma acting as a load through transformer action at a voltage level of 4.1 kV, a peak current of 5 kA, and a current switching rate of 1 kA/{mu}s.

  17. Thyristor stack for pulsed inductive plasma generation.

    PubMed

    Teske, C; Jacoby, J; Schweizer, W; Wiechula, J

    2009-03-01

    A thyristor stack for pulsed inductive plasma generation has been developed and tested. The stack design includes a free wheeling diode assembly for current reversal. Triggering of the device is achieved by a high side biased, self supplied gate driver unit using gating energy derived from a local snubber network. The structure guarantees a hard firing gate pulse for the required high dI/dt application. A single fiber optic command is needed to achieve a simultaneous turn on of the thyristors. The stack assembly is used for switching a series resonant circuit with a ringing frequency of 30 kHz. In the prototype pulsed power system described here an inductive discharge has been generated with a pulse duration of 120 micros and a pulse energy of 50 J. A maximum power transfer efficiency of 84% and a peak power of 480 kW inside the discharge were achieved. System tests were performed with a purely inductive load and an inductively generated plasma acting as a load through transformer action at a voltage level of 4.1 kV, a peak current of 5 kA, and a current switching rate of 1 kA/micros.

  18. Stacked Learning to Search for Scene Labeling.

    PubMed

    Cheng, Feiyang; He, Xuming; Zhang, Hong

    2017-02-13

    Search-based structured prediction methods have shown promising successes in both computer vision and natural language processing recently. However, most existing search-based approaches lead to a complex multi-stage learning process, which is ill-suited for scene labeling problems with a high-dimensional output space. In this paper, a stacked learning to search method is proposed to address scene labeling tasks. We design a simplified search process consisting of a sequence of ranking functions, which are learned based on a stacked learning strategy to prevent over-fitting. Our method is able to encode rich prior knowledge by incorporating a variety of local and global scene features. In addition, we estimate a labeling confidence map to further improve the search efficiency from two aspects: first, it constrains the search space more effectively by pruning out low-quality solutions based on confidence scores; second, we employ the confidence map as an additional ranking feature to improve its prediction performance and thus reduce the search steps. Our approach is evaluated on both semantic segmentation and geometric labeling tasks, including the Stanford Background, Sift Flow, Geometric Context and NYUv2 RGB-D dataset. The competitive results demonstrate that our stacked learning to search method provides an effective alternative paradigm for scene labeling.

  19. Transparent organic photodiodes stacked with electroluminescence devices

    NASA Astrophysics Data System (ADS)

    Komatsu, Takahiro; Sakanoue, Kei; Fujita, Katsuhiko; Tsutsui, Tetsuo

    2005-10-01

    Stacked devices that consisted of transparent organic photodiodes (TOPDs) and organic electroluminescence devices (OELs) were demonstrated. TOPDs were prepared by poly-(2-methoxy-5- (2'-ethylhexyloxy)-1,4-phenylene vinylene (MEH-PPV) and [6,6]-phenyl C61-butyric acid methyl ester (PCBM) blend films as an active layer and transparent Au cathode (10 nm thick). These TOPDs showed about 45 % transmittance on average in visible light region (380-780 nm) and good correlation between incident light intensity and output photocurrent. Based on these results, the stacked devices were prepared by introducing OELs on TOPDs through a SiO insulating layer. The structure of OELs was ITO/Carbon/TPD/Alq3/LiF/Al. These stacked devices work as light emitting devices and also photo diodes. Since TOPDs have transparency, OELs can illuminate a paper put on the glass substrate through TOPDs and TOPDs can receive reflective light from the paper. Although the TOPDs also absorb light from OELs directly, the output signals from TOPDs changed according to the black and white pattern of the paper. These results show that the devices act as an image sensor having light emitting layer and light receiving layer in a same area.

  20. Performance Analysis of Coaxial Fed Stacked Patch Antennas

    NASA Astrophysics Data System (ADS)

    Jain, Satish K.; Jain, Shobha

    2014-01-01

    A performance analysis of coaxial fed stacked dual patch electromagnetic-coupled microstrip antenna useful for satellite communication working in X/Ku band is presented. A simplified structure of stacked dual patch antenna is proposed with adjustable foam-gap between patches. Few important geometrical parameters were chosen on which the performance of stacked dual patch antenna mainly depends. Dimension of lower square patch, upper square patch and height of foam-gap between two patches are the parameters, which were varied one by one keeping other parameters constant. The performance was observed through the reflection coefficient (dB) and smith chart impedance plot, obtained from the numerical simulator (IE3D) for the dual resonance frequency and bandwidth. Proposed geometry of stacked dual patch antenna was also analyzed with cavity model and artificial neural network modeling technique. Dual resonance frequencies and associated bandwidth were calculated through them and results were cross checked in the laboratory with a few experimental findings.

  1. Stacking dependence of carrier transport properties in multilayered black phosphorous

    NASA Astrophysics Data System (ADS)

    Sengupta, A.; Audiffred, M.; Heine, T.; Niehaus, T. A.

    2016-02-01

    We present the effect of different stacking orders on carrier transport properties of multi-layer black phosphorous. We consider three different stacking orders AAA, ABA and ACA, with increasing number of layers (from 2 to 6 layers). We employ a hierarchical approach in density functional theory (DFT), with structural simulations performed with generalized gradient approximation (GGA) and the bandstructure, carrier effective masses and optical properties evaluated with the meta-generalized gradient approximation (MGGA). The carrier transmission in the various black phosphorous sheets was carried out with the non-equilibrium green’s function (NEGF) approach. The results show that ACA stacking has the highest electron and hole transmission probabilities. The results show tunability for a wide range of band-gaps, carrier effective masses and transmission with a great promise for lattice engineering (stacking order and layers) in black phosphorous.

  2. Stacking dependence of carrier transport properties in multilayered black phosphorous.

    PubMed

    Sengupta, A; Audiffred, M; Heine, T; Niehaus, T A

    2016-02-24

    We present the effect of different stacking orders on carrier transport properties of multi-layer black phosphorous. We consider three different stacking orders AAA, ABA and ACA, with increasing number of layers (from 2 to 6 layers). We employ a hierarchical approach in density functional theory (DFT), with structural simulations performed with generalized gradient approximation (GGA) and the bandstructure, carrier effective masses and optical properties evaluated with the meta-generalized gradient approximation (MGGA). The carrier transmission in the various black phosphorous sheets was carried out with the non-equilibrium green's function (NEGF) approach. The results show that ACA stacking has the highest electron and hole transmission probabilities. The results show tunability for a wide range of band-gaps, carrier effective masses and transmission with a great promise for lattice engineering (stacking order and layers) in black phosphorous.

  3. Slippage in stacking of graphene nanofragments induced by spin polarization

    PubMed Central

    Lei, Yanyu; Jiang, Wanrun; Dai, Xing; Song, Ruixia; Wang, Bo; Gao, Yang; Wang, Zhigang

    2015-01-01

    Spin polarization and stacking are interesting effects in complex molecular systems and are both presented in graphene-based materials. Their possible combination may provide a new perspective in understanding the intermolecular force. The nanoscale graphene structures with zigzag edges could possess spin-polarized ground states. However, the mechanical effect of spin polarization in stacking of graphene nanofragments is not clear. Here we demonstrate the displacement between two stacked rhombic graphene nanofragments induced by spin polarization, using first-principles density-functional methods. We found that, in stacking of two rhombic graphene nanofragments, a spin-polarized stacked conformation with zero total spin is energetically more favorable than the closed-shell stacking. The spin-polarized conformation gives a further horizontal interlayer displacement within 1 angstrom compared with the closed-shell structure. This result highlights that, besides the well-known phenomenologically interpreted van der Waals forces, a specific mechanism dependent on the monomeric spin polarization may lead to obvious mechanical effects in some intermolecular interactions. PMID:26078005

  4. Slippage in stacking of graphene nanofragments induced by spin polarization

    NASA Astrophysics Data System (ADS)

    Lei, Yanyu; Jiang, Wanrun; Dai, Xing; Song, Ruixia; Wang, Bo; Gao, Yang; Wang, Zhigang

    2015-06-01

    Spin polarization and stacking are interesting effects in complex molecular systems and are both presented in graphene-based materials. Their possible combination may provide a new perspective in understanding the intermolecular force. The nanoscale graphene structures with zigzag edges could possess spin-polarized ground states. However, the mechanical effect of spin polarization in stacking of graphene nanofragments is not clear. Here we demonstrate the displacement between two stacked rhombic graphene nanofragments induced by spin polarization, using first-principles density-functional methods. We found that, in stacking of two rhombic graphene nanofragments, a spin-polarized stacked conformation with zero total spin is energetically more favorable than the closed-shell stacking. The spin-polarized conformation gives a further horizontal interlayer displacement within 1 angstrom compared with the closed-shell structure. This result highlights that, besides the well-known phenomenologically interpreted van der Waals forces, a specific mechanism dependent on the monomeric spin polarization may lead to obvious mechanical effects in some intermolecular interactions.

  5. Slippage in stacking of graphene nanofragments induced by spin polarization.

    PubMed

    Lei, Yanyu; Jiang, Wanrun; Dai, Xing; Song, Ruixia; Wang, Bo; Gao, Yang; Wang, Zhigang

    2015-06-16

    Spin polarization and stacking are interesting effects in complex molecular systems and are both presented in graphene-based materials. Their possible combination may provide a new perspective in understanding the intermolecular force. The nanoscale graphene structures with zigzag edges could possess spin-polarized ground states. However, the mechanical effect of spin polarization in stacking of graphene nanofragments is not clear. Here we demonstrate the displacement between two stacked rhombic graphene nanofragments induced by spin polarization, using first-principles density-functional methods. We found that, in stacking of two rhombic graphene nanofragments, a spin-polarized stacked conformation with zero total spin is energetically more favorable than the closed-shell stacking. The spin-polarized conformation gives a further horizontal interlayer displacement within 1 angstrom compared with the closed-shell structure. This result highlights that, besides the well-known phenomenologically interpreted van der Waals forces, a specific mechanism dependent on the monomeric spin polarization may lead to obvious mechanical effects in some intermolecular interactions.

  6. Interpreting spatially stacked Sp receiver functions

    NASA Astrophysics Data System (ADS)

    Lekić, Vedran; Fischer, Karen M.

    2017-08-01

    Conversions of shear waves (S) to compressional waves (P), often analysed as Sp receiver functions, are useful for studying upper-mantle layering, and have been used to map upper-mantle seismic impedance interfaces in various tectonic settings. Recently, common conversion point (CCP) stacking of Sp receiver functions has revealed variations of lithospheric thickness across short horizontal distances. However, compared to Ps receiver functions and reflection, only limited work has been done towards quantifying the interpretability of Sp receiver functions, especially in settings where large lateral structure variations are present. Using the spectral element method, we model wave propagation and S-to-P conversion through simple synthetic models with varying velocity interface topography. We systematically explore the effects of wave frequency content, seismometer spacing and illumination geometry on CCP stacked Sp receiver functions in settings where velocity interface depth varies laterally. We observe that the resolving power of Sp receiver functions decreases with decreasing frequency content, and that upward deflections of velocity interfaces are more difficult to observe than are downward deflections, an asymmetry that primarily arises due to corner diffractions. Furthermore, we document how the relationship between the angle of illumination and the orientation of the topography of the velocity interfaces largely determines the apparent interface slope and strongly affects the amplitude of Sp phases in the CCP stacks. Indeed, under certain illumination geometries, strong velocity contrasts across a dipping lithosphere-asthenosphere boundary may not produce detectable Sp phases at the surface. Furthermore, diffractions arising from corners of interface topography can produce artefacts in CCP stacks that masquerade as mid-lithospheric impedance jumps or drops, as well as gently sloped sublithospheric impedance drops. We find that estimates based on Fresnel zone

  7. Stacking interactions and DNA intercalation

    SciTech Connect

    Li, Dr. Shen; Cooper, Valentino R; Thonhauser, Prof. Timo; Lundqvist, Prof. Bengt I.; Langreth, David C.

    2009-01-01

    The relationship between stacking interactions and the intercalation of proflavine and ellipticine within DNA is investigated using a nonempirical van der Waals density functional for the correlation energy. Our results, employing a binary stack model, highlight fundamental, qualitative differences between base-pair base-pair interactions and that of the stacked intercalator base pair system. Most notable result is the paucity of torque which so distinctively defines the Twist of DNA. Surprisingly, this model, when combined with a constraint on the twist of the surrounding base-pair steps to match the observed unwinding of the sugar-phosphate backbone, was sufficient for explaining the experimentally observed proflavine intercalator configuration. Our extensive mapping of the potential energy surface of base-pair intercalator interactions can provide valuable information for future nonempirical studies of DNA intercalation dynamics.

  8. Stacking-dependent electronic property of trilayer graphene epitaxially grown on Ru(0001)

    SciTech Connect

    Que, Yande; Xiao, Wende E-mail: hjgao@iphy.ac.cn; Chen, Hui; Wang, Dongfei; Du, Shixuan; Gao, Hong-Jun E-mail: hjgao@iphy.ac.cn

    2015-12-28

    The growth, atomic structure, and electronic property of trilayer graphene (TLG) on Ru(0001) were studied by low temperature scanning tunneling microscopy and spectroscopy in combined with tight-binding approximation (TBA) calculations. TLG on Ru(0001) shows a flat surface with a hexagonal lattice due to the screening effect of the bottom two layers and the AB-stacking in the top two layers. The coexistence of AA- and AB-stacking in the bottom two layers leads to three different stacking orders of TLG, namely, ABA-, ABC-, and ABB-stacking. STS measurements combined with TBA calculations reveal that the density of states of TLG with ABC- and ABB-stacking is characterized by one and two sharp peaks near to the Fermi level, respectively, in contrast to the V-shaped feature of TLG with ABA-stacking. Our work demonstrates that TLG on Ru(0001) might be an ideal platform for exploring stacking-dependent electronic properties of graphene.

  9. NEXAFS study of electronic and atomic structure of active layer in Al/indium tin oxide/TiO2 stack during resistive switching.

    PubMed

    Filatova, Elena; Konashuk, Aleksei; Petrov, Yuri; Ubyivovk, Evgeny; Sokolov, Andrey; Selivanov, Andrei; Drozd, Victor

    2016-01-01

    We have studied the stability of the resistive switching process in the Al/(In2O3)0.9(SnO2)0.1/TiO2 assembly grown by atomic layer deposition. Besides electrical characterization the effect of electric field on the atomic electronic structure of the TiO2 layer was studied using near edge X-ray absorption fine structure (NEXAFS) spectroscopy. The region of the current instability in the I-V characteristics was revealed. Presumably this current instability is supported by the amorphous structure of the TiO2 film but is initiated by the surface morphology of the Al substrate. A formation of the O2 molecules was established which occurs specifically in the region of the current instability that is a result of electrical Joule heating manifestation.

  10. NEXAFS study of electronic and atomic structure of active layer in Al/indium tin oxide/TiO2 stack during resistive switching

    PubMed Central

    Filatova, Elena; Konashuk, Aleksei; Petrov, Yuri; Ubyivovk, Evgeny; Sokolov, Andrey; Selivanov, Andrei; Drozd, Victor

    2016-01-01

    Abstract We have studied the stability of the resistive switching process in the Al/(In2O3)0.9(SnO2)0.1/TiO2 assembly grown by atomic layer deposition. Besides electrical characterization the effect of electric field on the atomic electronic structure of the TiO2 layer was studied using near edge X-ray absorption fine structure (NEXAFS) spectroscopy. The region of the current instability in the I-V characteristics was revealed. Presumably this current instability is supported by the amorphous structure of the TiO2 film but is initiated by the surface morphology of the Al substrate. A formation of the O2 molecules was established which occurs specifically in the region of the current instability that is a result of electrical Joule heating manifestation. PMID:27877880

  11. Multi-functional stacked light-trapping structure for stabilizing and boosting solar-electricity efficiency of hydrogenated amorphous silicon solar cells

    NASA Astrophysics Data System (ADS)

    Huang, Wen-Hsien; Shieh, Jia-Min; Pan, Fu-Ming; Shen, Chang-Hong; Huang, Jung Y.; Wu, Tsung-Ta; Kao, Ming-Hsuan; Hsiao, Tzu-Hsuan; Yu, Peichen; Kuo, Hao-Chung; Lee, Ching-Ting

    2013-08-01

    A sandwiched light-trapping electrode structure, which consists of a capping aluminum-doped ZnO (AZO) layer, dispersed plasmonic Au-nanoparticles (Au-NPs), and a micro-structured transparent conductive substrate, is employed to stabilize and boost the conversion-efficiency of hydrogenated amorphous silicon (a-Si:H) solar cells. The conformal AZO ultrathin layer (5 nm) smoothened the Au-NP-dispersed electrode surface, thereby reducing defects across the AZO/a-Si:H interface and resulting in a high resistance to photo-degradation in the ultraviolet-blue photoresponse band. With the plasmonic light-trapping structure, the cell has a high conversion-efficiency of 10.1% and the photo-degradation is as small as 7%.

  12. Pressurized electrolysis stack with thermal expansion capability

    DOEpatents

    Bourgeois, Richard Scott

    2015-07-14

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

  13. The Direct FuelCell™ stack engineering

    NASA Astrophysics Data System (ADS)

    Doyon, J.; Farooque, M.; Maru, H.

    FuelCell Energy (FCE) has developed power plants in the size range of 300 kW to 3 MW for distributed power generation. Field-testing of the sub-megawatt plants is underway. The FCE power plants are based on its Direct FuelCell™ (DFC) technology. This is so named because of its ability to generate electricity directly from a hydrocarbon fuel, such as natural gas, by reforming it inside the fuel cell stack itself. All FCE products use identical 8000 cm 2 cell design, approximately 350-400 cells per stack, external gas manifolds, and similar stack compression systems. The difference lies in the packaging of the stacks inside the stack module. The sub-megawatt system stack module contains a single horizontal stack whereas the MW-class stack module houses four identical vertical stacks. The commonality of the design, internal reforming features, and atmospheric operation simplify the system design, reduce cost, improve efficiency, increase reliability and maintainability. The product building-block stack design has been advanced through three full-size stack operations at company's headquarters in Danbury, CT. The initial proof-of-concept of the full-size stack design was verified in 1999, followed by a 1.5 year of endurance verification in 2000-2001, and currently a value-engineered stack version is in operation. This paper discusses the design features, important engineering solutions implemented, and test results of FCE's full-size DFC stacks.

  14. Stacked rig refurbished for ultradeep gas drilling

    SciTech Connect

    Noevig, T.; Gutsche, W. )

    1995-01-09

    A heavy drilling rig, cold stacked for several years, recently underwent numerous structural, equipment, and computer upgrades for drilling ultradeep (8,000 m) gas wells in Germany. The technical improvements on the rig included supplementary installations and modifications to safety, quality, engineering, noise abatement, and environmental protection systems. With a maximal hook load of 700 tons, the drilling rig is one of the heaviest of its kind in Europe. The rig has a drilling depth range of 7,000--8,000 m, and the top drive system enables horizontal drilling. The paper describes the rig site, mast, top drive, substructure, draw works, power station, mud system, instrumentation, and other equipment.

  15. V-stack piezoelectric actuator

    NASA Astrophysics Data System (ADS)

    Ardelean, Emil V.; Clark, Robert L.

    2001-07-01

    Aeroelastic control of wings by means of a distributed, trailing-edge control surface is of interest with regards to maneuvers, gust alleviation, and flutter suppression. The use of high energy density, piezoelectric materials as motors provides an appealing solution to this problem. A comparative analysis of the state of the art actuators is currently being conducted. A new piezoelectric actuator design is presented. This actuator meets the requirements for trailing edge flap actuation in both stroke and force. It is compact, simple, sturdy, and leverages stroke geometrically with minimum force penalties while displaying linearity over a wide range of stroke. The V-Stack Piezoelectric Actuator, consists of a base, a lever, two piezoelectric stacks, and a pre-tensioning element. The work is performed alternately by the two stacks, placed on both sides of the lever. Pre-tensioning can be readily applied using a torque wrench, obviating the need for elastic elements and this is for the benefit of the stiffness of the actuator. The characteristics of the actuator are easily modified by changing the base or the stacks. A prototype was constructed and tested experimentally to validate the theoretical model.

  16. Late Pleistocene Sea Level Stack

    NASA Astrophysics Data System (ADS)

    Spratt, R. M.; Lisiecki, L. E.

    2014-12-01

    Sea level reconstructions have been created using wide variety of proxies and models. The accuracy of individual sea level reconstructions is limited by measurement, noise, local variations in salinity and temperature, and the assumptions particular to each reconstruction. To address these limitations, we have created a sea level stack (average) which increases the signal-to-noise ratio of sea level estimates by combining 5-7 sea level reconstructions over the last 800 kyr. Principal Component analysis (PCA) of seven sea level records from 0-430 kyr ago shows that 82% of the variance in these records is explained by their first principal component (i.e., the stack). Additionally, a stack of just the 5 longer records that extends to 800 kyr closely matches the timing and amplitude of our seven-record mean. We find that the mean sea level estimate for Marine Isotope Stage (MIS) 5e is 0-4 m above modern, and that the standard deviation of individual estimates is 11 m. Mean sea level estimates for MIS 11 are 12-16 m above modern with a standard deviation of 30 m. Due to the large variability between individual reconstructions, our sea level stack may provide more robust sea level estimates than any single technique.

  17. Multibeam collimator uses prism stack

    NASA Technical Reports Server (NTRS)

    Minott, P. O.

    1981-01-01

    Optical instrument creates many divergent light beams for surveying and machine element alignment applications. Angles and refractive indices of stack of prisms are selected to divert incoming laser beam by small increments, different for each prism. Angles of emerging beams thus differ by small, precisely-controlled amounts. Instrument is nearly immune to vibration, changes in gravitational force, temperature variations, and mechanical distortion.

  18. Multilayer Piezoelectric Stack Actuator Characterization

    NASA Technical Reports Server (NTRS)

    Sherrit, Stewart; Jones, Christopher M.; Aldrich, Jack B.; Blodget, Chad; Bao, Xioaqi; Badescu, Mircea; Bar-Cohen, Yoseph

    2008-01-01

    Future NASA missions are increasingly seeking to use actuators for precision positioning to accuracies of the order of fractions of a nanometer. For this purpose, multilayer piezoelectric stacks are being considered as actuators for driving these precision mechanisms. In this study, sets of commercial PZT stacks were tested in various AC and DC conditions at both nominal and extreme temperatures and voltages. AC signal testing included impedance, capacitance and dielectric loss factor of each actuator as a function of the small-signal driving sinusoidal frequency, and the ambient temperature. DC signal testing includes leakage current and displacement as a function of the applied DC voltage. The applied DC voltage was increased to over eight times the manufacturers' specifications to investigate the correlation between leakage current and breakdown voltage. Resonance characterization as a function of temperature was done over a temperature range of -180C to +200C which generally exceeded the manufacturers' specifications. In order to study the lifetime performance of these stacks, five actuators from one manufacturer were driven by a 60volt, 2 kHz sine-wave for ten billion cycles. The tests were performed using a Lab-View controlled automated data acquisition system that monitored the waveform of the stack electrical current and voltage. The measurements included the displacement, impedance, capacitance and leakage current and the analysis of the experimental results will be presented.

  19. Multilayer piezoelectric stack actuator characterization

    NASA Astrophysics Data System (ADS)

    Sherrit, Stewart; Jones, Christopher M.; Aldrich, Jack B.; Blodget, Chad; Bao, Xioaqi; Badescu, Mircea; Bar-Cohen, Yoseph

    2008-03-01

    Future NASA missions are increasingly seeking to use actuators for precision positioning to accuracies of the order of fractions of a nanometer. For this purpose, multilayer piezoelectric stacks are being considered as actuators for driving these precision mechanisms. In this study, sets of commercial PZT stacks were tested in various AC and DC conditions at both nominal and extreme temperatures and voltages. AC signal testing included impedance, capacitance and dielectric loss factor of each actuator as a function of the small-signal driving sinusoidal frequency, and the ambient temperature. DC signal testing includes leakage current and displacement as a function of the applied DC voltage. The applied DC voltage was increased to over eight times the manufacturers' specifications to investigate the correlation between leakage current and breakdown voltage. Resonance characterization as a function of temperature was done over a temperature range of -180°C to +200°C which generally exceeded the manufacturers' specifications. In order to study the lifetime performance of these stacks, five actuators from one manufacturer were driven by a 60volt, 2 kHz sine-wave for ten billion cycles. The tests were performed using a Lab-View controlled automated data acquisition system that monitored the waveform of the stack electrical current and voltage. The measurements included the displacement, impedance, capacitance and leakage current and the analysis of the experimental results will be presented.

