#### Sample records for hybrid non-local density

1. A hybrid local/non-local framework for the simulation of damage and fracture

KAUST Repository

Azdoud, Yan

2014-01-01

Recent advances in non-local continuum models, notably peridynamics, have spurred a paradigm shift in solid mechanics simulation by allowing accurate mathematical representation of singularities and discontinuities. This doctoral work attempts to extend the use of this theory to a community more familiar with local continuum models. In this communication, a coupling strategy - the morphing method -, which bridges local and non-local models, is presented. This thesis employs the morphing method to ease use of the non-local model to represent problems with failure-induced discontinuities. First, we give a quick review of strategies for the simulation of discrete degradation, and suggest a hybrid local/non-local alternative. Second, we present the technical concepts involved in the morphing method and evaluate the quality of the coupling. Third, we develop a numerical tool for the simulation of the hybrid model for fracture and damage and demonstrate its capabilities on numerical model examples

2. Definition of current density in the presence of a non-local potential.

Science.gov (United States)

Li, Changsheng; Wan, Langhui; Wei, Yadong; Wang, Jian

2008-04-16

In the presence of a non-local potential arising from electron-electron interaction, the conventional definition of current density J(c) = (e/2m)([(p-eA)ψ](*)ψ-ψ(*)[(p-eA)ψ]) cannot satisfy the condition of current conservation, i.e., [Formula: see text] in the steady state. In order to solve this problem, we give a new definition of current density including the contribution due to the non-local potential. We show that the current calculated based on the new definition of current density conserves the current and is the same as that obtained from the Landauer-Büttiker formula. Examples are given to demonstrate our results.

3. Definition of current density in the presence of a non-local potential

International Nuclear Information System (INIS)

Li Changsheng; Wan Langhui; Wei Yadong; Wang Jian

2008-01-01

In the presence of a non-local potential arising from electron-electron interaction, the conventional definition of current density J c = (e/2m)([(p-eA)ψ]*ψ-ψ*[(p-eA)ψ]) cannot satisfy the condition of current conservation, i.e., ∇ . J c ≠ 0 in the steady state. In order to solve this problem, we give a new definition of current density including the contribution due to the non-local potential. We show that the current calculated based on the new definition of current density conserves the current and is the same as that obtained from the Landauer-Buettiker formula. Examples are given to demonstrate our results

4. Non-local energy density functionals: models plus some exact general results

International Nuclear Information System (INIS)

March, N.H.

2001-02-01

Holas and March (Phys. Rev. A51, 2040, 1995) gave a formally exact expression for the force - δV xc (r-tilde)/δr-tilde associated with the exchange-correlation potential V xc (r-tilde) of density functional theory. This forged a precise link between first- and second-order density matrices and V xc (r-tilde). Here models are presented in which these low-order matrices can be related to the ground-state electron density. This allows non-local energy density functionals to be constructed within the framework of such models. Finally, results emerging from these models have led to the derivation of some exact 'nuclear cusp' relations for exchange and correlation energy densities in molecules, clusters and condensed phases. (author)

5. A multiconfigurational hybrid density-functional theory

DEFF Research Database (Denmark)

Sharkas, Kamal; Savin, Andreas; Jensen, Hans Jørgen Aagaard

2012-01-01

We propose a multiconfigurational hybrid density-functional theory which rigorously combines a multiconfiguration self-consistent-field calculation with a density-functional approximation based on a linear decomposition of the electron-electron interaction. This gives a straightforward extension ...

6. Stability of Non-Neutral Plasma Cylinder Consisting of Magnetized Cold Electrons and of Small Density Fraction of Ions Born at Rest: Non-Local Analysis

International Nuclear Information System (INIS)

Yeliseyev, Y. N.

2009-01-01

The non-local stability problem of the plasma cylinder, filled with 'cold' magnetized rigidly rotating electrons, and a small density fraction of ions, is solved. The ions are supposed to be born at rest by ionization of background gas. The study is based on the kinetic description of ions. The equilibrium distribution function, taking into account the peculiarity of ions birth, is used. The radial electric field is caused by space charge of non-neutral plasma. The dispersion equation for plasma eigen frequencies is obtained analytically. It is valid within the total admissible range of values of electric and magnetic fields. Normalized eigen frequencies ω'/Ω i are calculated for the basic azimuth mode m = 1(ω' ω-mω i + , ω + = (-ω ci +Ω i )/2, Ω i (ω ci 2 -4eE r /m i r) 1/2 is called the 'modified' ion cyclotron (MIC) frequency), for the density fraction of ions of atomic nitrogen f N i /n e = 0,01 and are presented in graphic form versus parameter 2ω pe 2 /ω ce 2 . The spectra of oscillations ω'/Ω i consist of the family of electron Trivel-piece--Gould (TG) modes and of the families of MIC modes. The frequencies of MIC modes are located in a small vicinity of harmonics of the MIC frequency Ω i above and below the harmonic. The TG modes in non-neutral plasma fall in the region of MIC frequencies Ω i and interact strongly with MIC modes. The slow TG modes become unstable near the crossings with non-negative harmonics of MIC frequencies. The instabilities have a resonant character. The lowest radial TG mode has a maximum growth rate at crossing with a zero harmonic of Ω i ((Im ω'/Ω i ) max ≅0,074). The growth rates of MIC modes are much lower ((Im ω'/Ω i ) max pe 2 /ω ce 2 , corresponding to strong radial electric fields (ω ci 2 r /m i r|), in which the ions are unmagnetized. The oscillations of small amplitude are seen on some frequency dependencies of MIC modes. They are similar to oscillations on dispersion curves of electron waves in

7. Macroscopic quantum waves in non local theories

International Nuclear Information System (INIS)

Ventura, I.

1979-01-01

By means of an expansion in the density, it is shown that Macroscopic Quantum Waves also apear in non local theories. This result reinforces the conjecture that these waves should exist in liquid 4 He. (Author) [pt

8. Macroscopic quantum waves in non local theories

International Nuclear Information System (INIS)

Ventura, I.