  20. Strangely stable sphere stacking in yield-stress fluids

    NASA Astrophysics Data System (ADS)

    Singh, Piyush; Rogman, Scott; Freund, Jonathan; Ewoldt, Randy

    2016-11-01

    We have previously observed a novel phenomenon whereby spheres sediment and form a single, stable vertical stack in a yield-stress fluid. Individually, the spheres settle to the bottom, since the yield stress is insufficient to suspend a single sphere. However, cooperative effects result in surprisingly stable stacking. Here, we further explore this phenomenon experimentally in a simple yield stress fluid, a carbopol microgel. Depending on the yield stress of the fluid, the sphere density, and the precise alignment of the spheres, a varying number of spheres can be stacked. Although a taller stack is observed for spheres of the same size, smaller stacks are frequently formed for spheres with mixed sizes and offset centers. This stacking phenomenon is not amenable to a simple force balance analysis because of the complex interplay of viscous and yield stresses and the non-trivial deformation zone in a yield-stress fluid. This study provides new insights on the collective flow behavior of objects in structurally complex and widely used yield-stress fluids. Furthermore, this observed phenomenon can be used to check the predictive efficacy of past, present, and future constitutive models for rheologically-complex fluids.

  1. Nature of base stacking: reference quantum-chemical stacking energies in ten unique B-DNA base-pair steps.

    PubMed

    Sponer, Jirí; Jurecka, Petr; Marchan, Ivan; Luque, F Javier; Orozco, Modesto; Hobza, Pavel

    2006-03-20

    Base-stacking energies in ten unique B-DNA base-pair steps and some other arrangements were evaluated by the second-order Møller-Plesset (MP2) method, complete basis set (CBS) extrapolation, and correction for triple (T) electron-correlation contributions. The CBS(T) calculations were compared with decade-old MP2/6-31G*(0.25) reference data and AMBER force field. The new calculations show modest increases in stacking stabilization compared to the MP2/6-31G*(0.25) data and surprisingly large sequence-dependent variation of stacking energies. The absolute force-field values are in better agreement with the new reference data, while relative discrepancies between quantum-chemical (QM) and force-field values increase modestly. Nevertheless, the force field provides good qualitative description of stacking, and there is no need to introduce additional pair-additive electrostatic terms, such as distributed multipoles or out-of-plane charges. There is a rather surprising difference of about 0.1 A between the vertical separation of base pairs predicted by quantum chemistry and derived from crystal structures. Evaluations of different local arrangements of the 5'-CG-3' step indicate a sensitivity of the relative stacking energies to the level of calculation. Thus, describing quantitative relations between local DNA geometrical variations and stacking may be more complicated than usually assumed. The reference calculations are complemented by continuum-solvent assessment of solvent-screening effects.

  2. The crucial role of chelate-chelate stacking interactions in the crystal structure of a square planar copper(II) complex

    NASA Astrophysics Data System (ADS)

    Jana, Subrata; Khan, Samim; Bauzá, Antonio; Frontera, Antonio; Chattopadhyay, Shouvik

    2017-01-01

    A square planar copper(II) complex has been synthesized and characterized by elemental analysis, IR spectroscopy and single-crystal X-ray diffraction study. The X-ray structure of the complex is used to analyze the crucial role of the π-interactions in the solid state. The complex also shows significant hydrogen-bonding interactions. Moreover, we have evaluated energetically both interactions by means of high level DFT calculations (BP86-D3/def2-TZVP) and characterized them using the Bader's theory of "atoms-in-molecules".

  3. Spectrally tunable linear polarization rotation using stacked metallic metamaterials

    NASA Astrophysics Data System (ADS)

    Romain, Xavier; Baida, Fadi I.; Boyer, Philippe

    2017-08-01

    We make a theoretical study of the transmission properties of a stack of metallic metamaterials and show that is able to achieve a perfect transmission selectively exhibiting broadband (Q < 10) or extremely narrowband (Q > {10}5) polarization rotation. We especially highlight how the arrangement of the stacked structure, as well as the metamaterial unit cell geometry, has a large influence on transmission in the spectral domain. For this purpose, we use an extended analytical Jones formalism that allows us to obtain a rigorous and analytical expression of the transmission. Such versatile structures could find potential applications in polarimetry or in the control of light polarization for THz waves.

  4. Structures and IR/UV spectra of neutral and ionic phenol-Ar(n) cluster isomers (n ≤ 4): competition between hydrogen bonding and stacking.

    PubMed

    Schmies, Matthias; Patzer, Alexander; Fujii, Masaaki; Dopfer, Otto

    2011-08-21

    The structures, binding energies, and vibrational and electronic spectra of various isomers of neutral and ionic phenol-Ar(n) clusters with n ≤ 4, PhOH((+))-Ar(n), are characterized by quantum chemical calculations. The properties in the neutral and ionic ground electronic states (S(0), D(0)) are determined at the M06-2X/aug-cc-pVTZ level, whereas the S(1) excited state of the neutral species is investigated at the CC2/aug-cc-pVDZ level. The Ar complexation shifts calculated for the S(1) origin and the adiabatic ionisation potential, ΔS(1) and ΔIP, sensitively depend on the Ar positions and thus the sequence of filling the first Ar solvation shell. The calculated shifts confirm empirical additivity rules for ΔS(1) established recently from experimental spectra and enable thus a firm assignment of various S(1) origins to their respective isomers. A similar additivity model is newly developed for ΔIP using the M06-2X data. The isomer assignment is further confirmed by Franck-Condon simulations of the intermolecular vibrational structure of the S(1) ← S(0) transitions. In neutral PhOH-Ar(n), dispersion dominates the attraction and π-bonding is more stable than H-bonding. The solvation sequence of the most stable isomers is derived as (10), (11), (30), and (31) for n ≤ 4, where (km) denotes isomers with k and m Ar ligands binding above and below the aromatic plane, respectively. The π interaction is somewhat stronger in the S(1) state due to enhanced dispersion forces. Similarly, the H-bond strength increases in S(1) due to the enhanced acidity of the OH proton. In the PhOH(+)-Ar(n) cations, H-bonds are significantly stronger than π-bonds due to additional induction forces. Consequently, one favourable solvation sequence is derived as (H00), (H10), (H20), and (H30) for n ≤ 4, where (Hkm) denotes isomers with one H-bound ligand and k and m π-bonded Ar ligands above and below the aromatic plane, respectively. Another low-energy solvation motif for n = 2

  5. Room-Temperature Multi-Peak NDR in nc-Si Quantum-Dot Stacking MOS Structures for Multiple Value Memory and Logic

    NASA Astrophysics Data System (ADS)

    Qian, Xin-Ye; Chen, Kun-Ji; Huang, Jian; Wang, Yue-Fei; Fang, Zhong-Hui; Xu, Jun; Huang, Xin-Fan

    2013-07-01

    Room-temperature negative differential resistance (NDR) characteristics are observed in a nanocrystalline Si quantum dot (nc-Si QD) floating-gate MOS structure, which is fabricated by plasma-enhanced chemical vapor deposition. Clear multi-NDR peaks for the electrons and holes, shown in the I—V curves, which are significant for the application of multiple value memory and logic, are proved to be induced by electron and hole resonant tunneling into the nc-Si QDs from the substrate. The calculation results indicate that these NDR characteristics should be associated with the Coulomb blockade effect and the quantum confinement effect of the nc-Si QDs. Furthermore, low-temperature I—V characteristics are also investigated to confirm the room-temperature results.

  6. Fully ALD-grown TiN/Hf0.5Zr0.5O2/TiN stacks: Ferroelectric and structural properties

    NASA Astrophysics Data System (ADS)

    Zarubin, Sergei; Suvorova, Elena; Spiridonov, Maksim; Negrov, Dmitrii; Chernikova, Anna; Markeev, Andrey; Zenkevich, Andrei

    2016-11-01

    Since the discovery of ferroelectricity (FE) in HfO2-based thin films, they are gaining increasing attention as a viable alternative to conventional FE in the next generation of non-volatile memory devices. In order to further increase the density of elements in the integrated circuits, it is essential to adopt a three-dimensional design. Since atomic layer deposition (ALD) processes are extremely conformal, ALD is the favored approach in the production of 3D ferroelectric random access memory. Here, we report the fabrication of fully ALD-grown capacitors comprising a 10-nm-thick FE Hf0.5Zr0.5O2 layer sandwiched between TiN electrodes, which are subjected to a detailed investigation of the structural and functional properties. The robust FE properties of Hf0.5Zr0.5O2 films in capacitors are established by several alternative techniques. We demonstrate a good scalability of TiN/Hf0.5Zr0.5O2/TiN FE capacitors down to 100-nm size and the polarization retention in the test "one transistor-one capacitor" (1T-1C) cells after 1010 writing cycles. The presence of a non-centrosymmetric orthorhombic phase responsible for FE properties in the alloyed polycrystalline Hf0.5Zr0.5O2 films is established by transmission electron microscopy. Given the ability of the ALD technique to grow highly conformal films and multilayered structures, the obtained results indicate the route for the design of FE non-volatile memory devices in 3D integrated circuits.

  7. Hamiltonian approach to slip-stacking dynamics

    DOE PAGES

    Lee, S. Y.; Ng, K. Y.

    2017-06-29

    Hamiltonian dynamics has been applied to study the slip-stacking dynamics. The canonical-perturbation method is employed to obtain the second-harmonic correction term in the slip-stacking Hamiltonian. The Hamiltonian approach provides a clear optimal method for choosing the slip-stacking parameter and improving stacking efficiency. The dynamics are applied specifically to the Fermilab Booster-Recycler complex. As a result, the dynamics can also be applied to other accelerator complexes.

  8. Stacking transition in bilayer graphene caused by thermally activated rotation

    NASA Astrophysics Data System (ADS)

    Zhu, Mengjian; Ghazaryan, Davit; Son, Seok-Kyun; Woods, Colin R.; Misra, Abhishek; He, Lin; Taniguchi, Takashi; Watanabe, Kenji; Novoselov, Kostya S.; Cao, Yang; Mishchenko, Artem

    2017-03-01

    Crystallographic alignment between two-dimensional crystals in van der Waals heterostructures brought a number of profound physical phenomena, including observation of Hofstadter butterfly and topological currents, and promising novel applications, such as resonant tunnelling transistors. Here, by probing the electronic density of states in graphene using graphene-hexagonal boron nitride-graphene tunnelling transistors, we demonstrate a structural transition of bilayer graphene from incommensurate twisted stacking state into a commensurate AB stacking due to a macroscopic graphene self-rotation. This structural transition is accompanied by a topological transition in the reciprocal space and by pseudospin texturing. The stacking transition is driven by van der Waals interaction energy of the two graphene layers and is thermally activated by unpinning the microscopic chemical adsorbents which are then removed by the self-cleaning of graphene.

  9. Reliability Considerations in 3D Stacked Strata Systems

    NASA Astrophysics Data System (ADS)

    Pozder, Scott; Jain, Ankur; Jones, Robert; Huang, Zhihong; Justison, Patrick; Chatterjee, Ritwik

    2009-06-01

    The bonding of multiple silicon strata to form stacked circuits with high bandwidth connections, increased circuit densities, decreased latency and the capability to stack disparate technologies is increasingly gaining interest in the microelectronics industry. Stacking has been demonstrated using bom dielectric-to-dielectric and metal-to-metal bonds for die and wafer stratum bonding. The considerable thermal, mechanical and electromigration reliability challenges resulting from such bonding has been the focus of some recently reported work. In mis paper, the bond reliability of various bonding types, including wafer-to-wafer dielectric bond, die-to-wafer Cu/Sn-to-Cu bond and a simultaneous organic adhesive with Cu/Sn-to-Cu bond is discussed. Thermomechanical and electromigration characterization of the die-to-wafer 3D structures is also discussed. Results indicate that the intrinsic reliability of these structures can be as robust as current 2D technologies.

  10. Conserved guanine-guanine stacking in tetraplex and duplex DNA.

    PubMed

    Kypr, J; Fialová, M; Chládková, J; Tůmová, M; Vorlícková, M

    2001-12-01

    Using a series of suitably chosen oligonucleotides, we demonstrate that the DNA duplex of d(CCCCGGGG) provides an almost identical CD spectrum as the parallel-stranded tetraplex of d(GGGG). The CD spectra are very sensitive to base stacking in DNA so that the above observation indicates that guanine-guanine stacking is essentially the same within the duplex of d(CCCCGGGG) and the tetraplex of d(GGGG). A very similar CD spectrum is also provided by the A-form of d(CCCCGGGG) induced by trifluoroethanol. These results reveal that guanine-guanine stacking is a structural invariant conserved in various nucleic acid conformers. The structural invariance is likely to cohere with evolution of the genetic molecules and be important for fundamental functions, e.g. initiation of transcription.

  11. Hydrogen bonding, π–π stacking and van der Waals forces-dominated layered regions in the crystal structure of 4-amino­pyridinium hydrogen (9-phosphono­non­yl)phospho­nate

    PubMed Central

    van Megen, Martin; Reiss, Guido J.; Frank, Walter

    2016-01-01

    The asymmetric unit of the title mol­ecular salt, [C5H7N2 +][(HO)2OP(CH2)9PO2(OH)−], consists of one 4-amino­pyridinium cation and one hydrogen (9-phos­phono­non­yl)phospho­nate anion, both in general positions. As expected, the 4-amino­pyridinium moieties are protonated exclusively at their endocyclic nitro­gen atom due to a mesomeric stabilization by the imine form which would not be given in the corresponding double-protonated dicationic species. In the crystal, the phosphonyl (–PO3H2) and hydrogen phospho­nate (–PO3H) groups of the anions form two-dimensional O—H⋯O hydrogen-bonded networks in the ab plane built from 24-membered hydrogen-bonded ring motifs with the graph-set descriptor R 6 6(24). These networks are pairwise linked by the anions’ alkyl­ene chains. The 4-amino­pyridinium cations are stacked in parallel displaced face-to-face arrangements and connect neighboring anionic substructures via medium–strong charge-supported N—H⋯O hydrogen bonds along the c axis. The resulting three-dimensional hydrogen-bonded network shows clearly separated hydro­philic and hydro­phobic structural domains. PMID:27746940

  12. LETTER TO THE EDITOR: High colour rendering index non-doped-type white organic light-emitting devices with a RGB-stacked multilayer structure

    NASA Astrophysics Data System (ADS)

    Xie, Wenfa; Zhao, Yi; Li, Chuannan; Liu, Shiyong

    2005-12-01

    A non-doped-type white organic light-emitting device with high colour rendering index has been reported. The structure of the device is ITO/NPB (50 nm)/TPBI (3 nm)/Alq3 (d nm)/DCM2 (0.1 nm)/TPBI (40 - d nm)/Alq3 (10 nm)/LiF/Al, where NPB is N, N'-bis-(1-naphthyl)-N, N'-diphenyl-1, 1'-biph-enyl-4, 4'-diamine, TPBI is 2, 2', 2''-(1, 3, 5-phenylene) tris(1-phenyl-1H-benzimidazole), Alq3 is tris (8-hydroxyquinoline) aluminium, DCM2 is [2-methyl-6-[2-(2, 3, 6, 7-tetrahydro-1H, 5H-benzo[ij] quinolizin-9-yl)ethenyl]-4H-pyran-4-ylidene] propane-dinitrile. Through the optimization of d, pure white emission with CIE coordinates of (0.3198, 0.3400) at 9 V was obtained, at which the colour temperature and colour rendering index were 6080 K and 97, respectively. The CIE coordinates of the device change from (0.4552, 0.3867) at 4 V to (0.2864, 0.2865) at 19 V that are well in the white region. Its maximum luminance was 10 855 cd m-2 at 19 V and maximum power efficiency was 1.31 lm W-1 at 5 V.

  13. Helping Students Design HyperCard Stacks.

    ERIC Educational Resources Information Center

    Dunham, Ken

    1995-01-01

    Discusses how to teach students to design HyperCard stacks. Highlights include introducing HyperCard, developing storyboards, introducing design concepts and scripts, presenting stacks, evaluating storyboards, and continuing projects. A sidebar presents a HyperCard stack evaluation form. (AEF)

  14. 49 CFR 178.980 - Stacking test.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 49 Transportation 3 2013-10-01 2013-10-01 false Stacking test. 178.980 Section 178.980... Packagings § 178.980 Stacking test. (a) General. The stacking test must be conducted for the qualification of... test. (1) All Large Packagings except flexible Large Packaging design types must be loaded to...

  15. 49 CFR 178.606 - Stacking test.

    Code of Federal Regulations, 2013 CFR

    2013-10-01

    ... 49 Transportation 3 2013-10-01 2013-10-01 false Stacking test. 178.606 Section 178.606... Packagings and Packages § 178.606 Stacking test. (a) General. All packaging design types other than bags must be subjected to a stacking test. (b) Number of test samples. Three test samples are required for...

  16. Precision Cosmography with Stacked Voids

    NASA Astrophysics Data System (ADS)

    Lavaux, Guilhem; Wandelt, Benjamin D.

    2012-08-01

    We present a purely geometrical method for probing the expansion history of the universe from the observation of the shape of stacked voids in spectroscopic redshift surveys. Our method is an Alcock-Paczyński (AP) test based on the average sphericity of voids posited on the local isotropy of the universe. It works by comparing the temporal extent of cosmic voids along the line of sight with their angular, spatial extent. We describe the algorithm that we use to detect and stack voids in redshift shells on the light cone and test it on mock light cones produced from N-body simulations. We establish a robust statistical model for estimating the average stretching of voids in redshift space and quantify the contamination by peculiar velocities. Finally, assuming that the void statistics that we derive from N-body simulations is preserved when considering galaxy surveys, we assess the capability of this approach to constrain dark energy parameters. We report this assessment in terms of the figure of merit (FoM) of the dark energy task force and in particular of the proposed Euclid mission which is particularly suited for this technique since it is a spectroscopic survey. The FoM due to stacked voids from the Euclid wide survey may double that of all other dark energy probes derived from Euclid data alone (combined with Planck priors). In particular, voids seem to outperform baryon acoustic oscillations by an order of magnitude. This result is consistent with simple estimates based on mode counting. The AP test based on stacked voids may be a significant addition to the portfolio of major dark energy probes and its potentialities must be studied in detail.

  17. PRECISION COSMOGRAPHY WITH STACKED VOIDS

    SciTech Connect

    Lavaux, Guilhem; Wandelt, Benjamin D.

    2012-08-01

    We present a purely geometrical method for probing the expansion history of the universe from the observation of the shape of stacked voids in spectroscopic redshift surveys. Our method is an Alcock-Paczynski (AP) test based on the average sphericity of voids posited on the local isotropy of the universe. It works by comparing the temporal extent of cosmic voids along the line of sight with their angular, spatial extent. We describe the algorithm that we use to detect and stack voids in redshift shells on the light cone and test it on mock light cones produced from N-body simulations. We establish a robust statistical model for estimating the average stretching of voids in redshift space and quantify the contamination by peculiar velocities. Finally, assuming that the void statistics that we derive from N-body simulations is preserved when considering galaxy surveys, we assess the capability of this approach to constrain dark energy parameters. We report this assessment in terms of the figure of merit (FoM) of the dark energy task force and in particular of the proposed Euclid mission which is particularly suited for this technique since it is a spectroscopic survey. The FoM due to stacked voids from the Euclid wide survey may double that of all other dark energy probes derived from Euclid data alone (combined with Planck priors). In particular, voids seem to outperform baryon acoustic oscillations by an order of magnitude. This result is consistent with simple estimates based on mode counting. The AP test based on stacked voids may be a significant addition to the portfolio of major dark energy probes and its potentialities must be studied in detail.

  18. Boiler Stack Gas Heat Recovery

    DTIC Science & Technology

    1987-09-01

    Based upon "economic analysis of available options, three cost- effective methods of recovering waste heat were identified: the conventional economizer...upon economic analysis of available options, three cost- effective methods of Continued DO I IA.N1 1473 EDITION OF I NOV AS IS OBSOLETE S Y C O OF...energy loss in a boiler is attributable to the hot flue gas leaving the stack. Thus, the most effective method to save fuel is to recover as much

  19. Stack Monitor Operating Experience Review

    SciTech Connect

    L. C. Cadwallader; S. A. Bruyere

    2009-05-01

    Stack monitors are used to sense radioactive particulates and gases in effluent air being vented from rooms of nuclear facilities. These monitors record the levels and types of effluents to the environment. This paper presents the results of a stack monitor operating experience review of the U.S. Department of Energy (DOE) Occurrence Reporting and Processing System (ORPS) database records from the past 18 years. Regulations regarding these monitors are briefly described. Operating experiences reported by the U.S. DOE and in engineering literature sources were reviewed to determine the strengths and weaknesses of these monitors. Electrical faults, radiation instrumentation faults, and human errors are the three leading causes of failures. A representative “all modes” failure rate is 1E-04/hr. Repair time estimates vary from an average repair time of 17.5 hours (with spare parts on hand) to 160 hours (without spare parts on hand). These data should support the use of stack monitors in any nuclear facility, including the National Ignition Facility and the international ITER project.

  20. The ELSA-Flood-Stack: A reconstruction from the laminated sediments of Eifel maar structures during the last 60 000 years

    NASA Astrophysics Data System (ADS)

    Brunck, H.; Sirocko, F.; Albert, J.

    2016-07-01

    This study reconstructs the main flood phases in central Europe from event layers in sediment cores from Holocene Eifel maar lakes and Pleistocene dry maar structures. These reconstructions are combined with recent gauge time-series to cover the entire precipitation extremes of the last 60 000 years. In general, Eifel maar sediments are perfectly suited for the preservation of event layers since the deep water in the maar lakes is seasonal anoxic and therefore, bioturbation is low. However, the preservation of annual lamination is only preserved in Holzmaar and Ulmener Maar; the other cores are dated by 14C, magnetostratigraphy, tephra markers and ice core tuning. The cores were drilled in the Eifel region of central western Germany, which represents a climatic homogenous region from Belgium to Poland and all across Central Europe. A total of 233 flood layers over 7.5 mm were detected in all analysed cores. The stratigraphic classification of the flood events follows the newly defined Landscape Evolution Zones (LEZ). The strongest events in the Holocene have occurred during LEZ 1 (0-6000 b2k) in the years 658, 2800 and 4100 b2k. Flood layers in the LEZ 2 (6000-10 500 b2k) are not as frequent as during the LEZ 1, nevertheless, the floods cluster between 6000 and 6500 b2k. Twenty flood layers are found in the LEZ 3 (10 500-14 700 b2k); 11 in LEZ 4 (14 700-21 000 b2k); 15 in LEZ 5 (21 000-28 500 b2k); 34 in LEZ 6 (28 500-36 500 b2k); 8 in LEZ 7 (36 500-49 000 b2k); zero in LEZ 8 (49 000-55 000 b2k) and LEZ 9 (55 000-60 000 b2k). The maximum flood phases during the Pleistocene are at 11 500-17 500 (late glacial and Younger Dryas), 23 000-24 000 (before Greenland Interstadial (GI) 2), 29 000-35 000 (especially between GI 5 and 4) and 44 000-44 500 b2k (transition from GI 12 to 11). The variations in flood dynamics are climatically driven and mainly associated with climate transitions and colder periods, combined with light vegetation. It turns out that low vegetation

  1. Stacks

    ERIC Educational Resources Information Center

    Kimber, Lizzie

    2010-01-01

    Linton Waters and Jayne Kranat ran a session on the Nuffield "Applying Mathematical Processes" (AMP) activities at BCME7 in Manchester in April this year. These 1-2 hour activities are revamps of some of the Graded Assessment in Mathematics (GAIM) resources, developed in the 1980s, and are freely available via the Nuffield website and…

  2. Engineering discrete stacks of aromatic molecules.

    PubMed

    Klosterman, Jeremy K; Yamauchi, Yoshihiro; Fujita, Makoto

    2009-06-01

    Intrigued by transannular interactions occurring in stacked aromatic molecules, chemists have long endeavored to engineer discrete stacks of specific lengths and orientation. The maturation of self-assembly methodologies has shifted the focus away from utilizing covalent scaffolds to harnessing non-covalent interactions such as ionic interactions, hydrogen bonds, metal-ligand interactions, and aromatic interactions. Aromatic molecules often assemble into ill-defined, infinite aggregates and thus multiple self-assembly techniques must be combined to achieve the desired stack size and conformations. This critical review briefly highlights covalent scaffolds of stack aromatics before focusing on modern self-assembly based strategies for engineering discrete stacks of aromatic molecules (149 references).

  3. Geometric Patterns for Neighboring Bases Near the Stacked State in Nucleic Acid Strands.

    PubMed

    Sedova, Ada; Banavali, Nilesh K

    2017-03-14

    Structural variation in base stacking has been analyzed frequently in isolated double helical contexts for nucleic acids, but not as often in nonhelical geometries or in complex biomolecular environments. In this study, conformations of two neighboring bases near their stacked state in any environment are comprehensively characterized for single-strand dinucleotide (SSD) nucleic acid crystal structure conformations. An ensemble clustering method is used to identify a reduced set of representative stacking geometries based on pairwise distances between select atoms in consecutive bases, with multiple separable conformational clusters obtained for categories divided by nucleic acid type (DNA/RNA), SSD sequence, stacking face orientation, and the presence or absence of a protein environment. For both DNA and RNA, SSD conformations are observed that are either close to the A-form, or close to the B-form, or intermediate between the two forms, or further away from either form, illustrating the local structural heterogeneity near the stacked state. Among this large variety of distinct conformations, several common stacking patterns are observed between DNA and RNA, and between nucleic acids in isolation or in complex with proteins, suggesting that these might be stable stacking orientations. Noncanonical face/face orientations of the two bases are also observed for neighboring bases in the same strand, but their frequency is much lower, with multiple SSD sequences across categories showing no occurrences of such unusual stacked conformations. The resulting reduced set of stacking geometries is directly useful for stacking-energy comparisons between empirical force fields, prediction of plausible localized variations in single-strand structures near their canonical states, and identification of analogous stacking patterns in newly solved nucleic acid containing structures.

  4. Porphyrin π-stacking in a heme protein scaffold tunes gas ligand affinity.

    PubMed

    Weinert, Emily E; Phillips-Piro, Christine M; Marletta, Michael A

    2013-10-01

    The role of π-stacking in controlling redox and ligand binding properties of porphyrins has been of interest for many years. The recent discovery of H-NOX domains has provided a model system to investigate the role of porphyrin π-stacking within a heme protein scaffold. Removal of a phenylalanine-porphyrin π-stack dramatically increased O2, NO, and CO affinities and caused changes in redox potential (~40mV) without any structural changes. These results suggest that small changes in redox potential affect ligand affinity and that π-stacking may provide a novel route to engineer heme protein properties for new functions.

  5. Analyzing Stack Flows to Compare Java Programs

    NASA Astrophysics Data System (ADS)

    Lim, Hyun-Il; Han, Taisook

    This paper presents a method for comparing and detecting clones of Java programs by analyzing program stack flows. A stack flow denotes an operational behavior of a program by describing individual instructions and stack movements for performing specific operations. We analyze stack flows by simulating the operand stack movements during execution of a Java program. Two programs for detection of clones of Java programs are compared by matching similar pairs of stack flows in the programs. Experiments were performed on the proposed method and compared with the earlier approaches of comparing Java programs, the Tamada, k-gram, and stack pattern based methods. Their performance was evaluated with real-world Java programs in several categories collected from the Internet. The experimental results show that the proposed method is more effective than earlier methods of comparing and detecting clones of Java programs.

  6. Lattice Stacking Interactions: Comparisons between bilayer graphene and silicene

    NASA Astrophysics Data System (ADS)

    Carey, David; Roome, Nathanael

    2015-03-01

    The stacking arrangement of atoms in elemental 2D materials, such as graphene and silicene, plays a crucial role in determining their structural, electronic and vibrational properties. The weaker π bonding in silicene results in atomic buckling, and previously we have found linear band dispersion in a low atom buckling geometry with a Fermi velocity about 2/3 that of graphene and electron-phonon matrix elements are about a factor of 25 times smaller than in graphene. Here we investigate the properties of different stacking configurations of bilayer silicene with those of bilayer graphene (BLG). In the case of BLG there are two stable configurations AA and AB stacking, with no atomic buckling present. In the case of bilayer silicene the presence of buckling and the different stacking arrangements results in a range of stable configurations. We calculate the frequencies of the IR and Raman active modes as a means to identify the different bonding and stacking configurations. This approach of fingerprint identification is applicable to other elemental layered materials.

  7. Pi-stacked interactions in explosive crystals: buffers against external mechanical stimuli.

    PubMed

    Zhang, Chaoyang; Wang, Xiaochuan; Huang, Hui

    2008-07-02

    The pi-stacked interactions in some explosive crystal packing are discussed. Taking a typical pi-stacked explosive 2,4,6-trinitrobenzene-1,3,5-triamine (TATB) as a sample and using molecular simulations, we investigated the nature of the pi-stacked interactions versus the external mechanical stimuli causing possible slide and compression of explosives. As a result, between the neighbor layers in the TATB unit cell, the electrostatic attraction decreases with a little decrease of vdW attraction when its top layer slides, whereas the vdW attraction increases with a decrease of electrostatic attraction when TATB crystal is compressed along its c axis. Meanwhile, we studied the correlation between the pi-stacked structures and the impact sensitivities of explosives by means of three representatives including TATB with typical planar pi-stacked structures, 2,2-dinitroethylene-1,1-diamine (Fox-7) with wavelike pi-stacked structures, and 1,3,5,7-tetranitro-1,3,5,7-tetrazocane (HMX) without pi-stacked structure. The results showed that pi-stacked structures, particularly planar layers, can effectively buffer against external mechanical stimuli. That is, pi-stacked structures can partly convert the mechanical energy acting on them into their intermolecular interaction energy, to avoid the increase of the molecular vibration resulting in the explosive decomposition, the formation of hot spots, and the final detonation. This is another reason for the low mechanical sensitivity of pi-stacked explosives besides their stable conjugated molecular structures.

  8. Self-biased reconfigurable graphene stacks for terahertz plasmonics

    NASA Astrophysics Data System (ADS)

    Gomez-Diaz, J. S.; Moldovan, C.; Capdevila, S.; Romeu, J.; Bernard, L. S.; Magrez, A.; Ionescu, A. M.; Perruisseau-Carrier, J.

    2015-03-01

    The gate-controllable complex conductivity of graphene offers unprecedented opportunities for reconfigurable plasmonics at terahertz and mid-infrared frequencies. However, the requirement of a gating electrode close to graphene and the single ‘control knob’ that this approach offers limits the practical implementation and performance of these devices. Here we report on graphene stacks composed of two or more graphene monolayers separated by electrically thin dielectrics and present a simple and rigorous theoretical framework for their characterization. In a first implementation, two graphene layers gate each other, thereby behaving as a controllable single equivalent layer but without any additional gating structure. Second, we show that adding an additional gate allows independent control of the complex conductivity of each layer within the stack and provides enhanced control on the stack equivalent complex conductivity. These results are very promising for the development of THz and mid-infrared plasmonic devices with enhanced performance and reconfiguration capabilities.

  9. Self-biased reconfigurable graphene stacks for terahertz plasmonics.

    PubMed

    Gomez-Diaz, J S; Moldovan, C; Capdevila, S; Romeu, J; Bernard, L S; Magrez, A; Ionescu, A M; Perruisseau-Carrier, J

    2015-03-02

    The gate-controllable complex conductivity of graphene offers unprecedented opportunities for reconfigurable plasmonics at terahertz and mid-infrared frequencies. However, the requirement of a gating electrode close to graphene and the single 'control knob' that this approach offers limits the practical implementation and performance of these devices. Here we report on graphene stacks composed of two or more graphene monolayers separated by electrically thin dielectrics and present a simple and rigorous theoretical framework for their characterization. In a first implementation, two graphene layers gate each other, thereby behaving as a controllable single equivalent layer but without any additional gating structure. Second, we show that adding an additional gate allows independent control of the complex conductivity of each layer within the stack and provides enhanced control on the stack equivalent complex conductivity. These results are very promising for the development of THz and mid-infrared plasmonic devices with enhanced performance and reconfiguration capabilities.

  10. Supra-Nanoparticle Functional Assemblies through Programmable Stacking.

    PubMed

    Tian, Cheng; Cordeiro, Marco Aurelio L; Lhermitte, Julien; Xin, Huolin L; Shani, Lior; Liu, Mingzhao; Ma, Chunli; Yeshurun, Yosef; DiMarzio, Donald; Gang, Oleg

    2017-07-25

    The quest for the by-design assembly of material and devices from nanoscale inorganic components is well recognized. Conventional self-assembly is often limited in its ability to control material morphology and structure simultaneously. Here, we report a general method of assembling nanoparticles in a linear "pillar" morphology with regulated internal configurations. Our approach is inspired by supramolecular systems, where intermolecular stacking guides the assembly process to form diverse linear morphologies. Programmable stacking interactions were realized through incorporation of DNA coded recognition between the designed planar nanoparticle clusters. This resulted in the formation of multilayered pillar architectures with a well-defined internal nanoparticle organization. By controlling the number, position, size, and composition of the nanoparticles in each layer, a broad range of nanoparticle pillars were assembled and characterized in detail. In addition, we demonstrated the utility of this stacking assembly strategy for investigating plasmonic and electrical transport properties.

  11. Hen eggwhite-mediated stack crystallization of calcium carbonate

    NASA Astrophysics Data System (ADS)

    Hu, Yanli; Ma, Yongjun; Zhou, Yong; Nie, Fude; Duan, Xiaohui; Pei, Chonghua

    2010-03-01

    In this paper, the stack-like crystallization of calcium carbonate in the presence of hen eggwhite under direct drying and vacuum freeze drying was investigated, and marked morphological changes in the calcium carbonate particles were observed depending on the reaction condition used. Scanning electron microscopy (SEM), Powder X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FT-IR), Transmission electron microscopy (TEM), and Nano Mechanical Tester were employed to characterize the samples. Results indicate that gelling eggwhite-mediated the formation of the "stack-like" layered calcium carbonate aggregates composed of considerable nanosheets under direct drying while only rhombohedra calcite crystal (1 0 4) was formed without any additives. An analogous structure to the brick-and-mortar arrangement was attainted by vacuum freeze drying. The average elastic modulus and the hardness of "stack-like" calcium carbonate hybrid material were assessed 0.9952 and 0.0415 GPa with Nano-indenter test, respectively.

  12. Magneto-optical properties of ABC-stacked trilayer graphene.

    PubMed

    Lin, Yi-Ping; Lin, Chiun-Yan; Ho, Yen-Hung; Do, Thi-Nga; Lin, Ming-Fa

    2015-06-28

    The generalized tight-binding model is developed to investigate the magneto-optical absorption spectra of ABC-stacked trilayer graphene. The absorption peaks can be classified into nine categories of inter-Landau-level optical excitations, including three intra-group and six inter-group ones. Most of them belong to the twin-peak structures because of the asymmetric Landau level spectrum. The threshold absorption peak alone comes from a certain excitation channel, and its frequency is associated with a specific interlayer atomic interaction. The Landau-level anticrossings cause extra absorption peaks. Moreover, a simple relationship between the absorption frequency and the field strength is absent. The magneto-optical properties of ABC-stacked trilayer graphene are totally different from those of AAA- and ABA-stacked ones, such as the number, intensity and frequency of absorption peaks.

  13. Assembling multiporphyrin stacks inside the DNA double helix.

    PubMed

    Vybornyi, Mykhailo; Nussbaumer, Alina L; Langenegger, Simon M; Häner, Robert

    2014-10-15

    Double stranded DNA hybrids containing up to four consecutive, face-to-face stacked porphyrins are described. Non-nucleosidic, 5,15-bisphenyl-substituted porphyrin building blocks were incorporated into complementary oligonucleotide strands. Upon hybridization multiple porphyrins are well accommodated inside the DNA scaffold without disturbing the overall B-DNA structure. The formation of double strands containing up to four free base porphyrins is enabled without compromising duplex stability. UV/vis, fluorescence, and CD spectroscopy demonstrate the formation of porphyrins H-aggregates inside the DNA double helix and provide evidence for the existence of strong excitonic coupling between interstrand stacked porphyrins. H-aggregation results in considerable fluorescence quenching. Most intense CD effects are observed in stacks containing four porphyrins. The findings demonstrate the value of DNA for the controlled formation of molecularly defined porphyrin aggregates.

  14. Gate stack engineering for GaN lateral power transistors

    NASA Astrophysics Data System (ADS)

    Yang, Shu; Liu, Shenghou; Liu, Cheng; Hua, Mengyuan; Chen, Kevin J.

    2016-02-01

    Developing optimal gate-stack technology is a key to enhancing the reliability and performance of GaN insulated-gate devices for high-voltage power switching applications. In this paper, we discuss current challenges and review our recent progresses in gate-stack technology development toward high-performance and high-reliability GaN power devices, including (1) interface engineering that creates a high-quality dielectric/III-nitride interface with low trap density; (2) barrier-layer engineering that enables optimal trade-off between performance and stability; (3) bulk quality and reliability enhancement of the gate dielectric. These gate-stack techniques in terms of new process development and device structure design are valuable to realize highly reliable and competitive GaN power devices.

  15. Calculated state densities of aperiodic nucleotide base stacks

    NASA Astrophysics Data System (ADS)

    Ye, Yuan-Jie; Chen, Run-Shen; Martinez, Alberto; Otto, Peter; Ladik, Janos

    2000-05-01

    Electronic density of states (DOS) histograms and of the nucleotide base stack regions of a segment of human oncogene (both single and double stranded, in B conformation) and of single-stranded random DNA base stack (also in B conformation), were calculated. The computations were performed with the help of the ab initio matrix block negative factor counting (NFC) method for the DOSs. The neglected effects of the sugar-phosphate chain and the water environment (with the counterions) were assessed on the basis of previous ab initio band structure calculations. Further, in the calculation of single nucleotide base stacks also basis set and correlation effects have been investigated. In the case of a single strand the level spacing widths of the allowed regions and the fundamental gap were calculated also with Clementi's double ς basis and corrected for correlation at the MP2 level. The inverse interaction method was applied for the study of Anderson localization.

  16. SLS Engine Section Test Article Moved for Stacking at Michoud

    NASA Image and Video Library

    2017-04-25

    Stacking is underway for the Space Launch System core stage engine section structural qualification test article at NASA's Michoud Assembly Facility in New Orleans. The rocket's engine section is the bottom of the core stage and houses the four RS-25 engines. The engine section test article was moved to Michoud's Cell A in Building 110 for vertical stacking with hardware that simulates the rocket's liquid hydrogen tank, which is the fuel tank that joins to the engine section. Once stacked, the entire test article will load onto the barge Pegasus and ship to NASA's Marshall Space Flight Center in Huntsville, Alabama. There, it will be subjected to millions of pounds of force during testing to ensure the hardware can withstand the incredible stresses of launch.

  17. Measurements with reticulated vitreous carbon stacks in thermoacoustic prime movers and refrigerators

    SciTech Connect

    Adeff, J.A.; Hofler, T.J.; Atchley, A.A.; Moss, W.C.

    1998-07-01

    Reticulated vitreous carbon has been successfully used as a stack material in thermoacoustic prime movers and refrigerators. It is a rigid glassy carbon material, with a porous spongelike structure. Test results indicate peak pressure amplitudes of up to 32{percent} in a prime mover, and refrigeration performance comparable to that of a traditional plastic roll stack. {copyright} {ital 1998 Acoustical Society of America.}

  18. A High Volume Stack Sampler

    NASA Technical Reports Server (NTRS)

    Boubel, Richard W.

    1971-01-01

    The stack sampler described in this paper has been developed to overcome the difficulties of particulate sampling with presently available equipment. Its use on emissions from hog fuel fired boilers, back-fired incinerators, wigwam burners, asphalt plants, and seed cleaning cyclones is reported. The results indicate that the sampler is rapid and reliable in its use. It is relatively simple and inexpensive to operate. For most sources it should be considered over the more complicated and expensive sampling trains being used and specified.

  19. A High Volume Stack Sampler

    NASA Technical Reports Server (NTRS)

    Boubel, Richard W.

    1971-01-01

    The stack sampler described in this paper has been developed to overcome the difficulties of particulate sampling with presently available equipment. Its use on emissions from hog fuel fired boilers, back-fired incinerators, wigwam burners, asphalt plants, and seed cleaning cyclones is reported. The results indicate that the sampler is rapid and reliable in its use. It is relatively simple and inexpensive to operate. For most sources it should be considered over the more complicated and expensive sampling trains being used and specified.

  20. Study of Boundary Structures.

    DTIC Science & Technology

    1982-09-01

    THEORY OF ABC-CBA STACKING BOUNDARY IN fcc STRUCTURE .......... 11 - 4 TRANSITIONS AND PHASE EQUILIBRIA AMONG GRAIN BOUNDARY STRUCTURES...19 B THEORY OF ABC-CBA STACKING BOUNDARY IN fcc STRUCTURE .......... 37 C TRANSITIONS AND PHASE EQUILIBRIA AMONG GRAIN BOUNDARY...layer structure. 10 SECTION 3 THEORY OF ABC-CBA STACKING BOUNDARY IN fcc STRUCTURE The (111) planes of the fcc structure is stacked as ABCABC... as

  1. Influence of different sulfur to selenium ratios on the structural and electronic properties of Cu(In,Ga)(S,Se){sub 2} thin films and solar cells formed by the stacked elemental layer process

    SciTech Connect

    Mueller, B. J.; Zimmermann, C.; Haug, V. Koehler, T.; Zweigart, S.; Hergert, F.; Herr, U.

    2014-11-07

    In this study, we investigate the effect of different elemental selenium to elemental sulfur ratios on the chalcopyrite phase formation in Cu(In,Ga)(S,Se){sub 2} thin films. The films are formed by the stacked elemental layer process. The structural and electronic properties of the thin films and solar cells are analyzed by means of scanning electron microscopy, glow discharge optical emission spectrometry, X-ray diffraction, X-ray fluorescence, Raman spectroscopy, spectral photoluminescence as well as current-voltage, and quantum efficiency measurements. The influence of different S/(S+Se) ratios on the anion incorporation and on the Ga/In distribution is investigated. We find a homogenous sulfur concentration profile inside the film from the top surface to the bottom. External quantum efficiency measurements show that the band edge of the solar cell device is shifted to shorter wavelength, which enhances the open-circuit voltages. The relative increase of the open-circuit voltage with S/(S+Se) ratio is lower than expected from the band gap energy trend, which is attributed to the presence of S-induced defects. We also observe a linear decrease of the short-circuit current density with increasing S/(S+Se) ratio which can be explained by a reduced absorption. Above a critical S/(S+Se) ratio of around 0.61, the fill factor drops drastically, which is accompanied by a strong series resistance increase which may be attributed to changes in the back contact or p-n junction properties.

  2. Status of MCFC stack development at Hitachi

    SciTech Connect

    Takashima, S.; Kahara, T.; Takeuchi, M.

    1996-12-31

    Hitachi, Ltd. has been developing Molten Carbonate Fuel Cells in the New Sunshine project in Japan, and Hitachi is taking part in the development of 1,000kW MCFC pilot plant at Kawagoe. Hitachi is engaged in system planning of the 1,000kW pilot plant, design and manufacturing of the reformer subsystem and the fuel cell subsystem, and design and manufacturing of the 250kW stacks for the 1,000kW plant. The 250kW stacks are developed on the basis of the results of the 100kW stack in 1993 and the following 25kW stack in 1994. In parallel to the stack development, Hitachi is also conducting researches for long endurance cells and stacks. In addition to the researches for anode, cathode, electrolyte, and electrolyte matrix, improvement of temperature distribution in stacks is investigated to extend the stack life. This paper describes the planning status of the 250kW stacks for the 1,000kW MCFC plant and the developing status of stack cooling method for longer life.

  3. Stacking faults in nonstoichiometric titanium sulfide

    NASA Astrophysics Data System (ADS)

    Onoda, Mitsuko; Saeki, Masanobu; Kawada, Isao

    1981-05-01

    The structure analysis of titanium sulfide with stacking faults was attempted by modifying the matrix method given by Kakinoki and Komura. The analyses were made for X-ray powder diffraction patterns of faulted Ti 1+ xS 2 which were synthesized at relatively low temperatures. A low-temperature model was obtained by assuming that the slides, which cause the faults, occur only between the S-Ti-S sandwiches. The experimental result for 2H-Ti 1.28S 2, which was synthesized at 410°C, was interpreted satisfactorily. An extended model was attempted for 6R-Ti 1.34S 2, which was synthesized at 600°C, and the experimental results could be explained approximately.

  4. Mechanically stacked concentrator tandem solar cells

    NASA Technical Reports Server (NTRS)

    Andreev, V. M.; Rumyantsev, V. D.; Karlina, L. B.; Kazantsev, A. B.; Khvostikov, V. P.; Shvarts, M. Z.; Sorokina, S. V.

    1995-01-01

    Four-terminal mechanically stacked solar cells were developed for advanced space arrays with line-focus reflective concentrators. The top cells are based on AlGaAs/GaAs multilayer heterostructures prepared by low temperature liquid phase epitaxy. The bottom cells are based on heteroepitaxial InP/InGaAs liquid phase epitaxy or on homo-junction GaSb, Zn-diffused structures. The sum of the highest reached efficiencies of the top and bottom cells is 29.4 percent. The best four-terminal tandems have an efficiency of 27 to 28 percent. Solar cells were irradiated with 1 MeV electrons and their performances were determined as a function of fluence up to 10(exp 16) cm(exp-2). It was shown that the radiation resistance of developed tandem cells is similar to the most radiative stable AlGaAs/GaAs cells with a thin p-GaAs photoactive layer.

  5. Designer Infrared Filters using Stacked Metal Lattices

    NASA Technical Reports Server (NTRS)

    Smith, Howard A.; Rebbert, M.; Sternberg, O.

    2003-01-01

    We have designed and fabricated infrared filters for use at wavelengths greater than or equal to 15 microns. Unlike conventional dielectric filters used at the short wavelengths, ours are made from stacked metal grids, spaced at a very small fraction of the performance wavelengths. The individual lattice layers are gold, the spacers are polyimide, and they are assembled using integrated circuit processing techniques; they resemble some metallic photonic band-gap structures. We simulate the filter performance accurately, including the coupling of the propagating, near-field electromagnetic modes, using computer aided design codes. We find no anomalous absorption. The geometrical parameters of the grids are easily altered in practice, allowing for the production of tuned filters with predictable useful transmission characteristics. Although developed for astronomical instrumentation, the filters arc broadly applicable in systems across infrared and terahertz bands.

  6. T phase observations in global seismogram stacks

    NASA Astrophysics Data System (ADS)

    Buehler, J. S.; Shearer, P. M.

    2015-08-01

    The T phase, conversion of acoustic to seismic energy, is typically observed as a high-frequency wave train at hydrophones or coastal seismic stations. Here we show that the T phase can be observed in broadband waveform stacks of ˜5200 earthquakes recorded by the Global Seismic Network. To enhance the phase arrivals in stacks, we apply short-time window average over long-time window average filtering to individual traces before stacking. Although the T phase arrival is visible in stacks from seismograms filtered at 0.5-5 Hz, it appears much stronger at higher frequencies (2-8 Hz) and is further enhanced by only stacking seismograms from oceanic paths. Stacking only subsets of the data depending on continental path lengths on the receiver side shows that the T phase can be observed at stations up to 4∘ inland from the coast, and changes in the T phase arrival time correspond to reasonable crustal velocities.

  7. Prediction of temperature profile in MCFC stack

    SciTech Connect

    Lee, Kab Soo; Kim, Hwayong; Hong, Seong-An; Lim, Hee Chun

    1996-12-31

    A simple three dimensional model was developed to simulate the temperature distribution and the performance of various flow types of the MCFC stack. The objective of this study was to understand the complicated phenomena occurring in the MCFC stack and to supply the basic data for optimizing the operating condition of the MCFC stack. Assuming that the stack consists of a number of differential elements which have uniform temperature and gas composition, the model was solved by finite difference method. The performance of this model was demonstrated by comparing the calculated value with experimental data of the 1.5kW class co-flow type MCFC stack operated in KIST. This model can be utilized as a simple diagnostic tool in case of the operational abnormality such as the hot spot which often occurs inside the stack.

  8. Ultra-dark graphene stack metamaterials

    NASA Astrophysics Data System (ADS)

    Chugh, Sunny; Man, Mengren; Chen, Zhihong; Webb, Kevin J.