1979-01-01

By means of an expansion in the density, it is shown that Macroscopic Quantum Waves also appear in non local theories. This result reinforces the conjecture that these waves should exist in liquid 4 He [pt

9. High-density hybrid interconnect methodologies

International Nuclear Information System (INIS)

John, J.; Zimmermann, L.; Moor, P.De; Hoof, C.Van

2003-01-01

Full text: The presentation gives an overview of the state-of-the-art of hybrid integration and in particular the IMEC technological approaches that will be able to address future hybrid detector needs. The dense hybrid flip-chip integration of an array of detectors and its dedicated readout electronics can be achieved with a variety of solderbump techniques such as pure Indium or Indium alloys, Ph-In, Ni/PbSn, but also conducting polymers... Particularly for cooled applications or ultra-high density applications, Indium solderbump technology (electroplated or evaporated) is the method of choice. The state-of-the-art of solderbump technologies that are to a high degree independent of the underlying detector material will be presented and examples of interconnect densities between 5x1E4cm-2 and 1x1E6 cm-2 will be demonstrated. For several classes of detectors, flip-chip integration is not allowed since the detectors have to be illuminated from the top. This applies to image sensors for EUV applications such as GaN/AlGaN based detectors and to MEMS-based sensors. In such cases, the only viable interconnection method has to be through the (thinned) detector wafer followed by a solderbump-based integration. The approaches for dense and ultra-dense through-the-wafer interconnect 'vias' will be presented and wafer thinning approaches will be shown

10. Non-local effects in kaonic atoms

International Nuclear Information System (INIS)

Lutz, M.; Florkowski, W.

2000-04-01

Optical potentials with non-local (gradient) terms are used to describe the spectra of kaonic atoms. The strength of the non-local terms is determined from a many-body calculation of the kaon self-energy in nuclear matter. The optical potentials show strong non-linearities in the nucleon density and sizeable non-local terms. We find that the non-local terms are quantitatively important and the results depend strongly on the way the gradient terms are arranged. Phenomenologically successful fits are obtained for p-wave like optical potentials. It is suggested that the microscopic form of the non-local interaction terms is obtained systematically by means of a semi-classical expansion of the nucleus structure. We conclude that a microscopic description of kaonic atom data requires further detailed studies of the microscopic K - nuclear dynamics. (orig.)

11. Stability of Non-Neutral Plasma Cylinder Consisting of Magnetized Cold Electrons and of Small Density Fraction of Ions Born at Rest: Non-Local Analysis

Science.gov (United States)

Yeliseyev, Y. N.

2009-03-01

The non-local stability problem of the plasma cylinder, filled with "cold" magnetized rigidly rotating electrons, and a small density fraction of ions, is solved. The ions are supposed to be born at rest by ionization of background gas. The study is based on the kinetic description of ions. The equilibrium distribution function, taking into account the peculiarity of ions birth, is used. The radial electric field is caused by space charge of non-neutral plasma. The dispersion equation for plasma eigen frequencies is obtained analytically. It is valid within the total admissible range of values of electric and magnetic fields. Normalized eigen frequencies ω'/Ωi are calculated for the basic azimuth mode m = 1 (ω' = ω-mωi+, ω+ = (-ωci+Ωi)/2, Ωi = (ωci2-4eEr/mir)1/2 is called the "modified" ion cyclotron (MIC) frequency), for the density fraction of ions of atomic nitrogen f = Ni/ne = 0,01 and are presented in graphic form versus parameter 2ωpe2/ωce2. The spectra of oscillations ω'/Ωi consist of the family of electron Trivel-piece—Gould (TG) modes and of the families of MIC modes. The frequencies of MIC modes are located in a small vicinity of harmonics of the MIC frequency Ωi above and below the harmonic. The TG modes in non-neutral plasma fall in the region of MIC frequencies Ωi and interact strongly with MIC modes. The slow TG modes become unstable near the crossings with non-negative harmonics of MIC frequencies. The instabilities have a resonant character. The lowest radial TG mode has a maximum growth rate at crossing with a zero harmonic of Ωi ((Im ω'/Ωi)max≈0,074). The growth rates of MIC modes are much lower ((Im ω'/Ωi)max≲0,002). Their instability has a threshold character. The instabilities of TG and MIC modes take place mainly at the values of parameter 2ωpe2/ωce2, corresponding to strong radial electric fields (ωci2≪|eEr/mir|), in which the ions are unmagnetized. The oscillations of small amplitude are seen on some frequency

12. Effect of Stocking Density on Growth Performance of Hybrids of ...

African Journals Online (AJOL)

Fingerlings of Oreochromis niloticus♀ and Oreochromis urolepis urolepis♂ hybrids were reared at stocking densities of control, 5, 10, 15 and 20 fish/m3 at 15 Practical Salinity Units (PSU) in 1m3 plastic tanks for 63 days. They were kept at low, intermediate and high densities respectively. All hybrids were fed on a ...

13. Hybrid Fluid/Kinetic Modeling Of Magnetized High Energy Density Plasmas

Science.gov (United States)

Hansen, David; Held, Eric; King, Jacob; Stoltz, Peter; Masti, Robert; Srinivasan, Bhuvana

2017-10-01

MHD modeling with an equation of state (EOS) of the Rayleigh-Taylor (RT) instabily in Z indicates that it is seeded by the electro-thermal instability. Large thermodynamic drives associated with gradients at the interface between the liner and the coronal regions distort distribution functions and likely lead to non-local transport effects in a plasma which varies from weakly to strongly coupled. In this work, we discuss using effective potential theory along with a Chapman-Ensksog-like (CEL) formalism to develop hybrid fluid/kinetic modeling capabilities for these plasmas. Effective potential theory addresses the role of Coulomb collisions on transport across coupling regimes and the CEL approach bridges the gap between full-blow kinetic simulations and the EOS tables, which only depend locally on density and temperature. Quantitative results on the Spitzer problem across coupling coupling regimes will be presented as a first step. DOE Grant No. DE-SC0016525.