    2015-02-01

    We present a fabrication method to achieve a graphene stack metamaterial, a periodic array of unit cells composed of graphene and a thin insulating spacer, that allows accumulation of the strong absorption from individual graphene sheets and low reflectivity from the stack. The complex sheet conductivity of graphene from experimental data models the measured power transmitted as a function of wavelength and number of periods in the stack. Simulated results based on the extracted graphene complex sheet conductivity for thicker stacks suggest that the graphene stack reflectivity and the per-unit-length absorption can be controlled to exceed the performance of competing light absorbers. Furthermore, the electrical properties of graphene coupled with the stack absorption characteristics provide for applications in optoelectronic devices.

  9. Manifold seal for fuel cell stack assembly

    DOEpatents

    Schmitten, Phillip F.; Wright, Maynard K.

    1989-01-01

    An assembly for sealing a manifold to a stack of fuel cells includes a first resilient member for providing a first sealing barrier between the manifold and the stack. A second resilient member provides a second sealing barrier between the manifold and the stack. The first and second resilient members are retained in such a manner as to define an area therebetween adapted for retaining a sealing composition.

  10. Improvement of Phosphoric Acid Fuel Cell Stacks.

    DTIC Science & Technology

    1980-07-01

    cell stacks. Stack assembly techniques using both prefilled and dry matrices with wick filling were employed with equally good results. Phenolic fiber...matrix to provide edge sealing, with no cement being used (except to position the electrodes on the bipolar plate). The stack is assembled with prefilled ...used in the wet assembly technique. Prior to use, the acid is heated to 170 0F. Next, 16 to 20 ml of acid is applied by syringe uniformly over the 5 in

  11. Hydrogen Embrittlement And Stacking-Fault Energies

    NASA Technical Reports Server (NTRS)

    Parr, R. A.; Johnson, M. H.; Davis, J. H.; Oh, T. K.

    1988-01-01

    Embrittlement in Ni/Cu alloys appears related to stacking-fault porbabilities. Report describes attempt to show a correlation between stacking-fault energy of different Ni/Cu alloys and susceptibility to hydrogen embrittlement. Correlation could lead to more fundamental understanding and method of predicting susceptibility of given Ni/Cu alloy form stacking-fault energies calculated from X-ray diffraction measurements.

  12. Piezoelectric stack transducer evaluation and comparison for optimized energy harvesting

    NASA Astrophysics Data System (ADS)

    Gamboa, Bryan

    Lead Zirconate Titanate (PZT) is the most prevalent piezoelectric material used around the world. These materials are used in a wide array of devices across a vast group of applications. The primary focus of this research is on the application and optimization of direct piezoelectric effect in energy harvesting from low frequency mechanical vibration. The specific research aim is at understanding the stacked PZT transducers in their mechanisms and performance on effective electromechanical energy conversion. Piezoelectric power output has been determined based on understanding of the fundamental concepts in composites (1:3 bi-phasic) and stack transducers. Several property structure relations are evaluated by various experimental methods including the utilization of electrodynamic test systems (Acumen III and the Universal Testing Machine 25, both by MTS Systems Corp.). The converted power is monitored and recorded using pc interfaced digital multimeter (Metrahit by Messtechnik GmbH). Power evaluation is compared among several samples in order to understand the most efficient configuration utilizing PZT ceramics. Impedance measurements, piezoelectric coefficients and permittivity calculations are evaluated to more accurately compare the samples. Power density as function of applied mechanical force and pressure, are calculated and compared with experimental results which yield good agreement. Three types of stack PZT transducers were compared and systemically tested for their electromechanical power conversion performance. While 1:3 composite stack PZT transducer was found to be the best performer in term of power density per active volume, the custom fabricated stack PZT transducers (UTSA stack sample) were found to have the highest power density per total transducer volume, 0.615 muW/mm3, measured at 965 kN/m2 (140 PSI), among the three types studied.

  13. Film stacking architecture for immersion lithography process

    NASA Astrophysics Data System (ADS)

    Goto, Tomohiro; Sanada, Masakazu; Miyagi, Tadashi; Shigemori, Kazuhito; Kanaoka, Masashi; Yasuda, Shuichi; Tamada, Osamu; Asai, Masaya

    2008-03-01

    In immersion lithography process, film stacking architecture will be necessary due to film peeling. However, the architecture will restrict lithographic area within a wafer due to top side EBR accuracy In this paper, we report an effective film stacking architecture that also allows maximum lithographic area. This study used a new bevel rinse system on RF3 for all materials to make suitable film stacking on the top side bevel. This evaluation showed that the new bevel rinse system allows the maximum lithographic area and a clean wafer edge. Patterning defects were improved with suitable film stacking.

  14. ooi: OpenStack OCCI interface

    NASA Astrophysics Data System (ADS)

    López García, Álvaro; Fernández del Castillo, Enol; Orviz Fernández, Pablo

    In this document we present an implementation of the Open Grid Forum's Open Cloud Computing Interface (OCCI) for OpenStack, namely ooi (Openstack occi interface, 2015) [1]. OCCI is an open standard for management tasks over cloud resources, focused on interoperability, portability and integration. ooi aims to implement this open interface for the OpenStack cloud middleware, promoting interoperability with other OCCI-enabled cloud management frameworks and infrastructures. ooi focuses on being non-invasive with a vanilla OpenStack installation, not tied to a particular OpenStack release version.

  15. Flexible interconnects for fuel cell stacks

    DOEpatents

    Lenz, David J.; Chung, Brandon W.; Pham, Ai Quoc

    2004-11-09

    An interconnect that facilitates electrical connection and mechanical support with minimal mechanical stress for fuel cell stacks. The interconnects are flexible and provide mechanically robust fuel cell stacks with higher stack performance at lower cost. The flexible interconnects replace the prior rigid rib interconnects with flexible "fingers" or contact pads which will accommodate the imperfect flatness of the ceramic fuel cells. Also, the mechanical stress of stacked fuel cells will be smaller due to the flexibility of the fingers. The interconnects can be one-sided or double-sided.

  16. Debuncher Cooling Limitations to Stacking

    SciTech Connect

    Halling, Mike

    1991-08-13

    During the January studies period we performed studies to determine the effect that debuncher cooling has on the stacking rate. Two different sets of measurements were made separated by about a week. Most measurements reported here are in PBAR log 16, page 243-247. These measurements were made by changing the accelerator timeline to give about 6 seconds between 29's, and then gating the cooling systems to simulate reduced cycle times. For the measurement of the momentum cooling effectiveness the gating switches could not be made to work, so the timeline was changed for each measurement. The cooling power of all three systems was about 800 watts for the tests reported here. We now regularly run at 1200 watts per system.

  17. Influence of the stacking order on structural features of the Cu-In-Ga-Se precursors for formation of Cu(In,Ga)Se2 thin films prepared by thermal reaction of InSe/Cu/GaSe alloys to elemental Se vapor and diethylselenide gas

    NASA Astrophysics Data System (ADS)

    Dejene, F. B.; Sugiyama, M.; Nakanishi, H.; Alberts, V.; Chichibu, S. F.

    2006-09-01

    A novel partway for the fabrication of copper-indium (gallium) diselenide has been developed. This two-stage process consists of the formation of Cu-In-(Ga)-Se precursors and subsequent selenization to form CuIn(Ga)Se2. In this work, we have investigated and compared the possible interactions in Cu-In-Ga-Se systems, using sequentially stacked precursors premixed with Se, in order to get a better understanding of the Cu(In,Ga)Se2 thin film formation. Comparison of these SEM micrographs clearly revealed that the surface morphologies and hence surface roughness of the resulting Cu(In,Ga)Se2 absorber films were significantly influenced by the structure of the precursor films prior to selenization. XRD analyses revealed the presence of a graded CuIn1-xGaxSe structure, irrespective of the stacking order during the precursor formation step for samples selenized using elemental Se vapor. It was established that distinct from the case of using Se vapor, a single-phase Cu(In,Ga)Se2 films were obtained by diethylselenide (DESe) selenization from Cu-In-Ga metal precursors premixed Se irrespective of the stacking order during the precursor formation step.

  18. Actuators Using Piezoelectric Stacks and Displacement Enhancers

    NASA Technical Reports Server (NTRS)

    Bar-Cohen, Yoseph; Sherrit, Stewart; Bao, Xiaoqi; Badescu, Mircea; Lee, Hyeong Jae; Walkenmeyer, Phillip; Lih, Shyh-Shiuh

    2015-01-01

    Actuators are used to drive all active mechanisms including machines, robots, and manipulators to name a few. The actuators are responsible for moving, manipulating, displacing, pushing and executing any action that is needed by the mechanism. There are many types and principles of actuation that are responsible for these movements ranging from electromagnetic, electroactive, thermo-mechanic, piezoelectric, electrostrictive etc. Actuators are readily available from commercial producers but there is a great need for reducing their size, increasing their efficiency and reducing their weight. Studies at JPL’s Non Destructive Evaluation and Advanced Actuators (NDEAA) Laboratory have been focused on the use of piezoelectric stacks and novel designs taking advantage of piezoelectric’s potential to provide high torque/force density actuation and high electromechanical conversion efficiency. The actuators/motors that have been developed and reviewed in this paper are operated by various horn configurations as well as the use of pre-stress flexures that make them thermally stable and increases their coupling efficiency. The use of monolithic designs that pre-stress the piezoelectric stack eliminates the use of compression stress bolt. These designs enable the embedding of developed solid-state motors/actuators in any structure with the only macroscopically moving parts are the rotor or the linear translator. Finite element modeling and design tools were used to determine the requirements and operation parameters and the results were used to simulate, design and fabricate novel actuators/motors. The developed actuators and performance will be described and discussed in this paper.

  19. Dielectric elastomer generators that stack up

    NASA Astrophysics Data System (ADS)

    McKay, T. G.; Rosset, S.; Anderson, I. A.; Shea, H.

    2015-01-01

    This paper reports the design, fabrication, and testing of a soft dielectric elastomer power generator with a volume of less than 1 cm3. The generator is well suited to harvest energy from ambient and from human body motion as it can harvest from low frequency (sub-Hz) motions, and is compact and lightweight. Dielectric elastomers are highly stretchable variable capacitors. Electrical energy is produced when the deformation of a stretched, charged dielectric elastomer is relaxed; like-charges are compressed together and opposite-charges are pushed apart, resulting in an increased voltage. This technology provides an opportunity to produce soft, high energy density generators with unparalleled robustness. Two major issues block this goal: current configurations require rigid frames that maintain the dielectric elastomer in a prestretched state, and high energy densities have come at the expense of short lifetime. This paper presents a self-supporting stacked generator configuration which does not require rigid frames. The generator consists of 48 generator films stacked on top of each other, resulting in a structure that fits within an 11 mm diameter footprint while containing enough active material to produce useful power. To ensure sustainable power production, we also present a mathematical model for designing the electronic control of the generator which optimizes energy production while limiting the electrical stress on the generator below failure limits. When cyclically compressed at 1.6 Hz, our generator produced 1.8 mW of power, which is sufficient for many low-power wireless sensor nodes. This performance compares favorably with similarly scaled electromagnetic, piezoelectric, and electrostatic generators. The generator’s small form factor and ability to harvest useful energy from low frequency motions such as tree swaying or shoe impact provides an opportunity to deliver power to remote wireless sensor nodes or to distributed points in the human body

  20. Project W-420 stack monitoring system upgrades

    SciTech Connect

    CARPENTER, K.E.

    1999-02-25

    This project will execute the design, procurement, construction, startup, and turnover activities for upgrades to the stack monitoring system on selected Tank Waste Remediation System (TWRS) ventilation systems. In this plan, the technical, schedule, and cost baselines are identified, and the roles and responsibilities of project participants are defined for managing the Stack Monitoring System Upgrades, Project W-420.

  1. Effective Stack Design in Air Pollution Control.

    ERIC Educational Resources Information Center

    Clarke, John H.

    1968-01-01

    Stack design problems fall into two general caterories--(1) those of building re-entry, and (2) those of general area pollution. Extensive research has developed adequate information, available in the literature, to permit effective stack design. A major roadblock to effective design has been the strong belief by architects and engineers that high…

  2. Excitation transfer in stacked quantum dot chains

    NASA Astrophysics Data System (ADS)

    Kanjanachuchai, Songphol; Xu, Ming; Jaffré, Alexandre; Jittrong, Apichart; Chokamnuai, Thitipong; Panyakeow, Somsak; Boutchich, Mohamed

    2015-05-01

    Stacked InAs quantum dot chains (QDCs) on InGaAs/GaAs cross-hatch pattern (CHP) templates yield a rich emission spectrum with an unusual carrier transfer characteristic compared to conventional quantum dot (QD) stacks. The photoluminescent spectra of the controlled, single QDC layer comprise multiple peaks from the orthogonal QDCs, the free-standing QDs, the CHP, the wetting layers and the GaAs substrate. When the QDC layers are stacked, employing a 10 nm GaAs spacer between adjacent QDC layers, the PL spectra are dominated by the top-most stack, indicating that the QDC layers are nominally uncoupled. Under high excitation power densities when the high-energy peaks of the top stack are saturated, however, low-energy PL peaks from the bottom stacks emerge as a result of carrier transfers across the GaAs spacers. These unique PL signatures contrast with the state-filling effects in conventional, coupled QD stacks and serve as a means to quickly assess the presence of electronic coupling in stacks of dissimilar-sized nanostructures.

  3. Effective Stack Design in Air Pollution Control.

    ERIC Educational Resources Information Center

    Clarke, John H.

    1968-01-01

    Stack design problems fall into two general caterories--(1) those of building re-entry, and (2) those of general area pollution. Extensive research has developed adequate information, available in the literature, to permit effective stack design. A major roadblock to effective design has been the strong belief by architects and engineers that high…

  4. Interconnections For Stacked Parallel Computer Modules

    NASA Technical Reports Server (NTRS)

    Johannesson, Richard T.

    1996-01-01

    Concept for interconnecting modules in parallel computers leads to cheaper, smaller, lighter, lower-power computing systems for aerospace, industrial, business, and consumer applications. Computer modules stacked and interconnected in various configurations. Connections among stacks controlled by switching within gateways and/or by addresses on buses.

  5. Revealing the preferred interlayer orientations and stackings of two-dimensional bilayer gallium selenide crystals.

    PubMed

    Li, Xufan; Basile, Leonardo; Yoon, Mina; Ma, Cheng; Puretzky, Alexander A; Lee, Jaekwang; Idrobo, Juan C; Chi, Miaofang; Rouleau, Christopher M; Geohegan, David B; Xiao, Kai

    2015-02-23

    Characterizing and controlling the interlayer orientations and stacking orders of two-dimensional (2D) bilayer crystals and van der Waals (vdW) heterostructures is crucial to optimize their electrical and optoelectronic properties. The four polymorphs of layered gallium selenide (GaSe) crystals that result from different layer stackings provide an ideal platform to study the stacking configurations in 2D bilayer crystals. Through a controllable vapor-phase deposition method, bilayer GaSe crystals were selectively grown and their two preferred 0° or 60° interlayer rotations were investigated. The commensurate stacking configurations (AA' and AB stacking) in as-grown bilayer GaSe crystals are clearly observed at the atomic scale, and the Ga-terminated edge structure was identified using scanning transmission electron microscopy. Theoretical analysis reveals that the energies of the interlayer coupling are responsible for the preferred orientations among the bilayer GaSe crystals.

  6. Stacking nature and band gap opening of graphene: Perspective for optoelectronic applications

    NASA Astrophysics Data System (ADS)

    Ullah, Naeem; Zhang, R. Q.; Murtaza, G.; Yar, Abdullah; Mahmood, Asif

    2016-11-01

    Using first principles density functional theory calculations, we have performed geometrical and electronic structure calculations of two-dimensional graphene(G) sheet on the hexagonal boron nitride (h-BN) with different stacking orders. We found that AB stacking appears as the ground state while AA-stacking is a local minima. Band gap opening in the hybrid G/h-BN is sensitive to the interlayer distance and stacking arrangement. Charge redistribution in the graphene sheet determined the band gap opening where the onsite energy difference between carbon lattice atoms of G-sheet takes place. Similar behavior can be observed for the proposed h-BN/G/h-BN tri-layer system. Stacking resolved calculations of the absorptive part of complex dielectric function and optical conductivity revealed the importance of the proposed hybrid systems in the optoelectronics.

  7. Hard solder 20-kW QCW stack array diode laser

    NASA Astrophysics Data System (ADS)

    Li, Xiaoning; Kang, Lijun; Wang, Jingwei; Zhang, Pu; Xiong, Lingling; Liu, Xingsheng

    2012-03-01

    With the increasing applications of high power semiconductor lasers in industry, advanced manufacturing, aerospace, medical systems, display, entertainment, etc., semiconductor lasers with high power and high performances are required. The performance of semiconductor lasers is greatly affected by packaging structure, packaging process and beam shaping. A novel macro channel cooler (MaCC) for stack array laser with good heat dissipation capacity and high reliability is presented in this work. Based on the MaCC package, a high power stack array diode laser is successfully fabricated. A series of techniques such as spectrum control and beam control are used to achieve narrow spectrum and high beam quality. The performances of the semiconductor laser stack array are characterized. A high power 20kW QCW hard solder packaged stack array laser is fabricated; a narrow spectrum of 3.94 nm and an excellent rectangular beam shape are obtained. The lifetime of the stack array laser is tested as well.

  8. Mapping of Bernal and non-Bernal stacking domains in bilayer graphene using infrared nanoscopy.

    PubMed

    Jeong, Gyouil; Choi, Boogeon; Kim, Deok-Soo; Ahn, Seongjin; Park, Baekwon; Kang, Jin Hyoun; Min, Hongki; Hong, Byung Hee; Kim, Zee Hwan

    2017-03-23

    Bilayer graphene (BLG) shows great potential as a new material for opto-electronic devices because its bandgap can be controlled by varying the stacking orders, as well as by applying an external electric field. An imaging technique that can visualize and characterize various stacking domains in BLG may greatly help in fully utilizing such properties of BLG. Here we demonstrate that infrared (IR) scattering-type scanning near-field optical microscopy (sSNOM) can visualize Bernal and non-Bernal stacking domains of BLG, based on the stacking-specific inter- and intra-band optical conductivities. The method enables nanometric mapping of stacking domains in BLG on dielectric substrates, augmenting current limitations of Raman spectroscopy and electron microscopy techniques for the structural characterization of BLG.

  9. Status of MCFC stack technology at IHI

    SciTech Connect

    Hosaka, M.; Morita, T.; Matsuyama, T.; Otsubo, M.

    1996-12-31

    The molten carbonate fuel cell (MCFC) is a promising option for highly efficient power generation possible to enlarge. IHI has been studying parallel flow MCFC stacks with internal manifolds that have a large electrode area of 1m{sup 2}. IHI will make two 250 kW stacks for MW plant, and has begun to make cell components for the plant. To improve the stability of stack, soft corrugated plate used in the separator has been developed, and a way of gathering current from stacks has been studied. The DC output potential of the plant being very high, the design of electric insulation will be very important. A 20 kW short stack test was conducted in 1995 FY to certificate some of the improvements and components of the MW plant. These activities are presented below.

  10. Stacking textures and singularities in bilayer graphene

    NASA Astrophysics Data System (ADS)

    Mele, Eugene

    2014-03-01

    Multilayer graphenes feature special functionalities that microscopically arise from the atomic registry when graphene sheets are stacked. These depend on relative lateral translations, rotations and layer symmetry breaking that can occur spontaneously or be induced. This talk will focus on bilayer graphenes (BLG) in which the stacking arrangement varies in space. We examine domain walls where the local stacking order switches from local AB to BA registry, and study the electronic modes at the boundary by analyzing their valley-projected four band continuum models augmented by numerical calculations on a lattice. We then consider the more general family of two dimensional strain-minimizing BLG stacking textures, finding that they are twisted textures of the interlayer displacement field. We study the interactions and composition rules for these elementary textures which permit a unified treatment of stacking point defects, domain walls and twisted graphenes. Collaborators: Z. Addison, X. Gong, A.H. MacDonald and Fan Zhang

  11. Experimental and computational studies on stacking faults in zinc titanate

    SciTech Connect

    Sun, W.; Ageh, V.; Mohseni, H.; Scharf, T. W. E-mail: Jincheng.Du@unt.edu; Du, J. E-mail: Jincheng.Du@unt.edu

    2014-06-16

    Zinc titanate (ZnTiO{sub 3}) thin films grown by atomic layer deposition with ilmenite structure have recently been identified as an excellent solid lubricant, where low interfacial shear and friction are achieved due to intrafilm shear velocity accommodation in sliding contacts. In this Letter, high resolution transmission electron microscopy with electron diffraction revealed that extensive stacking faults are present on ZnTiO{sub 3} textured (104) planes. These growth stacking faults serve as a pathway for dislocations to glide parallel to the sliding direction and hence achieve low interfacial shear/friction. Generalized stacking fault energy plots also known as γ-surfaces were computed for the (104) surface of ZnTiO{sub 3} using energy minimization method with classical effective partial charge potential and verified by using density functional theory first principles calculations for stacking fault energies along certain directions. These two are in qualitative agreement but classical simulations generally overestimate the energies. In addition, the lowest energy path was determined to be along the [451{sup ¯}] direction and the most favorable glide system is (104) 〈451{sup ¯}〉 that is responsible for the experimentally observed sliding-induced ductility.

  12. Dynamic behaviour of SOFC short stacks

    NASA Astrophysics Data System (ADS)

    Molinelli, Michele; Larrain, Diego; Autissier, Nordahl; Ihringer, Raphaël; Sfeir, Joseph; Badel, Nicolas; Bucheli, Olivier; Van herle, Jan

    Electrical output behaviour obtained on solid oxide fuel cell stacks, based on planar anode supported cells (50 or 100 cm 2 active area) and metallic interconnects, is reported. Stacks (1-12 cells) have been operated with cathode air and anode hydrogen flows between 750 and 800 °C operating temperature. At first polarisation, an activation phase (increase in power density) is typically observed, ascribed to the cathode but not clarified. Activation may extend over days or weeks. The materials are fairly resistant to thermal cycling. A 1-cell stack cycled five times in 4 days at heating/cooling rates of 100-300 K h -1, showed no accelerated degradation. In a 5-cell stack, open circuit voltage (OCV) of all cells remained constant after three full cycles (800-25 °C). Power output is little affected by air flow but markedly influenced by small fuel flow variation. Fuel utilisation reached 88% in one 5-cell stack test. Performance homogeneity between cells lay at ±4-8% for three different 5- or 6-cell stacks, but was poor for a 12-cell stack with respect to the border cells. Degradation of a 1-cell stack operated for 5500 h showed clear dependence on operating conditions (cell voltage, fuel conversion), believed to be related to anode reoxidation (Ni). A 6-cell stack (50 cm 2 cells) delivering 100 W el at 790 °C (1 kW el L -1 or 0.34 W cm -2) went through a fuel supply interruption and a thermal cycle, with one out of the six cells slightly underperforming after these events. This cell was eventually responsible (hot spot) for stack failure.

  13. High Yield Chemical Vapor Deposition Growth of High Quality Large-Area AB Stacked Bilayer Graphene

    PubMed Central

    Liu, Lixin; Zhou, Hailong; Cheng, Rui; Yu, Woo Jong; Liu, Yuan; Chen, Yu; Shaw, Jonathan; Zhong, Xing; Huang, Yu; Duan, Xiangfeng

    2012-01-01

    Bernal stacked (AB stacked) bilayer graphene is of significant interest for functional electronic and photonic devices due to the feasibility to continuously tune its band gap with a vertical electrical field. Mechanical exfoliation can be used to produce AB stacked bilayer graphene flakes but typically with the sizes limited to a few micrometers. Chemical vapor deposition (CVD) has been recently explored for the synthesis of bilayer graphene but usually with limited coverage and a mixture of AB and randomly stacked structures. Herein we report a rational approach to produce large-area high quality AB stacked bilayer graphene. We show that the self-limiting effect of graphene growth on Cu foil can be broken by using a high H2/CH4 ratio in a low pressure CVD process to enable the continued growth of bilayer graphene. A high temperature and low pressure nucleation step is found to be critical for the formation of bilayer graphene nuclei with high AB stacking ratio. A rational design of a two-step CVD process is developed for the growth of bilayer graphene with high AB stacking ratio (up to 90 %) and high coverage (up to 99 %). The electrical transport studies demonstrated that devices made of the as-grown bilayer graphene exhibit typical characteristics of AB stacked bilayer graphene with the highest carrier mobility exceeding 4,000 cm2/V·s at room temperature, comparable to that of the exfoliated bilayer graphene. PMID:22906199

  14. Probing Temperature Inside Planar SOFC Short Stack, Modules, and Stack Series

    NASA Astrophysics Data System (ADS)

    Yu, Rong; Guan, Wanbing; Zhou, Xiao-Dong

    2017-02-01

    Probing temperature inside a solid oxide fuel cell (SOFC) stack lies at the heart of the development of high-performance and stable SOFC systems. In this article, we report our recent work on the direct measurements of the temperature in three types of SOFC systems: a 5-cell short stack, a 30-cell stack module, and a stack series consisting of two 30-cell stack modules. The dependence of temperature on the gas flow rate and current density was studied under a current sweep or steady-state operation. During the current sweep, the temperature inside the 5-cell stack decreased with increasing current, while it increased significantly at the bottom and top of the 30-cell stack. During a steady-state operation, the temperature of the 5-cell stack was stable while it was increased in the 30-cell stack. In the stack series, the maximum temperature gradient reached 190°C when the gas was not preheated. If the gas was preheated and the temperature gradient was reduced to 23°C in the stack series with the presence of a preheating gas and segmented temperature control, this resulted in a low degradation rate.