14. On lower hybrid wave scattering by plasma density fluctuations

International Nuclear Information System (INIS)

Petrzilka, V.

1988-01-01

The scattering of lower hybrid waves on plasma density fluctuations in a thin turbulent layer at the plasma periphery is studied numerically. The lower hybrid waves are supposed to be radiated by a four-waveguide grill used on the CASTOR tokamak. A great number of calculated scattered wave spectra show that the scattered spectrum shifts to larger values of the parallel-to-magnetic-field component of the wave vector (to slower waves) with increasing central plasma density and with the decreasing safety factor at the boundary. As known, this shift of the wave spectra results in a decrease in current drive efficiency. The current drive efficiency will hence decrease with growing plasma density and with decreasing safety factor. (J.U.). 2 figs., 4 refs

15. Scattering of lower-hybrid waves by density fluctuations

International Nuclear Information System (INIS)

Andrews, P.L.; Perkins, F.W.

1981-07-01

The investigation of the scattering of lower-hybrid waves by density fluctuations in tokamaks is distinguished by the presence in the wave equation of a large, random, derivative-coupling term. Assuming the fluctuations to be of long wavelength compared to the incident wave the similarity of the wave equation to the Schroedinger equation for a particle in a random magnetic field is used to derive a two-way diffusion equation for the wave energy density. The diffusion constant found disagrees with earlier findings and the source of the discrepancy is pointed out. When the correct boundary conditions are imposed this equation can be solved by separation of variables. However most of the important features of the solution are apparent without detailed algebra

16. Conversion of localized lower hybrid oscillations and fast magnetosonic waves at a plasma density cavity

International Nuclear Information System (INIS)

Hall, J.O.

2004-01-01

Analytic expressions are presented for conversion of localized lower hybrid oscillations and magnetosonic waves by scattering off a small scale density cavity. The governing equations are solved in slab geometry with wave vectors perpendicular to both the ambient magnetic field and the density gradient associated with density cavity using a scale length separation method. The theory predicts strong excitation of localized lower hybrid oscillations for a set of frequencies between the lower hybrid frequency of the ambient plasma and the minimum lower hybrid frequency inside the cavity. The theory is relevant for the lower hybrid solitary structures observed in space plasmas

17. Non-Local Effects in Kaonic Atoms

International Nuclear Information System (INIS)

Lutz, M.; Florkowski, W.

2000-01-01

Optical potentials with non-local (gradient) terms are used to describe the spectra of kaonic atoms. The strength of the non-local terms is determined from a many-body calculation of the kaon self energy in nuclear matter. We find that the non-local terms are quantitatively important and the results depend strongly on the way the gradient terms are arranged. Phenomenologically successful description is obtained for p-wave like optical potentials. It is suggested that the microscopic form of the non-local interaction terms is obtained systematically by means of a semi-classical expansion of the nucleus structure. (author)

18. Hybrid graphene electrodes for supercapacitors of high energy density

Science.gov (United States)

Zhang, Feifei; Tang, Jie; Shinya, Norio; Qin, Lu-Chang

2013-10-01

We describe a process of co-reduction to reduce dispersed graphene oxide (GO) and single-walled carbon nanotubes (SWNTs) simultaneously for preparation of hybrid electrodes for graphene supercapacitors. The SWNTs are in between the inter-layer space of graphene sheets as a spacer to prevent effectively restacking of graphene that often limits seriously the electrochemical performance of graphene supercapacitors. The SWNTs also act as conductive binders to improve the electrical conduction of the electrode. A high specific capacitance of 261 F g-1 for a single electrode and specific energy density of 123 W h kg-1 measured in the two-electrode configuration have been obtained in ionic liquid (EMI-TFSI). For interpretation of color in Fig. 6, the reader is referred to the web version of this article.

19. Density gradient effect on waveguide launching of lower hybrid waves

International Nuclear Information System (INIS)

Fichet, M.; Fidone, I.

1981-01-01

An extensive numerical investigation of the waveguide-plasma coupling, in the lower hybrid range of frequencies, is presented. The role of a sharp density gradient at the plasma edge is investigated. It is found that, in the case of a very sharp gradient, the accessibility condition |nsub(parallel)|>nsub(c)=(1-ω 2 /ωsub(i)ωsub(e))sup(-1/2) is violated and an appreciable fraction of the total energy is launched in the range |nsub(parallel)|< nsub(c). The case of one, two and four waveguides is considered, and it is found that the general pattern of the energy spectrum is very similar for the three antennas. (author)

20. To the non-local theory of cold nuclear fusion.

Science.gov (United States)

Alexeev, Boris V

2014-10-01

In this paper, we revisit the cold fusion (CF) phenomenon using the generalized Bolzmann kinetics theory which can represent the non-local physics of this CF phenomenon. This approach can identify the conditions when the CF can take place as the soliton creation under the influence of the intensive sound waves. The vast mathematical modelling leads to affirmation that all parts of soliton move with the same velocity and with the small internal change of the pressure. The zone of the high density is shaped on the soliton's front. It means that the regime of the 'acoustic CF' could be realized from the position of the non-local hydrodynamics.

1. On a non-local gas dynamics like integrable hierarchy

International Nuclear Information System (INIS)

Brunelli, Jose Carlos; Das, Ashok

2004-01-01

We study a new hierarchy of equations derived from the system of isentropic gas dynamics equations where the pressure is a non-local function of the density. We show that the hierarchy of equations is integrable. We construct the two compatible Hamiltonian structures and show that the first structure has three distinct Casimirs while the second has one. The existence of Casimirs allows us to extend the flows to local ones. We construct an infinite series of commuting local Hamiltonians as well as three infinite series (related to the three Casimirs) of non-local charges. We discuss the zero curvature formulation of the system where we obtain a simple expression for the non-local conserved charges, which also clarifies the existence of the three series from a Lie algebraic point of view. We point out that the non-local hierarchy of Hunter-Zheng equations can be obtained from our non-local flows when the dynamical variables are properly constrained. (author)

2. Can EPR non-locality be geometrical?

International Nuclear Information System (INIS)

Ne'eman, Y.