  15. Reconstruction of 3D stacked hepatocyte tissues using degradable, microporous poly(d,l-lactide-co-glycolide) membranes.

    PubMed

    Kasuya, Junichi; Sudo, Ryo; Tamogami, Ryu; Masuda, Genta; Mitaka, Toshihiro; Ikeda, Mariko; Tanishita, Kazuo

    2012-03-01

    There is great demand for constructing well-organized three-dimensional (3D) tissues in vitro. Here, we developed a 3D stacked culture method using biodegradable poly(d,l-lactide-co- glycolide) (PLGA) membranes with defined topography. Pore size and porosity of the membranes can be controlled by changing the moisture content during fabrication. The optimized membrane served as a scaffold to manipulate small hepatocyte (SH) layers when they were stacked, while it degraded after stacking, resulting in the reorganization of the cells into a 3D stacked structure. Immunofluorescent staining for domain markers of cell polarity and electron microscopy confirmed that the cells in the 3D stacked structures recovered polarity. Furthermore, the cells exhibited improved liver-specific function as compared with cells in a monolayer. This 3D stacked culture may enable reconstruction of multilayered hepatic tissues with highly differentiated functions in vitro. Copyright © 2011 Elsevier Ltd. All rights reserved.

  16. Pre-stack time migration based on stationary-phase stacking in the dip-angle domain

    NASA Astrophysics Data System (ADS)

    Xu, Jincheng; Zhang, Hao; Zhang, Jianfeng; Li, Zhengwei; Liu, Wei

    2017-03-01

    The Kirchhoff-type migration approach often suffers from migration noise, aliasing artifacts due to operator error, or weak noise from a truncated aperture or pre-stacked data. These noises can be attenuated by using stationary-phase migration, which only stacks the reflection energy within the Fresnel zone rather than along the whole migration aperture, and therefore obtains a higher signal-to-noise ratio (SNR) for the migration results. This paper proposes a new implementation for the pre-stack time migration (PSTM) approach, which is based on stationary-phase stacking in the dip-angle domain. This implementation generates a pair of migrated dip-angle gathers in the image domain using PSTM. We can obtain the dip-angle field corresponding to the contribution of the Fresnel zones from the migrated dip-angle gathers, which allows us to remove noise outside the Fresnel zones and significantly improves the SNR of the image gathers. The proposed stationary-phase PSTM could effectively handle the problem of low SNR in migrated images, especially in the presence of steeply dipping structures. We test the method by applying stationary-phase PSTM to an overthrust model example and a three-dimensional field data set, and both examples demonstrate that the resulting images are of good quality with the method.

  17. Critical optical properties of AA-stacked multilayer graphenes

    NASA Astrophysics Data System (ADS)

    Chiu, Chih-Wei; Chen, Szu-Chao; Huang, Yuan-Cheng; Shyu, Feng-Lin; Lin, Ming-Fa

    2013-07-01

    The band structures and optical properties of AA-stacked multilayer graphenes are calculated by the tight-binding model and gradient approximation. For a nL-layer AA-stacked graphene, there are nL peaks at both low and middle frequencies. The threshold energy of odd-layer graphene is much lower than that of even-layer graphene for nL<10. The differences in the electronic structures and optical properties between the odd and even layers are reduced with increasing nL. When nL grows to 30 (200), the spectra of 2D graphene are almost identical to those of 3D graphite at middle (low) frequencies.

  18. Heating Isotopically Labeled Bernal Stacked Graphene: A Raman Spectroscopy Study.

    PubMed

    Ek-Weis, Johan; Costa, Sara; Frank, Otakar; Kalbac, Martin

    2014-02-06

    One of the greatest issues of nanoelectronics today is how to control the heating of the components. Graphene is a promising material in this area, and it is essential to study its thermal properties. Here, the effect of heating a bilayer structure was investigated using in situ Raman spectroscopy. In order to observe the effects on each individual layer, an isotopically labeled bilayer graphene was synthesized where the two layers were composed of different carbon isotopes. Therefore, the frequency of the phonons in the Raman spectra was shifted in relation to each other. This technique was used to investigate the influence of different stacking order. It was found that in bilayer graphene grown by chemical vapor deposition (CVD), the two layers behave very similarly for both Bernal stacking and randomly oriented structures, while for transferred samples, the layers act more independently. This highlights a significant dependence on the sample preparation procedure.

  19. Electronically decoupled stacking fault tetrahedra embedded in Au(111) films

    NASA Astrophysics Data System (ADS)

    Schouteden, Koen; Amin-Ahmadi, Behnam; Li, Zhe; Muzychenko, Dmitry; Schryvers, Dominique; Van Haesendonck, Chris

    2016-12-01

    Stacking faults are known as defective structures in crystalline materials that typically lower the structural quality of the material. Here, we show that a particular type of defect, that is, stacking fault tetrahedra (SFTs), exhibits pronounced quantized electronic behaviour, revealing a potential synthetic route to decoupled nanoparticles in metal films. We report on the electronic properties of SFTs that exist in Au(111) films, as evidenced by scanning tunnelling microscopy and confirmed by transmission electron microscopy. We find that the SFTs reveal a remarkable decoupling from their metal surroundings, leading to pronounced energy level quantization effects within the SFTs. The electronic behaviour of the SFTs can be described well by the particle-in-a-box model. Our findings demonstrate that controlled preparation of SFTs may offer an alternative way to achieve well-decoupled nanoparticles of high crystalline quality in metal thin films without the need of thin insulating layers.

  20. Electronically decoupled stacking fault tetrahedra embedded in Au(111) films

    PubMed Central

    Schouteden, Koen; Amin-Ahmadi, Behnam; Li, Zhe; Muzychenko, Dmitry; Schryvers, Dominique; Van Haesendonck, Chris

    2016-01-01

    Stacking faults are known as defective structures in crystalline materials that typically lower the structural quality of the material. Here, we show that a particular type of defect, that is, stacking fault tetrahedra (SFTs), exhibits pronounced quantized electronic behaviour, revealing a potential synthetic route to decoupled nanoparticles in metal films. We report on the electronic properties of SFTs that exist in Au(111) films, as evidenced by scanning tunnelling microscopy and confirmed by transmission electron microscopy. We find that the SFTs reveal a remarkable decoupling from their metal surroundings, leading to pronounced energy level quantization effects within the SFTs. The electronic behaviour of the SFTs can be described well by the particle-in-a-box model. Our findings demonstrate that controlled preparation of SFTs may offer an alternative way to achieve well-decoupled nanoparticles of high crystalline quality in metal thin films without the need of thin insulating layers. PMID:28008910

  1. Electronically decoupled stacking fault tetrahedra embedded in Au(111) films.

    PubMed

    Schouteden, Koen; Amin-Ahmadi, Behnam; Li, Zhe; Muzychenko, Dmitry; Schryvers, Dominique; Van Haesendonck, Chris

    2016-12-23

    Stacking faults are known as defective structures in crystalline materials that typically lower the structural quality of the material. Here, we show that a particular type of defect, that is, stacking fault tetrahedra (SFTs), exhibits pronounced quantized electronic behaviour, revealing a potential synthetic route to decoupled nanoparticles in metal films. We report on the electronic properties of SFTs that exist in Au(111) films, as evidenced by scanning tunnelling microscopy and confirmed by transmission electron microscopy. We find that the SFTs reveal a remarkable decoupling from their metal surroundings, leading to pronounced energy level quantization effects within the SFTs. The electronic behaviour of the SFTs can be described well by the particle-in-a-box model. Our findings demonstrate that controlled preparation of SFTs may offer an alternative way to achieve well-decoupled nanoparticles of high crystalline quality in metal thin films without the need of thin insulating layers.

  2. Planar stacking effect on elastic stability of hexagonal boron nitride

    NASA Astrophysics Data System (ADS)

    Qi, Yue; Hector, Louis G.

    2007-02-01

    The elastic stability of five hexagonal boron nitride (h-BN) stacking sequences is investigated with density functional theory. All components of the elasticity tensor are computed and used to evaluate the Born stability criteria. Phonon spectra are computed for one elastically stable and one elastically unstable h-BN structure and the normal modes associated with instability are identified. Charge density difference contour plots provide a qualitative connection between elastic stability and charge transfer.

  3. INTERIOR VIEW LOOKING EAST THROUGH BASE OF STACK NO. 2, ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    INTERIOR VIEW LOOKING EAST THROUGH BASE OF STACK NO. 2, STACK NO. 1 VISIBLE THROUGH EAST PORTAL - Greenwood Furnace, Stack No. 2, East of McAlevy's Fort on State Route 305, McAlevys Fort, Huntingdon County, PA

  4. Comment on ‘To stack or not to stack: Performance of a new density functional for the uracil and thymine dimers’ [Chem. Phys. Lett. 459 (2008) 164

    NASA Astrophysics Data System (ADS)

    van Mourik, Tanja

    2009-04-01

    A Letter by Gu et al. [J. Gu, J. Wang, J. Leszczynski, Y. Xie, H.F. Schaefer III, Chem. Phys. Lett. 459 (2008) 164] presented MP2/6-31+G(d) and MP2/TZVPP stacking energies for the uracil and thymine dimers, with the aim to assess the performance of the new M06-2X density functional. However, the stacking energies were not corrected for the basis set superposition error (BSSE). Here we show that correction for this error dramatically changes the results. BSSE correction severely reduces the stacking energy of the thymine dimer, whereas the stacked uracil dimer structure considered by Gu et al. is not even a minimum on the MP2/6-31+G(d) potential energy surface.

  5. Lattice-layer entanglement in Bernal-stacked bilayer graphene

    NASA Astrophysics Data System (ADS)

    Bittencourt, Victor A. S. V.; Bernardini, Alex E.

    2017-05-01

    The complete lattice-layer entanglement structure of Bernal-stacked bilayer graphene is obtained for the quantum system described by a tight-binding Hamiltonian which includes mass and bias voltage terms. Through a suitable correspondence with the parity-spin S U (2 )⊗S U (2 ) structure of a Dirac Hamiltonian, when it brings up tensor and pseudovector external field interactions, the lattice-layer degrees of freedom can be mapped into such a parity-spin two-qubit basis which supports the interpretation of the bilayer graphene eigenstates as entangled ones in a lattice-layer basis. The Dirac Hamiltonian mapping structure simply provides the tools for the manipulation of the corresponding eigenstates and eigenenergies of the Bernal-stacked graphene quantum system. The quantum correlational content is then quantified by means of quantum concurrence, in order to have the influence of mass and bias voltage terms quantified, and in order to identify the role of the trigonal warping of energy in the intrinsic entanglement. Our results show that while the mass term actively suppresses the intrinsic quantum entanglement of bilayer eigenstates, the bias voltage term spreads the entanglement in the Brillouin zone around the Dirac points. In addition, the interlayer coupling modifies the symmetry of the lattice-layer quantum concurrence around a given Dirac point. It produces some distortion on the quantum entanglement profile which follows the same pattern of the isoenergy line distortion in the Bernal-stacked bilayer graphene.

  6. Dynamical stability of slip-stacking particles

    SciTech Connect

    Eldred, Jeffrey; Zwaska, Robert

    2014-09-01

    We study the stability of particles in slip-stacking configuration, used to nearly double proton beam intensity at Fermilab. We introduce universal area factors to calculate the available phase space area for any set of beam parameters without individual simulation. We find perturbative solutions for stable particle trajectories. We establish Booster beam quality requirements to achieve 97% slip-stacking efficiency. We show that slip-stacking dynamics directly correspond to the driven pendulum and to the system of two standing-wave traps moving with respect to each other.

  7. Passive stacks in a multifamily housing project

    SciTech Connect

    Saum, D.

    1995-12-31

    The Summerfield multi-family, 1242 unit housing project that has been under construction since 1993 in Prince Georges County Maryland near Washington, DC suggests that passive stacks provides significant radon mitigation in multi-family construction. Random radon tests in these buildings indicate an average indoor ground floor concentration of 0.3 pCi/L with the stacks open, and 1.3 pCi/L with the stacks sealed. These buildings were built with post-tension slabs which should be more airtight than conventional floating slabs, and measurements show that the pressure field extension in these slabs in very good.

  8. Repetitively pulsed high power stacked Blumlein generators

    NASA Astrophysics Data System (ADS)

    Davanloo, F.; Borovina, D. L.; Collins, C. B.; Agee, F. J.; Kingsley, L. E.

    1995-05-01

    The stacked Blumlein pulse generators developed at the University of Texas at Dallas consist of several triaxial Blumleins stacked in series at one end. The lines are charged in parallel and synchronously commuted with a single switching element at the other end. In this way, relatively low charging voltages are multiplied to give the desired discharge voltage across an arbitrary load. Described here is the progress in development and characterization of these novel pulse-power generators capable of discharging at high repetition rates. The introduction of a tapered transmission line concept to the stacked Blumlein design provided fine tuning of output waveforms.

  9. Stacking-dependent interlayer coupling in trilayer MoS2 with broken inversion symmetry

    DOE PAGES

    Yan, Jiaxu; Wang, Xingli; Tay, Beng Kang; ...

    2015-11-13

    The stacking configuration in few-layer two-dimensional (2D) materials results in different structural symmetries and layer-to-layer interactions, and hence it provides a very useful parameter for tuning their electronic properties. For example, ABA-stacking trilayer graphene remains semimetallic similar to that of monolayer, while ABC-stacking is predicted to be a tunable band gap semiconductor under an external electric field. Such stacking dependence resulting from many-body interactions has recently been the focus of intense research activities. Here we demonstrate that few-layer MoS2 samples grown by chemical vapor deposition with different stacking configurations (AA, AB for bilayer; AAB, ABB, ABA, AAA for trilayer) exhibitmore » distinct coupling phenomena in both photoluminescence and Raman spectra. By means of ultralow-frequency (ULF) Raman spectroscopy, we demonstrate that the evolution of interlayer interaction with various stacking configurations correlates strongly with layer-breathing mode (LBM) vibrations. Our ab initio calculations reveal that the layer-dependent properties arise from both the spin–orbit coupling (SOC) and interlayer coupling in different structural symmetries. Lastly, such detailed understanding provides useful guidance for future spintronics fabrication using various stacked few-layer MoS2 blocks.« less

  10. Free energy analysis and mechanism of base pair stacking in nicked DNA

    PubMed Central

    Häse, Florian; Zacharias, Martin

    2016-01-01

    The equilibrium of stacked and unstacked base pairs is of central importance for all nucleic acid structure formation processes. The stacking equilibrium is influenced by intramolecular interactions between nucleosides but also by interactions with the solvent. Realistic simulations on nucleic acid structure formation and flexibility require an accurate description of the stacking geometry and stability and its sequence dependence. Free energy simulations have been conducted on a series of double stranded DNA molecules with a central strand break (nick) in one strand. The change in free energy upon unstacking was calculated for all ten possible base pair steps using umbrella sampling along a center-of-mass separation coordinate and including a comparison of different water models. Comparison to experimental studies indicates qualitative agreement of the stability order but a general overestimation of base pair stacking interactions in the simulations. A significant dependence of calculated nucleobase stacking free energies on the employed water model was observed with the tendency of stacking free energies being more accurately reproduced by more complex water models. The simulation studies also suggest a mechanism of stacking/unstacking that involves significant motions perpendicular to the reaction coordinate and indicate that the equilibrium nicked base pair step may slightly differ from regular B-DNA geometry in a sequence-dependent manner. PMID:27407106

  11. Magnetic oscillation of optical phonon in ABA- and ABC-stacked trilayer graphene

    NASA Astrophysics Data System (ADS)

    Cong, Chunxiao; Jung, Jeil; Cao, Bingchen; Qiu, Caiyu; Shen, Xiaonan; Ferreira, Aires; Adam, Shaffique; Yu, Ting

    2015-06-01

    We present a comparative measurement of the G -peak oscillations of phonon frequency, Raman intensity, and linewidth in the magneto-Raman scattering of optical E2 g phonons in mechanically exfoliated ABA- and ABC-stacked trilayer graphene (TLG). Whereas in ABA-stacked TLG, we observe magnetophonon oscillations consistent with single-bilayer chiral band doublets, the features are flat for ABC-stacked TLG up to magnetic fields of 9 T. This suppression can be attributed to the enhancement of band chirality that compactifies the spectrum of Landau levels and modifies the magnetophonon resonance properties. The drastically different coupling behavior between the electronic excitations and the E2 g phonons in ABA- and ABC-stacked TLG reflects their different electronic band structures and the electronic Landau level transitions and thus can be another way to determine the stacking orders and to probe the stacking-order-dependent electronic structures. In addition, the sensitivity of the magneto-Raman scattering to the particular stacking order in few-layer graphene highlights the important role of interlayer coupling in modifying the optical response properties in van der Waals layered materials.

  12. Free energy analysis and mechanism of base pair stacking in nicked DNA.

    PubMed

    Häse, Florian; Zacharias, Martin

    2016-09-06

    The equilibrium of stacked and unstacked base pairs is of central importance for all nucleic acid structure formation processes. The stacking equilibrium is influenced by intramolecular interactions between nucleosides but also by interactions with the solvent. Realistic simulations on nucleic acid structure formation and flexibility require an accurate description of the stacking geometry and stability and its sequence dependence. Free energy simulations have been conducted on a series of double stranded DNA molecules with a central strand break (nick) in one strand. The change in free energy upon unstacking was calculated for all ten possible base pair steps using umbrella sampling along a center-of-mass separation coordinate and including a comparison of different water models. Comparison to experimental studies indicates qualitative agreement of the stability order but a general overestimation of base pair stacking interactions in the simulations. A significant dependence of calculated nucleobase stacking free energies on the employed water model was observed with the tendency of stacking free energies being more accurately reproduced by more complex water models. The simulation studies also suggest a mechanism of stacking/unstacking that involves significant motions perpendicular to the reaction coordinate and indicate that the equilibrium nicked base pair step may slightly differ from regular B-DNA geometry in a sequence-dependent manner. © The Author(s) 2016. Published by Oxford University Press on behalf of Nucleic Acids Research.

  13. Stacked vapor fed amtec modules

    DOEpatents

    Sievers, Robert K.

    1989-01-01

    The present invention pertains to a stacked AMTEC module. The invention includes a tubular member which has an interior. The member is comprised of a ion conductor that substantially conducts ions relative to electrons, preferably a beta"-alumina solid electrolyte, positioned about the interior. A porous electrode for conducting electrons and allowing sodium ions to pass therethrough, and wherein electrons and sodium ions recombine to form sodium is positioned about the beta"-alumina solid electrolyte. The electrode is operated at a temperature and a pressure that allows the recombined sodium to vaporize. Additionally, an outer current collector grid for distributing electrons throughout the porous electrode is positioned about and contacts the porous electrode. Also included in the invention is transporting means for transporting liquid sodium to the beta"-alumina solid electrolyte of the tubular member. A transition piece is positioned about the interior of the member and contacts the transporting means. The transition piece divides the member into a first cell and a second cell such that each first and second cell has a beta"-alumina solid electrolyte, a first and second porous electrode and a grid. The transition piece conducts electrons from the interior of the tubular member. There is supply means for supplying sodium to the transporting means. Preferably the supply means is a shell which surrounds the tubular member and is operated at a temperature such that the vaporized sodium condenses thereon. Returning means for returning the condensed sodium from the shell to the transporting means provides a continuous supply of liquid sodium to the transporting means. Also, there are first conducting means for conducting electric current from the transition piece which extends through the shell, and second conducting means for conducting electric current to the grid of the first cell which extends through the shell.

  14. 40 CFR 61.33 - Stack sampling.

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... EMISSION STANDARDS FOR HAZARDOUS AIR POLLUTANTS National Emission Standard for Beryllium § 61.33 Stack... Administrator. (d) All samples shall be analyzed and beryllium emissions shall be determined within 30 days...

  15. 40 CFR 61.33 - Stack sampling.

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... EMISSION STANDARDS FOR HAZARDOUS AIR POLLUTANTS National Emission Standard for Beryllium § 61.33 Stack... Administrator. (d) All samples shall be analyzed and beryllium emissions shall be determined within 30 days...

  16. 40 CFR 61.33 - Stack sampling.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... EMISSION STANDARDS FOR HAZARDOUS AIR POLLUTANTS National Emission Standard for Beryllium § 61.33 Stack... Administrator. (d) All samples shall be analyzed and beryllium emissions shall be determined within 30 days...

  17. 40 CFR 61.33 - Stack sampling.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... EMISSION STANDARDS FOR HAZARDOUS AIR POLLUTANTS National Emission Standard for Beryllium § 61.33 Stack... Administrator. (d) All samples shall be analyzed and beryllium emissions shall be determined within 30 days...

  18. 40 CFR 61.33 - Stack sampling.

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... EMISSION STANDARDS FOR HAZARDOUS AIR POLLUTANTS National Emission Standard for Beryllium § 61.33 Stack... results reported to the Administrator. (d) All samples shall be analyzed and beryllium emissions shall be...

  19. Contemporary sample stacking in analytical electrophoresis.

    PubMed

    Šlampová, Andrea; Malá, Zdena; Pantůčková, Pavla; Gebauer, Petr; Boček, Petr

    2013-01-01

    Sample stacking is a term denoting a multifarious class of methods and their names that are used daily in CE for online concentration of diluted samples to enhance separation efficiency and sensitivity of analyses. The essence of these methods is that analytes present at low concentrations in a large injected sample zone are concentrated into a short and sharp zone (stack) in the separation capillary. Then the stacked analytes are separated and detected. Regardless of the diversity of the stacking electromigration methods, one can distinguish four main principles that form the bases of nearly all of them: (i) Kohlrausch adjustment of concentrations, (ii) pH step, (iii) micellar methods, and (iv) transient ITP. This contribution is a continuation of our previous reviews on the topic and brings an overview of papers published during 2010-2012 and relevant to the mentioned principles (except the last one which is covered by another review in this issue).

  20. Wearable solar cells by stacking textile electrodes.

    PubMed

    Pan, Shaowu; Yang, Zhibin; Chen, Peining; Deng, Jue; Li, Houpu; Peng, Huisheng

    2014-06-10

    A new and general method to produce flexible, wearable dye-sensitized solar cell (DSC) textiles by the stacking of two textile electrodes has been developed. A metal-textile electrode that was made from micrometer-sized metal wires was used as a working electrode, while the textile counter electrode was woven from highly aligned carbon nanotube fibers with high mechanical strengths and electrical conductivities. The resulting DSC textile exhibited a high energy conversion efficiency that was well maintained under bending. Compared with the woven DSC textiles that are based on wire-shaped devices, this stacked DSC textile unexpectedly exhibited a unique deformation from a rectangle to a parallelogram, which is highly desired in portable electronics. This lightweight and wearable stacked DSC textile is superior to conventional planar DSCs because the energy conversion efficiency of the stacked DSC textile was independent of the angle of incident light.

  1. Near-Earth Asteroid Stack - Mission Animation

    NASA Image and Video Library

    A possible stack configuration - a deep space habitat, the Orion Multi-Purpose Crew Vehicle and Space Exploration Vehicle - approaches a near-Earth asteroid. During a mission that could take months...