1995-01-01

The presence in Quantum Mechanics of non-local correlations is one of the two fundamentally non-intuitive features of that theory. The non-local correlations themselves fall into two classes: EPR and Geometrical. The non-local characteristics of the geometrical type are well-understood and are not suspected of possibly generating acausal features, such as faster-than-light propagation of information. This has especially become true since the emergence of a geometrical treatment for the relevant gauge theories, i.e. Fiber Bundle geometry, in which the quantum non-localities are seen to correspond to pure homotopy considerations. This aspect is reviewed in section 2. Contrary-wise, from its very conception, the EPR situation was felt to be paradoxical. It has been suggested that the non-local features of EPR might also derive from geometrical considerations, like all other non-local characteristics of QM. In[7], one of the authors was able to point out several plausibility arguments for this thesis, emphasizing in particular similarities between the non-local correlations provided by any gauge field theory and those required by the preservation of the quantum numbers of the original EPR state-vector, throughout its spatially-extended mode. The derivation was, however, somewhat incomplete, especially because of the apparent difference between, on the one hand, the closed spatial loops arising in the analysis of the geometrical non-localities, from Aharonov-Bohm and Berry phases to magnetic monopoles and instantons, and on the other hand, in the EPR case, the open line drawn by the positions of the two moving decay products of the disintegrating particle. In what follows, the authors endeavor to remove this obstacle and show that as in all other QM non-localities, EPR is somehow related to closed loops, almost involving homotopy considerations. They develop this view in section 3

3. Employee Travel Data (Non-Local)

Data.gov (United States)

Montgomery County of Maryland — ‘This dataset provides information regarding the total approved actual expenses incurred by Montgomery County government employees traveling non-locally (over 75...

4. Gauging Non-local Quark Models

International Nuclear Information System (INIS)

Broniowski, W.

1999-09-01

The gauge effective quark model with non-local interactions is considered. It is shown how this approach regularize the theory in such a way that the anomalies are preserved and charges are properly quantized. With non-local interactions the effective action is finite to all orders in the loop expansion and there is no need to introduce the quark momentum cut-off parameter

5. Robust non-local median filter

Science.gov (United States)

Matsuoka, Jyohei; Koga, Takanori; Suetake, Noriaki; Uchino, Eiji

2017-04-01

This paper describes a novel image filter with superior performance on detail-preserving removal of random-valued impulse noise superimposed on natural gray-scale images. The non-local means filter is in the limelight as a way of Gaussian noise removal with superior performance on detail preservation. By referring the fundamental concept of the non-local means, we had proposed a non-local median filter as a specialized way for random-valued impulse noise removal so far. In the non-local processing, the output of a filter is calculated from pixels in blocks which are similar to the block centered at a pixel of interest. As a result, aggressive noise removal is conducted without destroying the detailed structures in an original image. However, the performance of non-local processing decreases enormously in the case of high noise occurrence probability. A cause of this problem is that the superimposed noise disturbs accurate calculation of the similarity between the blocks. To cope with this problem, we propose an improved non-local median filter which is robust to the high level of corruption by introducing a new similarity measure considering possibility of being the original signal. The effectiveness and validity of the proposed method are verified in a series of experiments using natural gray-scale images.

6. A morphing strategy to couple non-local to local continuum mechanics

KAUST Repository

Lubineau, Gilles; Azdoud, Yan; Han, Fei; Rey, Christian C.; Askari, Abe H.

2012-01-01

A method for coupling non-local continuum models with long-range central forces to local continuum models is proposed. First, a single unified model that encompasses both local and non-local continuum representations is introduced. This model can be purely non-local, purely local or a hybrid depending on the constitutive parameters. Then, the coupling between the non-local and local descriptions is performed through a transition (morphing) affecting only the constitutive parameters. An important feature is the definition of the morphing functions, which relies on energy equivalence. This approach is useful in large-scale modeling of materials that exhibit strong non-local effects. The computational cost can be reduced while maintaining a reasonable level of accuracy. Efficiency, robustness and basic properties of the approach are discussed using one- and two-dimensional examples. © 2012 Elsevier Ltd.

7. A morphing strategy to couple non-local to local continuum mechanics

KAUST Repository

Lubineau, Gilles

2012-06-01

A method for coupling non-local continuum models with long-range central forces to local continuum models is proposed. First, a single unified model that encompasses both local and non-local continuum representations is introduced. This model can be purely non-local, purely local or a hybrid depending on the constitutive parameters. Then, the coupling between the non-local and local descriptions is performed through a transition (morphing) affecting only the constitutive parameters. An important feature is the definition of the morphing functions, which relies on energy equivalence. This approach is useful in large-scale modeling of materials that exhibit strong non-local effects. The computational cost can be reduced while maintaining a reasonable level of accuracy. Efficiency, robustness and basic properties of the approach are discussed using one- and two-dimensional examples. © 2012 Elsevier Ltd.

8. Analysis of Non Local Image Denoising Methods

Science.gov (United States)

Pardo, Álvaro

Image denoising is probably one of the most studied problems in the image processing community. Recently a new paradigm on non local denoising was introduced. The Non Local Means method proposed by Buades, Morel and Coll attracted the attention of other researches who proposed improvements and modifications to their proposal. In this work we analyze those methods trying to understand their properties while connecting them to segmentation based on spectral graph properties. We also propose some improvements to automatically estimate the parameters used on these methods.

9. Improving the energy density of hydraulic hybrid vehicles (HHVS) and evaluating plug-in HHVS.

Science.gov (United States)

2010-10-01

This report describes analyses performed by researchers at The University of Toledo (UT) in : collaboration with researchers at the University of Detroit Mercy (UDM) on the project : Improving the Energy Density of Hydraulic Hybrid Vehicles (HHVs)...

10. G-centers in irradiated silicon revisited: A screened hybrid density functional theory approach

KAUST Repository

Wang, H.; Chroneos, A.; Londos, C. A.; Sgourou, E. N.; Schwingenschlö gl, Udo

2014-01-01

Electronic structure calculations employing screened hybrid density functional theory are used to gain fundamental insight into the interaction of carbon interstitial (Ci) and substitutional (Cs) atoms forming the CiCs defect known as G

11. High energy density additives for Hybrid Fuel Rockets to Improve Performance and Enhance Safety

Data.gov (United States)

National Aeronautics and Space Administration — We propose a conceptual study of prototype strained hydrocarbon molecules as high energy density additives for hybrid rocket fuels to boost the performance of these...

12. High regression rate, high density hybrid fuels, Phase I

Data.gov (United States)

National Aeronautics and Space Administration — This SBIR program will investigate high energy density novel nanofuels combined with high density binders for use with an N2O oxidizer. Terves has developed...

13. Switching non-local vector median filter

Science.gov (United States)

Matsuoka, Jyohei; Koga, Takanori; Suetake, Noriaki; Uchino, Eiji

2016-04-01

This paper describes a novel image filtering method that removes random-valued impulse noise superimposed on a natural color image. In impulse noise removal, it is essential to employ a switching-type filtering method, as used in the well-known switching median filter, to preserve the detail of an original image with good quality. In color image filtering, it is generally preferable to deal with the red (R), green (G), and blue (B) components of each pixel of a color image as elements of a vectorized signal, as in the well-known vector median filter, rather than as component-wise signals to prevent a color shift after filtering. By taking these fundamentals into consideration, we propose a switching-type vector median filter with non-local processing that mainly consists of a noise detector and a noise removal filter. Concretely, we propose a noise detector that proactively detects noise-corrupted pixels by focusing attention on the isolation tendencies of pixels of interest not in an input image but in difference images between RGB components. Furthermore, as the noise removal filter, we propose an extended version of the non-local median filter, we proposed previously for grayscale image processing, named the non-local vector median filter, which is designed for color image processing. The proposed method realizes a superior balance between the preservation of detail and impulse noise removal by proactive noise detection and non-local switching vector median filtering, respectively. The effectiveness and validity of the proposed method are verified in a series of experiments using natural color images.

14. Mechanochemically conjugated PMHS/nano-SiO 2 hybrid and subsequent optimum grafting density study

Science.gov (United States)

Lin, Jinbin; Chen, Hongling; Yuan, Yongbing; Ji, Yan

2011-08-01

In this paper, we reported the preparation of poly(methylhydrosiloxane) (PMHS)/SiO 2 hybrid particles by mechanochemical method based on high energy ball milling (HEBM). The obtained hybrid particles were characterized by Fourier transform infrared (FT-IR) spectroscopy, 29Si CP (cross-polarization) MAS NMR, viscosity measurement, particle size distribution, thermal analysis (TGA, DSC and DTG), static contact angle (CA), field emission scanning electron microscopy (FE-SEM) and transmission electron microscopy (TEM). FT-IR and 29Si CP MAS NMR spectra indicate that PMHS is chemically anchored onto the surface of nano-SiO 2. Viscosity measurement, particle size distribution, FE-SEM and TEM demonstrate that an appropriate grafting density optimizes the dispersion of nanoparticles in poly(dimethylsiloxane) (PDMS) matrix, so lower viscosity can be achieved. Too high or too low grafting density may only achieve suboptimal and poor dispersions. The optimum grafting density of PMHS on nano-SiO 2 was determined by thermal analysis, with approximately 0.0531 PMHS/nm 2. Static contact angle measurement indicates that the water contact angle of hybrid particles is modulated by changing the grafting density of PMHS on nano-SiO 2. The CA value of PMHS/SiO 2 hybrid with optimum grafting density is 139.4°, and the highest CA value of PMHS/SiO 2 hybrid is approximately 158.2°.

15. Genetic Variation and Phenotypic Response of 15 Sweet Corn (Zea mays L. Hybrids to Population Density

Directory of Open Access Journals (Sweden)

William F. Tracy

2013-06-01

Full Text Available Planting sweet corn at higher densities may increase the canopy cover, reducing light transmission to the understory and suppressing weed growth. High planting densities can also negatively impact the crop, however, by decreasing ear size and overall yield. The objective of this study was to determine the potential for increased density tolerance of 15 sweet corn hybrids by estimating the general combining ability (GCA and specific combining ability (SCA for traits of interest. In 2010 and 2011, a half-diallel of six historic sweet corn inbreds was evaluated in a split-block randomized complete block design in four Wisconsin environments, with four replicates in each environment. Hybrids were planted at a low density of 29,936 plants ha−1, a medium density of 63,615 plants ha−1, and a high density of 97,293 plants ha−1. Significant differences between hybrids were found for phenomorphological traits and ear characteristics. Inbreds C68, C40 and Ia5125 produced the progeny most tolerant of the highest population density. Among these genotypes, tolerance to high density is a heritable trait, indicating the feasibility of breeding sweet corn for density tolerance and potential weed competitiveness.

16. Non-local modeling of materials

DEFF Research Database (Denmark)

Niordson, Christian Frithiof

2002-01-01

Numerical studies of non-local plasticity effects on different materials and problems are carried out. Two different theories are used. One is of lower order in that it retains the structure of a conventional plasticity boundary value problem, while the other is of higher order and employs higher...... order stresses as work conjugates to higher order strains and uses higher order boundary conditions. The influence of internal material length parameters is studied, and the effects of higher order boundary conditions are analyzed. The focus of the thesis is on metal-matrix composites, and non...