  2. Characterization of Piezoelectric Stacks for Space Applications

    NASA Technical Reports Server (NTRS)

    Sherrit, Stewart; Jones, Christopher; Aldrich, Jack; Blodget, Chad; Bao, Xiaoqi; Badescu, Mircea; Bar-Cohen, Yoseph

    2008-01-01

    Future NASA missions are increasingly seeking to actuate mechanisms to precision levels in the nanometer range and below. Co-fired multilayer piezoelectric stacks offer the required actuation precision that is needed for such mechanisms. To obtain performance statistics and determine reliability for extended use, sets of commercial PZT stacks were tested in various AC and DC conditions at both nominal and high temperatures and voltages. In order to study the lifetime performance of these stacks, five actuators were driven sinusoidally for up to ten billion cycles. An automated data acquisition system was developed and implemented to monitor each stack's electrical current and voltage waveforms over the life of the test. As part of the monitoring tests, the displacement, impedance, capacitance and leakage current were measured to assess the operation degradation. This paper presents some of the results of this effort.

  3. Effects of stacking disorder on thermal conductivity of cubic ice

    NASA Astrophysics Data System (ADS)

    Johari, G. P.; Andersson, Ove

    2015-08-01

    Cubic ice is said to have stacking disorder when the H2O sequences in its structure (space group F d 3 ¯ m ) are interlaced with hexagonal ice (space group P63/mmc) sequences, known as stacking faults. Diffraction methods have shown that the extent of this disorder varies in samples made by different methods, thermal history, and the temperature T, but other physical properties of cubic and hexagonal ices barely differ. We had found that at 160 K, the thermal conductivity, κ, of cubic ice is ˜20% less than that of hexagonal ice, and this difference varies for cubic ice samples prepared by different methods and/or subjected to different thermal history. After reviewing the methods of forming cubic ice, we report an investigation of the effects of stacking disorder and other features by using new data, and by analyzing our previous data on the dependence of κ on T and on the pressure. We conclude that the lower κ of cubic ice and its weaker T-dependence is due mainly to stacking disorder and small crystal sizes. On in situ heating at 20-50 MPa pressure, κ increases and cubic ice irreversibly transforms more sharply to ice Ih, and at a higher T of ˜220 K, than it does in ex situ studies. Cooling and heating between 115 and 130 K at 0.1 K min-1 rate yield the same κ value, indicating that the state of cubic ice in these conditions does not change with time and T. The increase in κ of cubic ice observed on heat-annealing before its conversion to hexagonal ice is attributed to the loss of stacking faults and other types of disorders, and to grain growth. After discussing the consequences of our findings on other properties, we suggest that detailed studies of variation of a given property of cubic ice with the fraction of stacking faults in its structure may reveal more about the effect of this disorder. A similar disorder may occur in the mono-layers of H2O adsorbed on a substrate, in bulk materials comprised of two dimensional layers, in diamond and in

  4. Effects of stacking disorder on thermal conductivity of cubic ice.

    PubMed

    Johari, G P; Andersson, Ove

    2015-08-07

    Cubic ice is said to have stacking disorder when the H2O sequences in its structure (space group Fd3̄m) are interlaced with hexagonal ice (space group P6(3)/mmc) sequences, known as stacking faults. Diffraction methods have shown that the extent of this disorder varies in samples made by different methods, thermal history, and the temperature T, but other physical properties of cubic and hexagonal ices barely differ. We had found that at 160 K, the thermal conductivity, κ, of cubic ice is ∼20% less than that of hexagonal ice, and this difference varies for cubic ice samples prepared by different methods and/or subjected to different thermal history. After reviewing the methods of forming cubic ice, we report an investigation of the effects of stacking disorder and other features by using new data, and by analyzing our previous data on the dependence of κ on T and on the pressure. We conclude that the lower κ of cubic ice and its weaker T-dependence is due mainly to stacking disorder and small crystal sizes. On in situ heating at 20-50 MPa pressure, κ increases and cubic ice irreversibly transforms more sharply to ice Ih, and at a higher T of ∼220 K, than it does in ex situ studies. Cooling and heating between 115 and 130 K at 0.1 K min(-1) rate yield the same κ value, indicating that the state of cubic ice in these conditions does not change with time and T. The increase in κ of cubic ice observed on heat-annealing before its conversion to hexagonal ice is attributed to the loss of stacking faults and other types of disorders, and to grain growth. After discussing the consequences of our findings on other properties, we suggest that detailed studies of variation of a given property of cubic ice with the fraction of stacking faults in its structure may reveal more about the effect of this disorder. A similar disorder may occur in the mono-layers of H2O adsorbed on a substrate, in bulk materials comprised of two dimensional layers, in diamond and in

  5. Progress on the NSTX Center Stack Upgrade

    SciTech Connect

    L. Dudek, J. Chrzanowski, P. Heitzenroeder, D. Mangra, C. Neumeyer, M. Smith, R. Strykowsky, P. Titus, T. Willard

    2010-09-22

    The National Spherical Torus Experiment (NSTX) will be upgraded to provide increased toroidal field, plasma current and pulse length. This involves the replacement of the so-called center stack, including the inner legs of the Toroidal Field (TF) coil, the Ohmic Heating (OH) coil, and the inner Poloidal Field (PF) coils. In addition the increased performance of the upgrade requires qualification of remaining existing components for higher loads. Initial conceptual design efforts were based on worst-case combinations of possible currents that the power supplies could deliver. This proved to be an onerous requirement and caused many of the outer coils support structures to require costly heavy reinforcement. This has led to the planned implementation of a Digital Coil Protection System (DCPS) to reduce design-basis loads to levels that are more realistic and manageable. As a minimum, all components must be qualified for the increase in normal operating loads with headroom. Design features and analysis efforts needed to meet the upgrade loading are discussed. Mission and features of the DCPS are presented.

  6. Locating tremor using stacked products of correlations

    NASA Astrophysics Data System (ADS)

    Li, Ka Lok; Sadeghisorkhani, Hamzeh; Sgattoni, Giulia; Gudmundsson, Olafur; Roberts, Roland

    2017-04-01

    We introduce a back-projection method to locate tremor sources using products of cross-correlation envelopes of time series between seismic stations. For a given subset of n stations, we calculate the (n - 1)th-order product of cross-correlation envelopes and we stack the back-projected products over combinations of station subsets. We show that compared to existing correlation methods and for realistic signal and noise characteristics, this way of combining information can significantly reduce the effects of correlated (spurious or irrelevant signals) and uncorrelated noise. Each back-projected product constitutes an individual localized estimate of the source locations, as opposed to a hyperbola for the existing correlation techniques, assuming a uniform velocity in two dimensions. We demonstrate the method with synthetic examples and a real-data example from tremor at Katla Volcano, Iceland, in July 2011. Despite very complex near-surface structure, including strong topography and thick ice cover, the method appears to produce robust estimates of tremor location.

  7. Removal of stacking-fault tetrahedra by twin boundaries in nanotwinned metals.

    PubMed

    Yu, K Y; Bufford, D; Sun, C; Liu, Y; Wang, H; Kirk, M A; Li, M; Zhang, X

    2013-01-01

    Stacking-fault tetrahedra are detrimental defects in neutron- or proton-irradiated structural metals with face-centered cubic structures. Their removal is very challenging and typically requires annealing at very high temperatures, incorporation of interstitials or interaction with mobile dislocations. Here we present an alternative solution to remove stacking-fault tetrahedra discovered during room temperature, in situ Kr ion irradiation of epitaxial nanotwinned Ag with an average twin spacing of ~8 nm. A large number of stacking-fault tetrahedra were removed during their interactions with abundant coherent twin boundaries. Consequently the density of stacking-fault tetrahedra in irradiated nanotwinned Ag was much lower than that in its bulk counterpart. Two fundamental interaction mechanisms were identified, and compared with predictions by molecular dynamics simulations. In situ studies also revealed a new phenomenon: radiation-induced frequent migration of coherent and incoherent twin boundaries. Potential migration mechanisms are discussed.

  8. PieceStack: Toward Better Understanding of.

    PubMed

    Wu, Tongshuang; Wu, Yingcai; Shi, Conglei; Qu, Huamin; Cui, Weiwei

    2016-02-24

    Stacked graphs have been widely adopted in various fields, because they are capable of hierarchically visualizing a set of temporal sequences as well as their aggregation. However, because of visual illusion issues, connections between overly-detailed individual layers and overly-generalized aggregation are intercepted. Consequently, information in this area has yet to be fully excavated. Thus, we present PieceStack in this paper, to reveal the relevance of stacked graphs in understanding intrinsic details of their displayed shapes. This new visual analytic design interprets the ways through which aggregations are generated with individual layers by interactively splitting and re-constructing the stacked graphs. A clustering algorithm is designed to partition stacked graphs into sub-aggregated pieces based on trend similarities of layers. We then visualize the pieces with augmented encoding to help analysts decompose and explore the graphs with respect to their interests. Case studies and a user study are conducted to demonstrate the usefulness of our technique in understanding the formation of stacked graphs.

  9. New Insights into Hydrogen Bonding and Stacking Interactions in Cellulose

    SciTech Connect

    Langan, Paul

    2011-01-01

    In this quantum chemical study, we explore hydrogen bonding (H-bonding) and stacking interactions in different crystalline cellulose allomorphs, namely cellulose I and cellulose IIII. We consider a model system representing a cellulose crystalline core, made from six cellobiose units arranged in three layers with two chains per layer. We calculate the contributions of intrasheet and intersheet interactions to the structure and stability in both cellulose I and cellulose IIII crystalline cores. Reference structures for this study were generated from molecular dynamics simulations of water-solvated cellulose I and IIII fibrils. A systematic analysis of various conformations describing different mutual orientations of cellobiose units is performed using the hybrid density functional theory (DFT) with the M06-2X with 6-31+G (d, p) basis sets. We dissect the nature of the forces that stabilize the cellulose I and cellulose IIII crystalline cores and quantify the relative strength of H-bonding and stacking interactions. Our calculations demonstrate that individual H-bonding interactions are stronger in cellulose I than in cellulose IIII. We also observe a significant contribution from cooperative stacking interactions to the stabilization of cellulose I . In addition, the theory of atoms-in-molecules (AIM) has been employed to characterize and quantify these intermolecular interactions. AIM analyses highlight the role of nonconventional CH O H-bonding in the cellulose assemblies. Finally, we calculate molecular electrostatic potential maps for the cellulose allomorphs that capture the differences in chemical reactivity of the systems considered in our study.

  10. Correlated lateral phase separations in stacks of lipid membranes

    NASA Astrophysics Data System (ADS)

    Hoshino, Takuma; Komura, Shigeyuki; Andelman, David

    2015-12-01

    Motivated by the experimental study of Tayebi et al. [Nat. Mater. 11, 1074 (2012)] on phase separation of stacked multi-component lipid bilayers, we propose a model composed of stacked two-dimensional Ising spins. We study both its static and dynamical features using Monte Carlo simulations with Kawasaki spin exchange dynamics that conserves the order parameter. We show that at thermodynamical equilibrium, due to strong inter-layer correlations, the system forms a continuous columnar structure for any finite interaction across adjacent layers. Furthermore, the phase separation shows a faster dynamics as the inter-layer interaction is increased. This temporal behavior is mainly due to an effective deeper temperature quench because of the larger value of the critical temperature, Tc, for larger inter-layer interaction. When the temperature ratio, T/Tc, is kept fixed, the temporal growth exponent does not increase and even slightly decreases as a function of the increased inter-layer interaction.

  11. Intriguing relations of interaction energy components in stacked nucleic acids

    NASA Astrophysics Data System (ADS)

    Langner, Karol M.; Sokalski, W. Andrzej; Leszczynski, J.

    2007-09-01

    Major components of the interaction energy that define several approximate levels starting from second order Möller-Plesset theory were studied for 58 stacked nucleic acid dimers. They included typical B-DNA and A-DNA structures, and selected published geometries. A survey of the various terms yields an unexpected correlation between the Pauli exchange and dispersion or correlation terms, which holds for each class of similar planar geometries and for various basis sets. The geometries that exhibit these correlations span a specific range of molecular overlaps when compared to a model benzene-pyridine stacked dimer. Also, the relationship between electrostatic interactions and MP2 stabilization energies reported earlier is confirmed and a prediction interval of practical relevance is estimated.

  12. Correlated lateral phase separations in stacks of lipid membranes.

    PubMed

    Hoshino, Takuma; Komura, Shigeyuki; Andelman, David

    2015-12-28

    Motivated by the experimental study of Tayebi et al. [Nat. Mater. 11, 1074 (2012)] on phase separation of stacked multi-component lipid bilayers, we propose a model composed of stacked two-dimensional Ising spins. We study both its static and dynamical features using Monte Carlo simulations with Kawasaki spin exchange dynamics that conserves the order parameter. We show that at thermodynamical equilibrium, due to strong inter-layer correlations, the system forms a continuous columnar structure for any finite interaction across adjacent layers. Furthermore, the phase separation shows a faster dynamics as the inter-layer interaction is increased. This temporal behavior is mainly due to an effective deeper temperature quench because of the larger value of the critical temperature, Tc, for larger inter-layer interaction. When the temperature ratio, T/Tc, is kept fixed, the temporal growth exponent does not increase and even slightly decreases as a function of the increased inter-layer interaction.

  13. Compact piezoelectric stacked actuators for high power applications.

    PubMed

    Yao, K; Uchino, K; Xu, Y; Dong, S; Lim, L C

    2000-01-01

    Small, hollow, multilayer actuators with a diameter of 3 mm were fabricated by the stacking method from piezoelectric hard lead zirconate titanate (PZT) ceramics. Langevin vibrators were also constructed with the hollow multilayer actuators. The performance capabilities of the actuator and Langevin vibrator samples were examined under high-power conditions. The high-power vibration level at a given sinusoidal drive voltage was significantly enhanced by using a multilayer structure under either a nonresonance or resonance condition. A maximum vibration velocity of 0.17 m/sec was obtained for the 9-layer actuator sample under nonresonance conditions. The vibration velocity was further improved with the Langevin vibrator driven at the resonance frequency. The temperature rise due to heat generation under high-power conditions was the immediate limitation on the maximum accessible vibration velocity for the stacked actuators.

  14. Stacking Faults in Ca(OH)2 Produced by Vapour Phase Hydration

    NASA Astrophysics Data System (ADS)

    Spinolo, G.; Tamburini, U. Anselmi

    1985-01-01

    The diffraction profiles of a thin single crystal with stacking faults were calculated with the theory of diffraction of a one-dimensionally disordered crystal (Kakinoki, Komura, Allegra) by including the effect of crystallite thickness. The results hold for generalized close packed structures. An application to calcium hydroxide is discussed: the stacking faults significantly contribute to the disorder of poorly crystalline forms of Ca(OH)2 produced by reaction of calcium oxide with water vapour at room temperature.

  15. Ordering and spin waves in NaNi O2 : A stacked quantum ferromagnet

    NASA Astrophysics Data System (ADS)

    Lewis, M. J.; Gaulin, B. D.; Filion, L.; Kallin, C.; Berlinsky, A. J.; Dabkowska, H. A.; Qiu, Y.; Copley, J. R. D.

    2005-07-01

    Neutron scattering measurements on powder NaNiO2 reveal magnetic Bragg peaks and spin waves characteristic of strongly correlated s=1/2 magnetic moments arranged in ferromagnetic layers which are stacked antiferromagnetically. This structure lends itself to stacking sequence frustration in the presence of mixing between nickel and alkali metal sites, possibly providing a natural explanation for the enigmatic spin glass state of the isostructural compound, LiNiO2 .

  16. A 3000W 808nm QCW G-stack semiconductor laser array

    NASA Astrophysics Data System (ADS)

    Zhang, Pu; Wang, Jingwei; Hou, Dong; Wang, Zhenfu; Xiong, Lingling; Liu, Hui; Nie, Zhiqiang; Liu, Xingsheng

    2015-02-01

    With the improvement of output power, efficiency and reliability, high power semiconductor lasers have been applied in more and more fields. In this paper, a conduction-cooled, high peak output power semiconductor laser array was studied and developed. The structure and operation parameters of G-Stack semiconductor laser array were designed and optimized using finite element method (FEM). A Quasi-continuous-wave (QCW) conduction-cooled G-Stack semiconductor laser array with a narrow spectrum width was fabricated successfully.

  17. Recent advances in stacked inverted top-emitting organic electrophosphorescent diodes (presentation video)

    NASA Astrophysics Data System (ADS)

    Kippelen, Bernard; Knauer, Keith A.; Najafabadi, Ehsan M.; Zhou, Yinhua; Fuentes-Hernandez, Canek

    2014-10-01

    In this talk, we will discuss recent advances in green and white electrophosphorescent stacked organic light-emitting diodes (OLEDs) with inverted top-emitting structures. These devices combine the advantages of having inverted electrode positions, a top-emissive design, and a stacked architecture. We will also demonstrate OLEDs that are fabricated on cellulose nanocrystal substrates and discuss how the use of such naturally-derived materials can reduce the environmental footprint of organic electronic devices such as OLEDs.

  18. Control of layer stacking in CVD graphene under quasi-static condition.

    PubMed

    Subhedar, Kiran M; Sharma, Indu; Dhakate, Sanjay R

    2015-09-14

    The type of layer stacking in bilayer graphene has a significant influence on its electronic properties because of the contrast nature of layer coupling. Herein, different geometries of the reaction site for the growth of bilayer graphene by the chemical vapor deposition (CVD) technique and their effects on the nature of layer stacking are investigated. Micro-Raman mapping and curve fitting analysis confirmed the type of layer stacking for the CVD grown bilayer graphene. The samples grown with sandwiched structure such as quartz/Cu foil/quartz along with a spacer, between the two quartz plates to create a sealed space, resulted in Bernal or AB stacked bilayer graphene while the sample sandwiched without a spacer produced the twisted bilayer graphene. The contrast difference in the layer stacking is a consequence of the difference in the growth mechanism associated with different geometries of the reaction site. The diffusion dominated process under quasi-static control is responsible for the growth of twisted bilayer graphene in sandwiched geometry while surface controlled growth with ample and continual supply of carbon in sandwiched geometry along with a spacer, leads to AB stacked bilayer graphene. Through this new approach, an efficient technique is presented to control the nature of layer stacking.

  19. Generalization of the H-κ stacking method to anisotropic media

    NASA Astrophysics Data System (ADS)

    Kaviani, Ayoub; Rümpker, Georg

    2015-07-01

    We investigate the effect of anisotropy on estimates of crustal thickness H and average bulk VP/VS-ratio κ. Here we extend the stacking approach of Zhu and Kanamori (2000) to include all 20 P-to-S converted waves and their crustal reverberations that are generated in the anisotropic case—instead of only five phases in the isotropic case. The ray-based algorithm of Frederiksen and Bostock (2000) is used to calculate the amplitude and arrival time of each phase. Synthetic tests are performed to investigate the feasibility and robustness of the stacking approach. For simplicity, we assume hexagonal symmetry and a horizontal symmetry axis, but more general anisotropy may be considered. The tests reveal that the estimates of H and κ can be significantly affected by the presence of crustal anisotropy. We verify the feasibility of the stacking approach for real data by applying the method to examples from three different tectonic regions. The results show that the anisotropic stacking scheme presented here can provide a much better constraint on the estimation of H and κ than is achieved using isotropic stacking. Anisotropic stacking can also help resolve the ambiguity in determination of H and κ that arises when several maxima from stacking amplitudes of receiver functions occur in the case of complex crustal structure.

  20. Multiple Dirac particles in AA-stacked graphite and multilayers of graphene

    NASA Astrophysics Data System (ADS)

    Lobato, I.; Partoens, B.

    2011-04-01

    Using the tight-binding formalism we show that in the recently experimentally realized AA-stacked graphite in essence two types of massless relativistic Dirac particles are present with a different effective speed of light. We also investigate how the electronic structure evolves from a single graphene sheet into AA-stacked graphite. It is shown that in contrast to AB-stacked graphene layers, the spectrum of AA-stacked graphene layers can be considered as a superposition of single-layer spectra and only particles with a linear spectrum at the Fermi energy around the K point are present. From the evolution of the band overlap we show that 6 multilayers of AA-stacked graphene already behave as AA-stacked graphite. The evolution of the effective speeds of light of the Dirac particles to their bulk values shows exactly the same behavior. The tight-binding parameters we use to describe AA-stacked graphite and multilayers of graphene are obtained by ab initio calculations.

  1. Plated lamination structures for integrated magnetic devices

    SciTech Connect

    Webb, Bucknell C.

    2014-06-17

    Semiconductor integrated magnetic devices such as inductors, transformers, etc., having laminated magnetic-insulator stack structures are provided, wherein the laminated magnetic-insulator stack structures are formed using electroplating techniques. For example, an integrated laminated magnetic device includes a multilayer stack structure having alternating magnetic and insulating layers formed on a substrate, wherein each magnetic layer in the multilayer stack structure is separated from another magnetic layer in the multilayer stack structure by an insulating layer, and a local shorting structure to electrically connect each magnetic layer in the multilayer stack structure to an underlying magnetic layer in the multilayer stack structure to facilitate electroplating of the magnetic layers using an underlying conductive layer (magnetic or seed layer) in the stack as an electrical cathode/anode for each electroplated magnetic layer in the stack structure.

  2. Electric field control of soliton motion and stacking in trilayer graphene

    NASA Astrophysics Data System (ADS)

    Yankowitz, Matthew; Wang, Joel I.-Jan; Birdwell, A. Glen; Chen, Yu-An; Watanabe, K.; Taniguchi, T.; Jacquod, Philippe; San-Jose, Pablo; Jarillo-Herrero, Pablo; Leroy, Brian J.

    2014-08-01

    The crystal structure of a material plays an important role in determining its electronic properties. Changing from one crystal structure to another involves a phase transition that is usually controlled by a state variable such as temperature or pressure. In the case of trilayer graphene, there are two common stacking configurations (Bernal and rhombohedral) that exhibit very different electronic properties. In graphene flakes with both stacking configurations, the region between them consists of a localized strain soliton where the carbon atoms of one graphene layer shift by the carbon-carbon bond distance. Here we show the ability to move this strain soliton with a perpendicular electric field and hence control the stacking configuration of trilayer graphene with only an external voltage. Moreover, we find that the free-energy difference between the two stacking configurations scales quadratically with electric field, and thus rhombohedral stacking is favoured as the electric field increases. This ability to control the stacking order in graphene opens the way to new devices that combine structural and electrical properties.

  3. Vibronic model of PTCDA stacks: fluorescence and relaxation energies

    NASA Astrophysics Data System (ADS)

    Hennessy, M. H.; Pascal, R. A., Jr.; Soos, Zoltan G.

    1999-12-01

    Face-to-face stacks of PTCDA molecules in films and multiple quantum wells are modeled using Frenkel and charge-transfer excitons that are coupled to a characteristic molecular vibration. The intensity and vibronic structure of film fluorescence are extensions of the mixed Frenkel-CT model for absorption and electroabsorption. Ab initio relaxation energies of PTCDA excited states and molecular ions provide independent estimates of model parameters, while the (pi) - (pi) * transition dipole gives the hopping integral J. PTCDA's close connections to conjugated hydrocarbons and its structural and electronic simplicity are emphasized.

  4. Manifold gasket accommodating differential movement of fuel cell stack

    DOEpatents

    Kelley, Dana A.; Farooque, Mohammad

    2007-11-13

    A gasket for use in a fuel cell system having at least one externally manifolded fuel cell stack, for sealing the manifold edge and the stack face. In accordance with the present invention, the gasket accommodates differential movement between the stack and manifold by promoting slippage at interfaces between the gasket and the dielectric and between the gasket and the stack face.

  5. Launch Vehicle Stage Adapter from Start to Stack

    NASA Image and Video Library

    2016-10-16

    See how a test version of the launch vehicle stage adapter (LVSA) for NASA's new rocket, the Space Launch System, is designed, built and stacked in a test stand at the agency's Marshall Space Flight Center in Huntsville, Alabama. The LVSA was moved to a 65-foot-tall test stand Oct. 12 at Marshall. The test version LVSA will be stacked with other test pieces of the upper part of the SLS rocket and pushed, pulled and twisted as part of an upcoming test series to ensure each structure can withstand the incredible stresses of launch. The LVSA joins the core stage simulator, which was loaded into the test stand Sept. 21. The other three qualification articles and the Orion simulator will complete the stack later this fall. Testing is scheduled to begin in early 2017. SLS will be the world’s most powerful rocket, and with the Orion spacecraft, take astronauts to deep-space destinations, including the Journey to Mars. More information on the upcoming test series can be found here: http://go.nasa.gov/2dS8yXB

  6. Managing multiple image stacks from confocal laser scanning microscopy

    NASA Astrophysics Data System (ADS)

    Zerbe, Joerg; Goetze, Christian H.; Zuschratter, Werner

    1999-05-01

    A major goal in neuroanatomy is to obtain precise information about the functional organization of neuronal assemblies and their interconnections. Therefore, the analysis of histological sections frequently requires high resolution images in combination with an overview about the structure. To overcome this conflict we have previously introduced a software for the automatic acquisition of multiple image stacks (3D-MISA) in confocal laser scanning microscopy. Here, we describe a Windows NT based software for fast and easy navigation through the multiple images stacks (MIS-browser), the visualization of individual channels and layers and the selection of user defined subregions. In addition, the MIS browser provides useful tools for the visualization and evaluation of the datavolume, as for instance brightness and contrast corrections of individual layers and channels. Moreover, it includes a maximum intensity projection, panning and zoom in/out functions within selected channels or focal planes (x/y) and tracking along the z-axis. The import module accepts any tiff-format and reconstructs the original image arrangement after the user has defined the sequence of images in x/y and z and the number of channels. The implemented export module allows storage of user defined subregions (new single image stacks) for further 3D-reconstruction and evaluation.