17. Observation of multi-channel non-local transport in J-TEXT plasmas

Science.gov (United States)

Shi, Yuejiang; Chen, Zhongyong; Yang, Zhoujun; Shi, Peng; Zhao, Kaijun; Diamond, Patrick H.; Kwon, JaeMin; Yan, Wei; Zhou, Hao; Pan, Xiaoming; Cheng, Zhifeng; Chen, Zhiping; Yang, SeongMoo; Zhang, Chi; Li, Da; Dong, Yunbo; Wang, Lu; Ding, YongHua; Liang, Yunfeng; Hahn, SangHee; Jhang, HoGun; Na, Yong-Su

2018-04-01

In cold pulse experiments in J-TEXT, not only are rapid electron temperature increases in the core observed, but also steep rises in the inner density are found. Moreover, some evidence of acceleration of the core toroidal rotation is also observed during the non-local transport process of electron temperature. These new findings of cold pulse experiments in J-TEXT suggest that turbulence spreading is a possible mechanism for the non-local transport dynamics.

18. Yields of ZP sweet maize hybrids in dependence on sowing densities

Directory of Open Access Journals (Sweden)

Srdić Jelena

2008-01-01

Full Text Available Sweet maize differs from maize of standard grain quality by many important traits that affect the ear appearance, and especially by traits controlling taste. The ear appearance trait encompasses the kernel row number, configuration, row pattern (direction and arrangement, seed set, kernel width and depth, ear shape and size. The quality of immature kernels is controlled by genes by which sweet maize differs from common maize. In order to obtain high-ranking and high-quality yields, it is necessary to provide the most suitable cropping practices for sweet maize hybrids developed at the Maize Research Institute, Zemun Polje. The adequate sowing density is one of more important elements of correct cropping practices. The objective of the present study was to determine the effect of four sowing densities in four ZP sweet maize hybrids of different FAO maturity groups on ear qualitative traits and yields obtained on chernozem type of soil in Zemun Polje. The observed traits of sweet maize (ear length, kernel row number, number of kernels per row, yield and shelling percentage significantly varied over years. The higher sowing density was the higher yield of sweet maize was, hence the highest ear yield of 9.67 t ha-1 , on the average for all four hybrids, was recorded at the highest sowing density of 70,000 plants ha-1. The highest yield was detected in the hybrid ZP 424su. The highest shelling percentage (67.81% was found in the hybrid ZP 521su at the sowing density of 60,000 plants ha-1. Generally, it can be stated that sweet maize hybrids of a shorter growing season (FAO 400 could be cultivated up to 70,000 plants ha-1, while those of a longer growing season (FAO 500 could be grown up to 60,000 plants ha-1. In such a way, the most favorable parameters of yields and the highest yields can be obtained.

19. Towards improved local hybrid functionals by calibration of exchange-energy densities

International Nuclear Information System (INIS)

Arbuznikov, Alexei V.; Kaupp, Martin

2014-01-01

A new approach for the calibration of (semi-)local and exact exchange-energy densities in the context of local hybrid functionals is reported. The calibration functions are derived from only the electron density and its spatial derivatives, avoiding spatial derivatives of the exact-exchange energy density or other computationally unfavorable contributions. The calibration functions fulfill the seven more important out of nine known exact constraints. It is shown that calibration improves substantially the definition of a non-dynamical correlation energy term for generalized gradient approximation (GGA)-based local hybrids. Moreover, gauge artifacts in the potential-energy curves of noble-gas dimers may be corrected by calibration. The developed calibration functions are then evaluated for a large range of energy-related properties (atomization energies, reaction barriers, ionization potentials, electron affinities, and total atomic energies) of three sets of local hybrids, using a simple one-parameter local-mixing. The functionals are based on (a) local spin-density approximation (LSDA) or (b) Perdew-Burke-Ernzerhof (PBE) exchange and correlation, and on (c) Becke-88 (B88) exchange and Lee-Yang-Parr (LYP) correlation. While the uncalibrated GGA-based functionals usually provide very poor thermochemical data, calibration allows a dramatic improvement, accompanied by only a small deterioration of reaction barriers. In particular, an optimized BLYP-based local-hybrid functional has been found that is a substantial improvement over the underlying global hybrids, as well as over previously reported LSDA-based local hybrids. It is expected that the present calibration approach will pave the way towards new generations of more accurate hyper-GGA functionals based on a local mixing of exchange-energy densities

20. Survival of the most transferable at the top of Jacob's ladder: Defining and testing the ωB97M(2) double hybrid density functional

Science.gov (United States)

2018-06-01

A meta-generalized gradient approximation, range-separated double hybrid (DH) density functional with VV10 non-local correlation is presented. The final 14-parameter functional form is determined by screening trillions of candidate fits through a combination of best subset selection, forward stepwise selection, and random sample consensus (RANSAC) outlier detection. The MGCDB84 database of 4986 data points is employed in this work, containing a training set of 870 data points, a validation set of 2964 data points, and a test set of 1152 data points. Following an xDH approach, orbitals from the ωB97M-V density functional are used to compute the second-order perturbation theory correction. The resulting functional, ωB97M(2), is benchmarked against a variety of leading double hybrid density functionals, including B2PLYP-D3(BJ), B2GPPLYP-D3(BJ), ωB97X-2(TQZ), XYG3, PTPSS-D3(0), XYGJ-OS, DSD-PBEP86-D3(BJ), and DSD-PBEPBE-D3(BJ). Encouragingly, the overall performance of ωB97M(2) on nearly 5000 data points clearly surpasses that of all of the tested density functionals. As a Rung 5 density functional, ωB97M(2) completes our family of combinatorially optimized functionals, complementing B97M-V on Rung 3, and ωB97X-V and ωB97M-V on Rung 4. The results suggest that ωB97M(2) has the potential to serve as a powerful predictive tool for accurate and efficient electronic structure calculations of main-group chemistry.