  7. Joining cross-stacked carbon nanotube architecture with covalent bonding

    NASA Astrophysics Data System (ADS)

    Li, Ru; Gong, Wenbin; He, Qiang; Li, Qingwen; Lu, Weibang; Zhu, Wenjun

    2017-05-01

    Carbon nanotubes (CNTs) have superior mechanical properties that make them highly attractive for high performance bulk structures such as CNT fibers and films; however, the weak wan der Waals interaction between CNTs gives degraded strength and modulus, forming covalent bonding between CNTs which is considered to be highly promising but remains a considerable challenge due to the inert nature of the carbon surface. An appropriate electron-beam, as yet, has been used to introduce covalent bonding but limited to CNT bundles. Here, we used a spinnable CNT array to form a cross-stacked CNT architecture first, a bulk film, and proved that sp3 covalent bonding can be directly formed between cross-stacked CNTs under high pressure at appropriate temperatures via a laser heated diamond anvil cell method. The Raman spectrum and molecular dynamic simulations were used to probe and interpret the bonding formation process, respectively. It was found that under 30 GPa with the temperature of 765-1345 K, sp3 covalent bonding was mainly formed in the cross-stacked region. We anticipate that the formation of sp3 covalent bonding between CNTs under high pressure could offer a general pathway to enhance the performance of nano-carbon based materials.

  8. Development of small polymer electrolyte fuel cell stacks

    SciTech Connect

    Paganin, V.A.; Ticianelli, E.A.; Gonzalez, E.R.

    1996-12-31

    The polymer electrolyte fuel cell (PEFC) has been one of the most studied fuel cell systems, because of several advantages for transportation applications. Research involve fundamental aspects related to the water transport and the fuel cell reactions, the practical aspects related to the optimization of the structure and operational conditions of gas diffusion electrodes, and technological aspects related to water management and the engineering of operational sized fuel cell modules. In many of these works it is observed that very satisfactory results regarding the performance of low catalyst loading electrodes (0.15 to 0.4 mg Pt/cm{sup 2}) have been obtained in single cells. However, the use of such electrodes is not yet being considered for building fuel cell stacks and, although not usually mentioned, fuel cell modules are assembled employing electrodes presenting catalyst loadings in the range of 2 to 4 mgPt cm{sup -2}. In this work the results on the research and development of small polymer electrolyte fuel cell stacks employing low catalyst loading electrodes are described. The systems include the assembly of single cells, 6-cell and 21-cell modules. Testing of the stacks was conducted in a specially designed test station employing non-pressurized H{sub 2}/O{sub 2} reactants and measuring the individual and the overall cell voltage versus current characteristics under several operational conditions for the system.

  9. Oxidative unzipping of stacked nitrogen-doped carbon nanotube cups.

    PubMed

    Dong, Haifeng; Zhao, Yong; Tang, Yifan; Burkert, Seth C; Star, Alexander

    2015-05-27

    We demonstrate a facile synthesis of different nanostructures by oxidative unzipping of stacked nitrogen-doped carbon nanotube cups (NCNCs). Depending on the initial number of stacked-cup segments, this method can yield graphene nanosheets (GNSs) or hybrid nanostructures comprised of graphene nanoribbons partially unzipped from a central nanotube core. Due to the stacked-cup structure of as-synthesized NCNCs, preventing complete exposure of graphitic planes, the unzipping mechanism is hindered, resulting in incomplete unzipping; however, individual, separated NCNCs are completely unzipped, yielding individual nitrogen-doped GNSs. Graphene-based materials have been employed as electrocatalysts for many important chemical reactions, and it has been proposed that increasing the reactive edges results in more efficient electrocatalysis. In this paper, we apply these graphene conjugates as electrocatalysts for the oxygen reduction reaction (ORR) to determine how the increase in reactive edges affects the electrocatalytic activity. This investigation introduces a new method for the improvement of ORR electrocatalysts by using nitrogen dopants more effectively, allowing for enhanced ORR performance with lower overall nitrogen content. Additionally, the GNSs were functionalized with gold nanoparticles (GNPs), resulting in a GNS/GNP hybrid, which shows efficient surface-enhanced Raman scattering and expands the scope of its application in advanced device fabrication and biosensing.

  10. Aeroservoelastic Stability Analysis of the X-43A Stack

    NASA Technical Reports Server (NTRS)

    Pak, Chan-gi

    2008-01-01

    The first air launch attempt of an X-43A stack, consisting of the booster, adapter and Hyper-X research vehicle, ended in failure shortly after the successful drop from the National Aeronautics and Space Administration Dryden Flight Research Center (Edwards, California) B-52B airplane and ignition of the booster. The stack was observed to begin rolling and yawing violently upon reaching transonic speeds, and the grossly oscillating fins of the booster separated shortly thereafter. The flight then had to be terminated with the stack out of control. Very careful linear flutter and aeroservoelastic analyses were subsequently performed as reported herein to numerically duplicate the observed instability. These analyses properly identified the instability mechanism and demonstrated the importance of including the flight control laws, rigid-body modes, structural flexible modes and control surface flexible modes. In spite of these efforts, however, the predicted instability speed remained more than 25 percent higher than that observed in flight. It is concluded that transonic shock phenomena, which linear analyses cannot take into account, are also important for accurate prediction of this mishap instability.

  11. Enhanced dynamical stability with harmonic slip stacking

    DOE PAGES

    Eldred, Jeffrey; Zwaska, Robert

    2016-10-26

    We develop a configuration of radio-frequency (rf) cavities to dramatically improve the performance of slip-stacking. Slip-stacking is an accumulation technique used at Fermilab to nearly double proton intensity by maintaining two beams of different momenta in the same storage ring. The two particle beams are longitudinally focused in the Recycler by two 53 MHz 100 kV rf cavities with a small frequency difference between them. We propose an additional 106 MHz 20 kV rf cavity with a frequency at the double the average of the upper and lower main rf frequencies. We show the harmonic rf cavity cancels out themore » resonances generated between the two main rf cavities and we derive the relationship between the harmonic rf voltage and the main rf voltage. We find the area factors that can be used to calculate the available phase space area for any set of beam parameters without individual simulation. We establish Booster beam quality requirements to achieve 99\\% slip-stacking efficiency. We measure the longitudinal distribution of the Booster beam and use it to generate a realistic beam model for slip-stacking simulation. In conclusion, we demonstrate that the harmonic rf cavity can not only reduce particle loss during slip-stacking, but also reduce the final longitudinal emittance.« less

  12. Technical description of Stack 296-B-5

    SciTech Connect

    Ridge, T.M.

    1994-11-15

    Of particular concern to facilities on the Hanford site is Title 40, Code of Federal Regulations, Chapter 40, Part 61, Subpart H, ``National emission Standards for Emissions of Radionuclides Other Than Radon From Department of Energy Facilities.`` Assessments of facility stacks and potential radionuclide emissions determined whether these stacks would be subject to the sampling and monitoring requirements of 40 CFR 61, Subpart H. Stack 296-B-5 exhausts 221-BB building which houses tanks containing B Plant steam condensate and B Plant process condensate from the operation of the low-level waste concentrator. The assessment of potential radionuclide emissions from the 296-B-5 stack resulted in an effective dose equivalent to the maximally exposed individual of less than 0.1 millirem per year. Therefore, the stack is not subject to the sampling and monitoring requirements of 40 CFR 61, Subpart H. However, the sampling and monitoring system must be in compliance with the Environmental Compliance Manual, WHC-CM-7-5. Currently, 296-B-5 is sampled continuously with a record sampler and continuous air monitor (CAM).

  13. Enhanced dynamical stability with harmonic slip stacking

    NASA Astrophysics Data System (ADS)

    Eldred, Jeffrey; Zwaska, Robert

    2016-10-01

    We develop a configuration of radio-frequency (rf) cavities to dramatically improve the performance of slip stacking. Slip stacking is an accumulation technique used at Fermilab to nearly double proton intensity by maintaining two beams of different momenta in the same storage ring. The two particle beams are longitudinally focused in the Recycler by two 53 MHz 100 kV rf cavities with a small frequency difference between them. We propose an additional 106 MHz 20 kV rf cavity with a frequency at the double the average of the upper and lower main rf frequencies. We show the harmonic rf cavity cancels out the resonances generated between the two main rf cavities and we derive the relationship between the harmonic rf voltage and the main rf voltage. We find the area factors that can be used to calculate the available phase space area for any set of beam parameters without individual simulation. We establish Booster beam quality requirements to achieve 99% slip stacking efficiency. We measure the longitudinal distribution of the Booster beam and use it to generate a realistic beam model for slip stacking simulation. We demonstrate that the harmonic rf cavity can not only reduce particle loss during slip stacking, but also reduce the final longitudinal emittance.

  14. Inflatable containment diaphragm for sealing and removing stacks

    DOEpatents

    Meskanick, G.R.; Rosso, D.T.

    1993-04-13

    A diaphragm with an inflatable torus-shaped perimeter is used to seal at least one end of a stack so that debris that might be hazardous will not be released during removal of the stack. A diaphragm is inserted and inflated in the lower portion of a stack just above where the stack is to be cut such that the perimeter of the diaphragm expands and forms a seal against the interior surface of the stack.

  15. Irregular stacking sequence in the initial growth of ultrathin Rh films on Ru(0001)

    SciTech Connect

    He Yunbin; Over, Herbert; Seitsonen, Ari P.

    2005-08-15

    Rhodium grows on single-crystal Ru(0001) surface initially layer by layer, adapting the in-plane lattice parameters of Ru(0001) (pseudomorphic growth). Using quantitative low-energy electron diffraction (LEED) and density functional theory (DFT) calculations, we determined the atomic structures of 1-monolayer (ML), 2-ML, and 3-ML Rh films on Ru(0001). The 1-ML Rh film continues the hexagonal-close-packed (hcp) stacking sequence of Ru(0001) (...ABAb), while the 2-ML Rh film already adopts its face-centered-cubic (fcc) stacking sequence (...ABAbc) if the topmost Ru layer is included into the stacking consideration. Three MLs of Rh form a fcc stacking sequence of ...ABAbac, requiring a massive restructuring of the second Rh layer when adding one ML of Rh onto the 2-ML Rh film.

  16. Oxidation behavior of metallic interconnect in solid oxide fuel cell stack

    NASA Astrophysics Data System (ADS)

    Li, Jun; Zhang, Wenying; Yang, Jiajun; Yan, Dong; Pu, Jian; Chi, Bo; Jian, Li

    2017-06-01

    Oxidation behavior of integrated interconnect with bipolar plate and corrugated sheet made by ferrite steel SUS430 is investigated and compared in simulated environment and in a realistic stack. Electrical current is found to have a direction-related impact on the thickness of the Cr2O3/MnCr2O4 composite oxide scale. Oxide scale of the interconnect aged in the stack exhibits a dual-layered structure of a complex Mn-Cr oxide layer covered by iron oxide. The oxidation rates vary greatly depending on its local environment, with different thermal, electrical density, as well as gas composition conditions. By analyzing the thickness distribution of oxide scale and comparing them with the simulated test result, the oxidation behavior of interconnect in stack is described in high definition. ASR distribution is also conducted by calculation, which could help further understanding the behavior of stack degradation.

  17. Stacking fault domains as sources of a-type threading dislocations in III-nitride heterostructures

    NASA Astrophysics Data System (ADS)

    Smalc-Koziorowska, J.; Bazioti, C.; Albrecht, M.; Dimitrakopulos, G. P.

    2016-02-01

    A mechanism for the nucleation of a-type threading dislocation half-loops from basal stacking faults in wurtzite III-nitride heterostructures is presented. Transmission electron microscopy observations, in conjunction with topological and strain analysis, show that there are two possible configurations of closed domains comprising basal stacking faults of I1 type. It is shown that the lattice dislocation may emanate when the sphalerite structural units of the stacking faults in the closed domain are oriented in a parallel manner. The closed domain configurations do not introduce any shift on the basal planes, resulting in zero defect content along the growth direction. The stacking fault domains are hexagonal, with sides along the ⟨ 10 1 ¯ 0 ⟩ directions, and the threading dislocation half loops nucleate at the line nodes. The mechanism was found to be operational in multiple III-nitride systems.

  18. Synthesis of aluminium indium nitride (AlInN) thin films by stacked elemental layers method

    NASA Astrophysics Data System (ADS)

    Afzal, Naveed; Devarajan, Mutharasu; Ibrahim, Kamarulazizi

    2014-07-01

    AlInN thin films were synthesized on Si substrates by using stacked elemental layers (SEL) technique. Three stacking sequence Al/InN, Al/InN/Al/InN and Al/InN/Al/InN/Al/InN were prepared on Si (1 0 0) substrates by reactive RF sputtering of In target in Ar-N2 and DC sputtering of Al target in Ar atmosphere at room temperature. Annealing of the deposited stacks was carried out at 400 °C for 6 h in a three zone tube furnace. Structural properties of the annealed films were investigated using X-ray diffraction (XRD) whereas the surface analysis of the films was carried out using field emission scanning electron microscope (FESEM) and atomic force microscope (AFM). XRD results show the formation of wurtzite AlInN thin films which become more obvious with increasing the stacked layers. FESEM analysis reveals drops-like polycrystalline films structure with randomly oriented grains whereas the AFM results show a decrease in the surface roughness with increasing stacking sequence. The formation of more prominent AlInN films with increase of stacking layers is attributed to a uniform interaction among the top and bottom Al and InN multilayers as a result of the annealing.

  19. Multi-Stacked Supported Lipid Bilayer Micropatterning through Polymer Stencil Lift-Off.

    PubMed

    Zhu, Yujie; Negmi, Ahmed; Moran-Mirabal, Jose

    2015-08-28

    Complex multi-lamellar structures play a critical role in biological systems, where they are present as lamellar bodies, and as part of biological assemblies that control energy transduction processes. Multi-lamellar lipid layers not only provide interesting systems for fundamental research on membrane structure and bilayer-associated polypeptides, but can also serve as components in bioinspired materials or devices. Although the ability to pattern stacked lipid bilayers at the micron scale is of importance for these purposes, limited work has been done in developing such patterning techniques. Here, we present a simple and direct approach to pattern stacked supported lipid bilayers (SLBs) using polymer stencil lift-off and the electrostatic interactions between cationic and anionic lipids. Both homogeneous and phase-segregated stacked SLB patterns were produced, demonstrating that the stacked lipid bilayers retain lateral diffusivity. We demonstrate patterned SLB stacks of up to four bilayers, where fluorescence resonance energy transfer (FRET) and quenching was used to probe the interactions between lipid bilayers. Furthermore, the study of lipid phase behaviour showed that gel phase domains align between adjacent layers. The proposed stacked SLB pattern platform provides a robust model for studying lipid behaviour with a controlled number of bilayers, and an attractive means towards building functional bioinspired materials or devices.

  20. Solid oxide fuel cell generator with removable modular fuel cell stack configurations

    DOEpatents

    Gillett, James E.; Dederer, Jeffrey T.; Zafred, Paolo R.; Collie, Jeffrey C.

    1998-01-01

    A high temperature solid oxide fuel cell generator produces electrical power from oxidation of hydrocarbon fuel gases such as natural gas, or conditioned fuel gases, such as carbon monoxide or hydrogen, with oxidant gases, such as air or oxygen. This electrochemical reaction occurs in a plurality of electrically connected solid oxide fuel cells bundled and arrayed in a unitary modular fuel cell stack disposed in a compartment in the generator container. The use of a unitary modular fuel cell stack in a generator is similar in concept to that of a removable battery. The fuel cell stack is provided in a pre-assembled self-supporting configuration where the fuel cells are mounted to a common structural base having surrounding side walls defining a chamber. Associated generator equipment may also be mounted to the fuel cell stack configuration to be integral therewith, such as a fuel and oxidant supply and distribution systems, fuel reformation systems, fuel cell support systems, combustion, exhaust and spent fuel recirculation systems, and the like. The pre-assembled self-supporting fuel cell stack arrangement allows for easier assembly, installation, maintenance, better structural support and longer life of the fuel cells contained in the fuel cell stack.

  1. Solid oxide fuel cell generator with removable modular fuel cell stack configurations

    DOEpatents

    Gillett, J.E.; Dederer, J.T.; Zafred, P.R.; Collie, J.C.

    1998-04-21

    A high temperature solid oxide fuel cell generator produces electrical power from oxidation of hydrocarbon fuel gases such as natural gas, or conditioned fuel gases, such as carbon monoxide or hydrogen, with oxidant gases, such as air or oxygen. This electrochemical reaction occurs in a plurality of electrically connected solid oxide fuel cells bundled and arrayed in a unitary modular fuel cell stack disposed in a compartment in the generator container. The use of a unitary modular fuel cell stack in a generator is similar in concept to that of a removable battery. The fuel cell stack is provided in a pre-assembled self-supporting configuration where the fuel cells are mounted to a common structural base having surrounding side walls defining a chamber. Associated generator equipment may also be mounted to the fuel cell stack configuration to be integral therewith, such as a fuel and oxidant supply and distribution systems, fuel reformation systems, fuel cell support systems, combustion, exhaust and spent fuel recirculation systems, and the like. The pre-assembled self-supporting fuel cell stack arrangement allows for easier assembly, installation, maintenance, better structural support and longer life of the fuel cells contained in the fuel cell stack. 8 figs.

  2. Multi-Stacked Supported Lipid Bilayer Micropatterning through Polymer Stencil Lift-Off

    PubMed Central

    Zhu, Yujie; Negmi, Ahmed; Moran-Mirabal, Jose

    2015-01-01

    Complex multi-lamellar structures play a critical role in biological systems, where they are present as lamellar bodies, and as part of biological assemblies that control energy transduction processes. Multi-lamellar lipid layers not only provide interesting systems for fundamental research on membrane structure and bilayer-associated polypeptides, but can also serve as components in bioinspired materials or devices. Although the ability to pattern stacked lipid bilayers at the micron scale is of importance for these purposes, limited work has been done in developing such patterning techniques. Here, we present a simple and direct approach to pattern stacked supported lipid bilayers (SLBs) using polymer stencil lift-off and the electrostatic interactions between cationic and anionic lipids. Both homogeneous and phase-segregated stacked SLB patterns were produced, demonstrating that the stacked lipid bilayers retain lateral diffusivity. We demonstrate patterned SLB stacks of up to four bilayers, where fluorescence resonance energy transfer (FRET) and quenching was used to probe the interactions between lipid bilayers. Furthermore, the study of lipid phase behaviour showed that gel phase domains align between adjacent layers. The proposed stacked SLB pattern platform provides a robust model for studying lipid behaviour with a controlled number of bilayers, and an attractive means towards building functional bioinspired materials or devices. PMID:26343733

  3. Nanostructured arrays of stacked graphene sheets

    NASA Astrophysics Data System (ADS)

    Böttcher, Artur; Löffler, Daniel; Bajales, Noelia; Ulas, Seyithan; Machatschek, Rainhard; Malik, Sharali; Brenner, Patrice; Kappes, Manfred M.

    2012-10-01

    Molecular oxygen etching of HOPG surfaces prepatterned by Ga+ focused-ion-beam irradiation (FIB) has been used to generate large-area arrays of nanometer-sized graphite blocks. AFM and SEM imaging show that structures with lateral sizes down to ˜100 nm and heights of between 30 and 55 nm can be routinely fabricated. The trenches separating the graphite blocks form in the early oxidation stages via preferential gasification (into CO and CO2) of the gridlike amorphized carbon regions written by FIB. In the later oxidative etching stages, gasification of the graphite nanoprism faces laterally terminating the graphite blocks becomes the major reaction channel. Correspondingly, graphite blocks are (further) reduced in lateral extent while the trenches in between are widened. Raman and photoionization spectroscopies indicate that the quality of the topmost nG sheet(s) covering the blocks also decreases with increasing etching time—as the size and lateral density of defect-mediated etch pits increases. nG block arrays are useful substrates with which to probe the size-dependent properties of nanographene, as they comprise large numbers of uniform sheets (ca. 4 × 1010 cm-2 for an array of 0.5 × 0.5 μm2) thus allowing for the application of area-integrating spectroscopic methods. We demonstrate this by examining the Raman features of nG block arrays which include a graphene-rim-region fingerprint mode. Individual nG sheets can be exfoliated from nG stacks by means of electron-irradiation-induced charging. We have explored a number of printing/manipulation strategies aimed at controllable electromechanical transfer of nG sheet arrays to silicon wafers.

  4. TESTING FOR CPT VIOLATION IN Bstack">0stack">s SEMILEPTONIC DECAYS

    NASA Astrophysics Data System (ADS)

    Kooten, R. Van

    2014-01-01

    A DØ analysis measuring the charge asymmetry Astack">bstack">sl of like-sign dimuon events due to semileptonic b-hadron decays at the Fermilab Tevatron Collider has shown indications of possible anomalous CP violation in the mixing of neutral B mesons. This result has been used to extract the first senstivity to CPT violation in the Bstack">0stack">s system. An analysis to explore further this anomaly by specifically measuring the semileptonic charge asymmetry, astack">sstack">sl, in Bstack">0stack">s decays is described, as well as how a variant of this analysis can be used to explore a larger set of CPT-violating parameters in the Bstack">0stack">s system for the first time.

  5. Fuel cell stack monitoring and system control

    DOEpatents

    Keskula, Donald H.; Doan, Tien M.; Clingerman, Bruce J.

    2005-01-25

    A control method for monitoring a fuel cell stack in a fuel cell system in which the actual voltage and actual current from the fuel cell stack are monitored. A preestablished relationship between voltage and current over the operating range of the fuel cell is established. A variance value between the actual measured voltage and the expected voltage magnitude for a given actual measured current is calculated and compared with a predetermined allowable variance. An output is generated if the calculated variance value exceeds the predetermined variance. The predetermined voltage-current for the fuel cell is symbolized as a polarization curve at given operating conditions of the fuel cell. Other polarization curves may be generated and used for fuel cell stack monitoring based on different operating pressures, temperatures, hydrogen quantities.

  6. Progress of MCFC stack technology at Toshiba

    SciTech Connect

    Hori, M.; Hayashi, T.; Shimizu, Y.

    1996-12-31

    Toshiba is working on the development of MCFC stack technology; improvement of cell characteristics, and establishment of separator technology. For the cell technology, Toshiba has concentrated on both the restraints of NiO cathode dissolution and electrolyte loss from cells, which are the critical issues to extend cell life in MCFC, and great progress has been made. On the other hand, recognizing that the separator is one of key elements in accomplishing reliable and cost-competitive MCFC stacks, Toshiba has been accelerating the technology establishment and verification of an advanced type separator. A sub-scale stack with such a separator was provided for an electric generating test, and has been operated for more than 10,000 hours. This paper presents several topics obtained through the technical activities in the MCFC field at Toshiba.

  7. A stack of cards rebuilt with calculus

    NASA Astrophysics Data System (ADS)

    Kazachkov, Alexander; Kireš, Marián

    2017-07-01

    Previous work covers building a tower from a stack of homogeneous rectangular plates, each with a maximum shift in displacement. We suggest using plates shaped as curvilinear triangles bounded by segments of power-law functions. The masses of the plates and the position of their center of mass are calculated and measured experimentally after cutting them out from cardboard and aluminum sheets. A computer simulation of the displacement towers is combined with their live building. Individual maximum shifts of the plates in the stack prove to be much bigger the higher the power coefficient of the boundary curves. The resulting total overhang of such a displacement tower may exceed that of a stack of traditionally used homogeneous rectangular cards.

  8. Radiation Tolerant Intelligent Memory Stack (RTIMS)

    NASA Technical Reports Server (NTRS)

    Ng, Tak-kwong; Herath, Jeffrey A.