1. Hybrid nanomembranes for high power and high energy density supercapacitors and their yarn application.

Science.gov (United States)

Lee, Jae Ah; Shin, Min Kyoon; Kim, Shi Hyeong; Kim, Seon Jeong; Spinks, Geoffrey M; Wallace, Gordon G; Ovalle-Robles, Raquel; Lima, Márcio D; Kozlov, Mikhail E; Baughman, Ray H

2012-01-24

We report mechanically robust, electrically conductive, free-standing, and transparent hybrid nanomembranes made of densified carbon nanotube sheets that were coated with poly(3,4-ethylenedioxythiophene) using vapor phase polymerization and their performance as supercapacitors. The hybrid nanomembranes with thickness of ~66 nm and low areal density of ~15 μg/cm(2)exhibited high mechanical strength and modulus of 135 MPa and 12.6 GPa, respectively. They also had remarkable shape recovery ability in liquid and at the liquid/air interface unlike previous carbon nanotube sheets. The hybrid nanomembrane attached on a current collector had volumetric capacitance of ~40 F/cm(3) at 100 V s(-1) (~40 and ~80 times larger than that of onion-like carbon measured at 100 V s(-1) and activated carbon measured at 20 V s(-1), respectively), and it showed rectangular shapes of cyclic voltammograms up to ~5 V s(-1). High mechanical strength and flexibility of the hybrid nanomembrane enabled twisting it into microsupercapacitor yarns with diameters of ~30 μm. The yarn supercapacitor showed stable cycling performance without a metal current collector, and its capacitance decrease was only ~6% after 5000 cycles. Volumetric energy and power density of the hybrid nanomembrane was ~70 mWh cm(-3) and ~7910 W cm(-3), and the yarn possessed the energy and power density of ~47 mWh cm(-3) and ~538 W cm(-3). © 2011 American Chemical Society

2. Switching non-local median filter

Science.gov (United States)

Matsuoka, Jyohei; Koga, Takanori; Suetake, Noriaki; Uchino, Eiji

2015-06-01

This paper describes a novel image filtering method for removal of random-valued impulse noise superimposed on grayscale images. Generally, it is well known that switching-type median filters are effective for impulse noise removal. In this paper, we propose a more sophisticated switching-type impulse noise removal method in terms of detail-preserving performance. Specifically, the noise detector of the proposed method finds out noise-corrupted pixels by focusing attention on the difference between the value of a pixel of interest (POI) and the median of its neighboring pixel values, and on the POI's isolation tendency from the surrounding pixels. Furthermore, the removal of the detected noise is performed by the newly proposed median filter based on non-local processing, which has superior detail-preservation capability compared to the conventional median filter. The effectiveness and the validity of the proposed method are verified by some experiments using natural grayscale images.

3. Characterization of a silica-PVA hybrid for high density and stable silver dissolution

Energy Technology Data Exchange (ETDEWEB)

Dorin, Bryce, E-mail: bryce.dorin@postgrad.manchester.ac.uk [The Photon Science Institute, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); School of Chemical Engineering and Analytical Science, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); Zhu, Guangyu, E-mail: g.zhu@liverpool.ac.uk [Lairdside Laser Engineering Centre, The University of Liverpool, Campbeltown Road, Merseyside, CH41 9HP (United Kingdom); Parkinson, Patrick, E-mail: patrick.parkinson@manchester.ac.uk [The Photon Science Institute, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); School of Physics and Astronomy, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); Perrie, Walter, E-mail: wpfemto1@liverpool.ac.uk [Lairdside Laser Engineering Centre, The University of Liverpool, Campbeltown Road, Merseyside, CH41 9HP (United Kingdom); Benyezzar, Med, E-mail: med.benyezzar@manchester.ac.uk [The Photon Science Institute, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); Scully, Patricia, E-mail: patricia.scully@manchester.ac.uk [The Photon Science Institute, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom); School of Chemical Engineering and Analytical Science, The University of Manchester, Oxford Road, Manchester, M13 9PL (United Kingdom)

2016-07-01

A silica and polyvinyl alcohol (PVA) hybrid material mixed with a high density of silver ions is synthesised and characterized in this work. The hybrid material can be cast into thick films, which we determined to be homogeneous using Raman spectroscopy. We observed that the silver ions remain stable in the material over time and at temperatures of 100 °C, which represents a marked improvement over previous solid solutions of silver. Differential scanning calorimetry and thermogravimetric analysis indicate the rapid activation of silver at 173 °C, resulting in a dense formation of silver nanoparticles within the hybrid. The activation of silver was also demonstrated in 3-dimensional geometries using femtosecond duration laser pulses. These results illustrate the silica-PVA hybrid is an attractive material for developing silver-insulator composites. - Highlights: • A novel PVA-silica hybrid is developed for silver ion dissolution. • The hybrid exhibits a high silver saturation point and good silver stability. • Heating and laser irradiation are capable of converting the silver ions to metal. • The hybrid material enables the fabrication of 3D metal-insulator composites.

4. Importance of non-local electron-positron correlations for positron annihilation characteristics in solids

International Nuclear Information System (INIS)

Rubaszek, A.

2001-01-01

Several methods to describe the electron-positron (e-p) correlation effects are used in calculations of positron annihilation characteristics in solids. The weighted density approximation (WDA), giving rise to the non-local, state-selective e-p correlation functions, is applied to calculate positron annihilation rates and e-p momentum densities in a variety of metals and silicon. The WDA results are compared to the results of other methods such as the independent particle model, local density approximation, generalised gradient approximation, and also to experiments. The importance of non-locality and state-dependence of the e-p correlation functions is discussed. (orig.)

5. Constraining generalized non-local cosmology from Noether symmetries.

Science.gov (United States)

Bahamonde, Sebastian; Capozziello, Salvatore; Dialektopoulos, Konstantinos F

2017-01-01

We study a generalized non-local theory of gravity which, in specific limits, can become either the curvature non-local or teleparallel non-local theory. Using the Noether symmetry approach, we find that the coupling functions coming from the non-local terms are constrained to be either exponential or linear in form. It is well known that in some non-local theories, a certain kind of exponential non-local couplings is needed in order to achieve a renormalizable theory. In this paper, we explicitly show that this kind of coupling does not need to be introduced by hand, instead, it appears naturally from the symmetries of the Lagrangian in flat Friedmann-Robertson-Walker cosmology. Finally, we find de Sitter and power-law cosmological solutions for different non-local theories. The symmetries for the generalized non-local theory are also found and some cosmological solutions are also achieved using the full theory.