    2006-01-01

    The Radiation Tolerant Intelligent Memory Stack (RTIMS), suitable for both geostationary and low earth orbit missions, has been developed. The memory module is fully functional and undergoing environmental and radiation characterization. A self-contained flight-like module is expected to be completed in 2006. RTIMS provides reconfigurable circuitry and 2 gigabits of error corrected or 1 gigabit of triple redundant digital memory in a small package. RTIMS utilizes circuit stacking of heterogeneous components and radiation shielding technologies. A reprogrammable field programmable gate array (FPGA), six synchronous dynamic random access memories, linear regulator, and the radiation mitigation circuitries are stacked into a module of 42.7mm x 42.7mm x 13.00mm. Triple module redundancy, current limiting, configuration scrubbing, and single event function interrupt detection are employed to mitigate radiation effects. The mitigation techniques significantly simplify system design. RTIMS is well suited for deployment in real-time data processing, reconfigurable computing, and memory intensive applications.

  9. Electrochemical Detection in Stacked Paper Networks.

    PubMed

    Liu, Xiyuan; Lillehoj, Peter B

    2015-08-01

    Paper-based electrochemical biosensors are a promising technology that enables rapid, quantitative measurements on an inexpensive platform. However, the control of liquids in paper networks is generally limited to a single sample delivery step. Here, we propose a simple method to automate the loading and delivery of liquid samples to sensing electrodes on paper networks by stacking multiple layers of paper. Using these stacked paper devices (SPDs), we demonstrate a unique strategy to fully immerse planar electrodes by aqueous liquids via capillary flow. Amperometric measurements of xanthine oxidase revealed that electrochemical sensors on four-layer SPDs generated detection signals up to 75% higher compared with those on single-layer paper devices. Furthermore, measurements could be performed with minimal user involvement and completed within 30 min. Due to its simplicity, enhanced automation, and capability for quantitative measurements, stacked paper electrochemical biosensors can be useful tools for point-of-care testing in resource-limited settings.

  10. High frequency model of stacked film capacitors

    NASA Astrophysics Data System (ADS)

    Talbert, T.; Joubert, C.; Daude, N.; Glaize, C.

    2001-11-01

    Polypropylene metallized capacitors are of general use in power electronics because of their reliability, their self-healing capabilities, and their low price. Though the behavior of metallized coiled capacitors has been discussed, no work has been carried out on stacked and flattened metallized capacitors. The purpose of this article is to suggest an analytical model of resonance frequency, stray inductance and impedance of stacked capacitors. We first solve the equation of propagation of the magnetic potential vector (A) in the dielectric of an homogeneous material. Then, we suggest an original method of resolution, like the one used for resonant cavities, in order to present an analytical solution of the problem. Finally, we give some experimental results proving that the physical knowledge of the parameters of the capacitor (dimension of the component, and material constants), enables us to calculate an analytical model of resonance frequency, stray inductance and impedance of stacked capacitors.

  11. Fuel cell stack monitoring and system control

    DOEpatents

    Keskula, Donald H.; Doan, Tien M.; Clingerman, Bruce J.

    2004-02-17

    A control method for monitoring a fuel cell stack in a fuel cell system in which the actual voltage and actual current from the fuel cell stack are monitored. A preestablished relationship between voltage and current over the operating range of the fuel cell is established. A variance value between the actual measured voltage and the expected voltage magnitude for a given actual measured current is calculated and compared with a predetermined allowable variance. An output is generated if the calculated variance value exceeds the predetermined variance. The predetermined voltage-current for the fuel cell is symbolized as a polarization curve at given operating conditions of the fuel cell.

  12. Three wafer stacking for 3D integration.

    SciTech Connect

    Greth, K. Douglas; Ford, Christine L.; Lantz, Jeffrey W.; Shinde, Subhash L.; Timon, Robert P.; Bauer, Todd M.; Hetherington, Dale Laird; Sanchez, Carlos Anthony

    2011-11-01

    Vertical wafer stacking will enable a wide variety of new system architectures by enabling the integration of dissimilar technologies in one small form factor package. With this LDRD, we explored the combination of processes and integration techniques required to achieve stacking of three or more layers. The specific topics that we investigated include design and layout of a reticle set for use as a process development vehicle, through silicon via formation, bonding media, wafer thinning, dielectric deposition for via isolation on the wafer backside, and pad formation.

  13. Nonlinearly stacked low noise turbofan stator

    NASA Technical Reports Server (NTRS)

    Schuster, William B. (Inventor); Kontos, Karen B. (Inventor); Weir, Donald S. (Inventor); Nolcheff, Nick A. (Inventor); Gunaraj, John A. (Inventor)

    2009-01-01

    A nonlinearly stacked low noise turbofan stator vane having a characteristic curve that is characterized by a nonlinear sweep and a nonlinear lean is provided. The stator is in an axial fan or compressor turbomachinery stage that is comprised of a collection of vanes whose highly three-dimensional shape is selected to reduce rotor-stator and rotor-strut interaction noise while maintaining the aerodynamic and mechanical performance of the vane. The nonlinearly stacked low noise turbofan stator vane reduces noise associated with the fan stage of turbomachinery to improve environmental compatibility.

  14. Carrier recombination effects in strain compensated quantum dot stacks embedded in solar cells

    NASA Astrophysics Data System (ADS)

    Alonso-Álvarez, D.; Taboada, A. G.; Ripalda, J. M.; Alén, B.; González, Y.; González, L.; García, J. M.; Briones, F.; Martí, A.; Luque, A.; Sánchez, A. M.; Molina, S. I.

    2008-09-01

    In this work we report the stacking of 50 InAs/GaAs quantum dot layers with a GaAs spacer thickness of 18 nm using GaP monolayers for strain compensation. We find a good structural and optical quality of the fabricated samples including a planar growth front across the whole structure, a reduction in the quantum dot size inhomogeneity, and an enhanced thermal stability of the emission. The optimized quantum dot stack has been embedded in a solar cell structure and we discuss the benefits and disadvantages of this approach for high efficiency photovoltaic applications.

  15. Bilayer SnS2: Tunable stacking sequence by charging and loading pressure

    NASA Astrophysics Data System (ADS)

    Bacaksiz, C.; Cahangirov, S.; Rubio, A.; Senger, R. T.; Peeters, F. M.; Sahin, H.

    2016-03-01

    Employing density functional theory-based methods, we investigate monolayer and bilayer structures of hexagonal SnS2, which is a recently synthesized monolayer metal dichalcogenide. Comparison of the 1 H and 1 T phases of monolayer SnS2 confirms the ground state to be the 1 T phase. In its bilayer structure we examine different stacking configurations of the two layers. It is found that the interlayer coupling in bilayer SnS2 is weaker than that of typical transition-metal dichalcogenides so that alternative stacking orders have similar structural parameters and they are separated with low energy barriers. A possible signature of the stacking order in the SnS2 bilayer has been sought in the calculated absorbance and reflectivity spectra. We also study the effects of the external electric field, charging, and loading pressure on the characteristic properties of bilayer SnS2. It is found that (i) the electric field increases the coupling between the layers at its preferred stacking order, so the barrier height increases, (ii) the bang gap value can be tuned by the external E field and under sufficient E field, the bilayer SnS2 can become a semimetal, (iii) the most favorable stacking order can be switched by charging, and (iv) a loading pressure exceeding 3 GPa changes the stacking order. The E-field tunable band gap and easily tunable stacking sequence of SnS2 layers make this 2D crystal structure a good candidate for field effect transistor and nanoscale lubricant applications.

  16. Electronic properties of bilayer graphenes strongly coupled to interlayer stacking and an external electric field

    NASA Astrophysics Data System (ADS)

    Park, Changwon; Ryu, Junga; Hong, Suklyun; Sumpter, Bobby; Kim, Gunn; Yoon, Mina

    2015-03-01

    In the design of bilayer graphene (BLG)-based switching devices, it is critical to understand the complex stacking structures observed experimentally and their impact on the overall electronic properties. Using a maximally localized Wannier function, a highly accurate tight-binding Hamiltonian based on density functional theory was constructed and the stacking-dependent evolution of BLGs electronic band structures and their response to an external electric field were systematically investigated. Although the crossing band structures remain at any stacking configurations (i.e., no energy gap opens), the wavefunction characteristics around the Fermi level can differ qualitatively for different stackings. This difference is conveyed to energy gap opening properties in the presence of an external electric field. We, for the first time, established a phase diagram summarizing the stacking-dependent electronic structures of BLG, separating metallic and semiconducting characteristics for a given external field. The research was conducted at the Center for Nanophase Materials Sciences, which is a DOE Office of Science User Facility.

  17. Synthesis of very narrow multilayer graphene nanoribbon with turbostratic stacking

    NASA Astrophysics Data System (ADS)

    Negishi, R.; Yamamoto, K.; Kitakawa, H.; Fukumori, M.; Tanaka, H.; Ogawa, T.; Kobayashi, Y.

    2017-05-01

    A multilayer graphene nanoribbon (GNR) less than 20 nm wide was synthesized by overlayer growth of graphene on a GNR template. First, very narrow template GNRs with widths of approximately 10 nm were prepared by unzipping from double-walled carbon nanotubes. Additional 4-5 layers of graphene were then formed on the pristine GNR template by chemical vapor deposition. Raman spectroscopy revealed that the synthesized multilayer GNR had turbostratic stacking without any structural correlation between the graphene layers. A large on/off ratio and a high on-current were observed in field effect transistors fabricated using the synthesized multilayer GNR channel.

  18. Revisiting Stacking Fault Energy of Steels

    NASA Astrophysics Data System (ADS)

    Das, Arpan

    2016-02-01

    The stacking fault energy plays an important role in the transition of deformation microstructure. This energy is strongly dependent on the concentration of alloying elements and the temperature under which the alloy is exposed. Extensive literature review has been carried out and investigated that there are inconsistencies in findings on the influence of alloying elements on stacking fault energy. This may be attributed to the differences in chemical compositions, inaccuracy in measurements, and the methodology applied for evaluating the stacking fault energy. In the present research, a Bayesian neural network model is created to correlate the complex relationship between the extent of stacking fault energy with its influencing parameters in different austenitic grade steels. The model has been applied to confirm that the predictions are reasonable in the context of metallurgical principles and other data published in the open literature. In addition, it has been possible to estimate the isolated influence of particular variables such as nickel concentration, which exactly cannot in practice be varied independently. This demonstrates the ability of the method to investigate a new phenomenon in cases where the information cannot be accessed experimentally.

  19. Average Transmission Probability of a Random Stack

    ERIC Educational Resources Information Center

    Lu, Yin; Miniatura, Christian; Englert, Berthold-Georg

    2010-01-01

    The transmission through a stack of identical slabs that are separated by gaps with random widths is usually treated by calculating the average of the logarithm of the transmission probability. We show how to calculate the average of the transmission probability itself with the aid of a recurrence relation and derive analytical upper and lower…

  20. Explosive demolition of K East Reactor Stack

    ScienceCinema

    None

    2016-07-12

    Using $420,000 in Recovery Act funds, the Department of Energy and contractor CH2M HILL Plateau Remediation Company topped off four months of preparations when they safely demolished the exhaust stack at the K East Reactor and equipment inside the reactor building on July 23, 2010.

  1. Arrays of stacked metal coordination compounds

    DOEpatents

    Bulkowski, J.E.

    1986-10-21

    A process is disclosed for preparing novel arrays of metal coordination compounds characterized by arrangement of the metal ions, separated by a linking agent, in stacked order one above the other. The process permits great flexibility in the design of the array. For example, layers of different composition can be added to the array at will. 3 figs.

  2. A Stack of Cards Rebuilt with Calculus

    ERIC Educational Resources Information Center

    Kazachkov, Alexander; Kireš, Marián

    2017-01-01

    Previous work covers building a tower from a stack of homogeneous rectangular plates, each with a maximum shift in displacement. We suggest using plates shaped as curvilinear triangles bounded by segments of power-law functions. The masses of the plates and the position of their center of mass are calculated and measured experimentally after…

  3. 49 CFR 178.606 - Stacking test.

    Code of Federal Regulations, 2011 CFR

    2011-10-01

    ... ADMINISTRATION, DEPARTMENT OF TRANSPORTATION (CONTINUED) SPECIFICATIONS FOR PACKAGINGS Testing of Non-bulk.... (c) Test method—(1) Design qualification testing. The test sample must be subjected to a force... might be stacked on it during transport; where the contents of the test sample are non-hazardous liquids...

  4. 49 CFR 178.606 - Stacking test.

    Code of Federal Regulations, 2012 CFR

    2012-10-01

    ... with specific gravities different from that of the liquid to be transported, the force must be calculated based on the specific gravity that will be marked on the packaging. The minimum height of the... number of containers that, when stacked, reach a height of 3 meters. s = specific gravity of lading. w...

  5. Explosive demolition of K East Reactor Stack

    SciTech Connect

    2010-07-26

    Using $420,000 in Recovery Act funds, the Department of Energy and contractor CH2M HILL Plateau Remediation Company topped off four months of preparations when they safely demolished the exhaust stack at the K East Reactor and equipment inside the reactor building on July 23, 2010.

  6. Removing Sulphur Dioxide From Stack Gases

    ERIC Educational Resources Information Center

    Slack, A. V.

    1973-01-01

    Process types, process concepts, claims and counterclaims, cost factors, and the level of developed technology for sulfur dioxide control in stack gases are focused upon and evaluated. Wet and dry processes as well as recovery and throwaway processes are compared. (BL)

  7. Stack Gas Scrubber Makes the Grade

    ERIC Educational Resources Information Center

    Chemical and Engineering News, 1975

    1975-01-01

    Describes a year long test of successful sulfur dioxide removal from stack gas with a calcium oxide slurry. Sludge disposal problems are discussed. Cost is estimated at 0.6 mill per kwh not including sludge removal. A flow diagram and equations are included. (GH)

  8. Scaling the CERN OpenStack cloud

    NASA Astrophysics Data System (ADS)

    Bell, T.; Bompastor, B.; Bukowiec, S.; Castro Leon, J.; Denis, M. K.; van Eldik, J.; Fermin Lobo, M.; Fernandez Alvarez, L.; Fernandez Rodriguez, D.; Marino, A.; Moreira, B.; Noel, B.; Oulevey, T.; Takase, W.; Wiebalck, A.; Zilli, S.

    2015-12-01

    CERN has been running a production OpenStack cloud since July 2013 to support physics computing and infrastructure services for the site. In the past year, CERN Cloud Infrastructure has seen a constant increase in nodes, virtual machines, users and projects. This paper will present what has been done in order to make the CERN cloud infrastructure scale out.

  9. Average Transmission Probability of a Random Stack

    ERIC Educational Resources Information Center

    Lu, Yin; Miniatura, Christian; Englert, Berthold-Georg

    2010-01-01

    The transmission through a stack of identical slabs that are separated by gaps with random widths is usually treated by calculating the average of the logarithm of the transmission probability. We show how to calculate the average of the transmission probability itself with the aid of a recurrence relation and derive analytical upper and lower…

  10. 49 CFR 178.606 - Stacking test.

    Code of Federal Regulations, 2014 CFR

    2014-10-01

    ... with specific gravities different from that of the liquid to be transported, the force must be calculated based on the specific gravity that will be marked on the packaging. The minimum height of the... number of containers that, when stacked, reach a height of 3 meters. s = specific gravity of lading....

  11. Arrays of stacked metal coordination compounds

    DOEpatents

    Bulkowski, John E.

    1986-01-01

    A process is disclosed for preparing novel arrays of metal coordination compounds characterized by arrangement of the metal ions, separated by a linking agent, in stacked order one above the other. The process permits great flexibility in the design of the array. For example, layers of different composition can be added to the array at will.

  12. Removing Sulphur Dioxide From Stack Gases

    ERIC Educational Resources Information Center

    Slack, A. V.

    1973-01-01

    Process types, process concepts, claims and counterclaims, cost factors, and the level of developed technology for sulfur dioxide control in stack gases are focused upon and evaluated. Wet and dry processes as well as recovery and throwaway processes are compared. (BL)

  13. Stack Gas Scrubber Makes the Grade

    ERIC Educational Resources Information Center

    Chemical and Engineering News, 1975

    1975-01-01

    Describes a year long test of successful sulfur dioxide removal from stack gas with a calcium oxide slurry. Sludge disposal problems are discussed. Cost is estimated at 0.6 mill per kwh not including sludge removal. A flow diagram and equations are included. (GH)

  14. Optical properties of thylakoid stacks

    NASA Astrophysics Data System (ADS)

    Shibayev, Pavel; Shibaev, Petr

    2012-02-01

    Optical properties of grana are simulated by means of 4x4 matrix approach (Berreman method). The results of calculations lead to a conclusion that even small degree of chirality, that may be present in a granum structure, results in the dramatic changes of its optical properties. Depending on the birefringence and degree of chirality in granum organization the reflection of left or right handed circularly polarized light can be greatly suppressed. This can explain the light induced difference in the growth of pea and lentil shoots irradiated by left and right handed circularly polarized light [1]. [4pt] [1] Pavel P. Shibayev, R.G. Pergolizzi, The effect of circularly polarized light on the growth of plants, International journal of botany, 7, 113 (2011)

  15. Inherent Driving Force for Charge Separation in Curved Stacks of Oligothiophenes

    DOE PAGES

    Wu, Qin

    2015-01-30

    Coexistence of high local charge mobility and an energy gradient can lead to efficient free charge carrier generation from geminate charge transfer states at the donor–acceptor interface in bulk heterojunction organic photovoltaics. It is, however, not clear what polymer microstructures can support such coexistence. Using recent methods from density functional theory, we propose that a stack of similarly curved oligothiophene chains can deliver the requirements for efficient charge separation. Curved stacks are stable because of the polymer’s strong π-stacking ability and because backbone torsions are flexible in neutral chains. However, energy of a charge in a polymer chain has remarkablymore » stronger dependence on torsions. The trend of increasing planarity in curved stacks effectively creates an energy gradient that drives charge in one direction. The curvature of these partially ordered stacks is found to beneficially interact with fullerenes for charge separation. The curved stacks, therefore, are identified as possible building blocks for interfacial structures that lead to efficient free carrier generation in high-performing organic photovoltaic systems.« less

  16. Inherent Driving Force for Charge Separation in Curved Stacks of Oligothiophenes

    SciTech Connect

    Wu, Qin

    2015-01-30

    Coexistence of high local charge mobility and an energy gradient can lead to efficient free charge carrier generation from geminate charge transfer states at the donor–acceptor interface in bulk heterojunction organic photovoltaics. It is, however, not clear what polymer microstructures can support such coexistence. Using recent methods from density functional theory, we propose that a stack of similarly curved oligothiophene chains can deliver the requirements for efficient charge separation. Curved stacks are stable because of the polymer’s strong π-stacking ability and because backbone torsions are flexible in neutral chains. However, energy of a charge in a polymer chain has remarkably stronger dependence on torsions. The trend of increasing planarity in curved stacks effectively creates an energy gradient that drives charge in one direction. The curvature of these partially ordered stacks is found to beneficially interact with fullerenes for charge separation. The curved stacks, therefore, are identified as possible building blocks for interfacial structures that lead to efficient free carrier generation in high-performing organic photovoltaic systems.

  17. Analyses of Large Coal-Based SOFCs for High Power Stack Block Development

    SciTech Connect

    Recknagle, Kurtis P; Koeppel, Brian J

    2010-10-01

    This report summarizes the numerical modeling and analytical efforts for SOFC stack development performed for the coal-based SOFC program. The stack modeling activities began in 2004, but this report focuses on the most relevant results obtained since August 2008. This includes the latter half of Phase-I and all of Phase-II activities under technical guidance of VPS and FCE. The models developed to predict the thermal-flow-electrochemical behaviors and thermal-mechanical responses of generic planar stacks and towers are described. The effects of cell geometry, fuel gas composition, on-cell reforming, operating conditions, cell performance, seal leak, voltage degradation, boundary conditions, and stack height are studied. The modeling activities to evaluate and achieve technical targets for large stack blocks are described, and results from the latest thermal-fluid-electrochemical and structural models are summarized. Modeling results for stack modifications such as scale-up and component thickness reduction to realize cost reduction are presented. Supporting modeling activities in the areas of cell fabrication and loss of contact are also described.

  18. Sequence-dependent elasticity and electrostatics of single-stranded DNA: signatures of base-stacking.

    PubMed

    McIntosh, Dustin B; Duggan, Gina; Gouil, Quentin; Saleh, Omar A

    2014-02-04

    Base-stacking is a key factor in the energetics that determines nucleic acid structure. We measure the tensile response of single-stranded DNA as a function of sequence and monovalent salt concentration to examine the effects of base-stacking on the mechanical and thermodynamic properties of single-stranded DNA. By comparing the elastic response of highly stacked poly(dA) and that of a polypyrimidine sequence with minimal stacking, we find that base-stacking in poly(dA) significantly enhances the polymer's rigidity. The unstacking transition of poly(dA) at high force reveals that the intrinsic electrostatic tension on the molecule varies significantly more weakly on salt concentration than mean-field predictions. Further, we provide a model-independent estimate of the free energy difference between stacked poly(dA) and unstacked polypyrimidine, finding it to be ∼-0.25 kBT/base and nearly constant over three orders of magnitude in salt concentration. Copyright © 2014 Biophysical Society. Published by Elsevier Inc. All rights reserved.

  19. Measurement of heat conduction through stacked screens.

    PubMed

    Lewis, M A; Kuriyama, T; Kuriyama, F; Radebaugh, R

    1998-01-01

    This paper describes the experimental apparatus for the measurement of heat conduction through stacked screens as well as some experimental results taken with the apparatus. Screens are stacked in a fiberglass-epoxy cylinder, which is 24.4 mm in diameter and 55 mm in length. The cold end of the stacked screens is cooled by a Gifford-McMahon (GM) cryocooler at cryogenic temperature, and the hot end is maintained at room temperature. Heat conduction through the screens is determined from the temperature gradient in a calibrated heat flow sensor mounted between the cold end of the stacked screens and the GM cryocooler. The samples used for these experiments consisted of 400-mesh stainless steel screens, 400-mesh phosphor bronze screens, and two different porosities of 325-mesh stainless steel screens. The wire diameter of the 400-mesh stainless steel and phosphor bronze screens was 25.4 micrometers and the 325-mesh stainless steel screen wire diameters were 22.9 micrometers and 27.9 micrometers. Standard porosity values were used for the experimental data with additional porosity values used on selected experiments. The experimental results showed that the helium gas between each screen enhanced the heat conduction through the stacked screens by several orders of magnitude compared to that in vacuum. The conduction degradation factor is the ratio of actual heat conduction to the heat conduction where the regenerator material is assumed to be a solid rod of the same cross sectional area as the metal fraction of the screen. This factor was about 0.1 for the stainless steel and 0.022 for the phosphor bronze, and almost constant for the temperature range of 40 to 80 K at the cold end.

  20. Measurement of heat conduction through stacked screens

    NASA Technical Reports Server (NTRS)

    Lewis, M. A.; Kuriyama, T.; Kuriyama, F.; Radebaugh, R.

    1998-01-01

    This paper describes the experimental apparatus for the measurement of heat conduction through stacked screens as well as some experimental results taken with the apparatus. Screens are stacked in a fiberglass-epoxy cylinder, which is 24.4 mm in diameter and 55 mm in length. The cold end of the stacked screens is cooled by a Gifford-McMahon (GM) cryocooler at cryogenic temperature, and the hot end is maintained at room temperature. Heat conduction through the screens is determined from the temperature gradient in a calibrated heat flow sensor mounted between the cold end of the stacked screens and the GM cryocooler. The samples used for these experiments consisted of 400-mesh stainless steel screens, 400-mesh phosphor bronze screens, and two different porosities of 325-mesh stainless steel screens. The wire diameter of the 400-mesh stainless steel and phosphor bronze screens was 25.4 micrometers and the 325-mesh stainless steel screen wire diameters were 22.9 micrometers and 27.9 micrometers. Standard porosity values were used for the experimental data with additional porosity values used on selected experiments. The experimental results showed that the helium gas between each screen enhanced the heat conduction through the stacked screens by several orders of magnitude compared to that in vacuum. The conduction degradation factor is the ratio of actual heat conduction to the heat conduction where the regenerator material is assumed to be a solid rod of the same cross sectional area as the metal fraction of the screen. This factor was about 0.1 for the stainless steel and 0.022 for the phosphor bronze, and almost constant for the temperature range of 40 to 80 K at the cold end.