6. Constraining generalized non-local cosmology from Noether symmetries

Energy Technology Data Exchange (ETDEWEB)

Bahamonde, Sebastian [University College London, Department of Mathematics, London (United Kingdom); Capozziello, Salvatore [Universita di Napoli ' ' Federico II' ' , Dipartimento di Fisica ' ' E. Pancini' ' , Naples (Italy); Gran Sasso Science Institute, L' Aquila (Italy); Complesso di Monte Sant' Angelo, Naples (Italy); INFN Sezione di Napoli, Naples (Italy); Dialektopoulos, Konstantinos F. [Universita di Napoli ' ' Federico II' ' , Dipartimento di Fisica ' ' E. Pancini' ' , Naples (Italy); Complesso di Monte Sant' Angelo, Naples (Italy); INFN Sezione di Napoli, Naples (Italy)

2017-11-15

We study a generalized non-local theory of gravity which, in specific limits, can become either the curvature non-local or teleparallel non-local theory. Using the Noether symmetry approach, we find that the coupling functions coming from the non-local terms are constrained to be either exponential or linear in form. It is well known that in some non-local theories, a certain kind of exponential non-local couplings is needed in order to achieve a renormalizable theory. In this paper, we explicitly show that this kind of coupling does not need to be introduced by hand, instead, it appears naturally from the symmetries of the Lagrangian in flat Friedmann-Robertson-Walker cosmology. Finally, we find de Sitter and power-law cosmological solutions for different non-local theories. The symmetries for the generalized non-local theory are also found and some cosmological solutions are also achieved using the full theory. (orig.)

7. Hybrid neural network for density limit disruption prediction and avoidance on J-TEXT tokamak

Science.gov (United States)

Zheng, W.; Hu, F. R.; Zhang, M.; Chen, Z. Y.; Zhao, X. Q.; Wang, X. L.; Shi, P.; Zhang, X. L.; Zhang, X. Q.; Zhou, Y. N.; Wei, Y. N.; Pan, Y.; J-TEXT team

2018-05-01

Increasing the plasma density is one of the key methods in achieving an efficient fusion reaction. High-density operation is one of the hot topics in tokamak plasmas. Density limit disruptions remain an important issue for safe operation. An effective density limit disruption prediction and avoidance system is the key to avoid density limit disruptions for long pulse steady state operations. An artificial neural network has been developed for the prediction of density limit disruptions on the J-TEXT tokamak. The neural network has been improved from a simple multi-layer design to a hybrid two-stage structure. The first stage is a custom network which uses time series diagnostics as inputs to predict plasma density, and the second stage is a three-layer feedforward neural network to predict the probability of density limit disruptions. It is found that hybrid neural network structure, combined with radiation profile information as an input can significantly improve the prediction performance, especially the average warning time ({{T}warn} ). In particular, the {{T}warn} is eight times better than that in previous work (Wang et al 2016 Plasma Phys. Control. Fusion 58 055014) (from 5 ms to 40 ms). The success rate for density limit disruptive shots is above 90%, while, the false alarm rate for other shots is below 10%. Based on the density limit disruption prediction system and the real-time density feedback control system, the on-line density limit disruption avoidance system has been implemented on the J-TEXT tokamak.

8. Screened exchange hybrid density functional for accurate and efficient structures and interaction energies.

Science.gov (United States)

Brandenburg, Jan Gerit; Caldeweyher, Eike; Grimme, Stefan

2016-06-21

We extend the recently introduced PBEh-3c global hybrid density functional [S. Grimme et al., J. Chem. Phys., 2015, 143, 054107] by a screened Fock exchange variant based on the Henderson-Janesko-Scuseria exchange hole model. While the excellent performance of the global hybrid is maintained for small covalently bound molecules, its performance for computed condensed phase mass densities is further improved. Most importantly, a speed up of 30 to 50% can be achieved and especially for small orbital energy gap cases, the method is numerically much more robust. The latter point is important for many applications, e.g., for metal-organic frameworks, organic semiconductors, or protein structures. This enables an accurate density functional based electronic structure calculation of a full DNA helix structure on a single core desktop computer which is presented as an example in addition to comprehensive benchmark results.

9. Global hybrids from the semiclassical atom theory satisfying the local density linear response.

Science.gov (United States)

Fabiano, Eduardo; Constantin, Lucian A; Cortona, Pietro; Della Sala, Fabio

2015-01-13

We propose global hybrid approximations of the exchange-correlation (XC) energy functional which reproduce well the modified fourth-order gradient expansion of the exchange energy in the semiclassical limit of many-electron neutral atoms and recover the full local density approximation (LDA) linear response. These XC functionals represent the hybrid versions of the APBE functional [Phys. Rev. Lett. 2011, 106, 186406] yet employing an additional correlation functional which uses the localization concept of the correlation energy density to improve the compatibility with the Hartree-Fock exchange as well as the coupling-constant-resolved XC potential energy. Broad energetic and structural testing, including thermochemistry and geometry, transition metal complexes, noncovalent interactions, gold clusters and small gold-molecule interfaces, as well as an analysis of the hybrid parameters, show that our construction is quite robust. In particular, our testing shows that the resulting hybrid, including 20% of Hartree-Fock exchange and named hAPBE, performs remarkably well for a broad palette of systems and properties, being generally better than popular hybrids (PBE0 and B3LYP). Semiempirical dispersion corrections are also provided.

10. Deriving appropriate boundary conditions, and accelerating position-jump simulations, of diffusion using non-local jumping

International Nuclear Information System (INIS)

Taylor, P R; Baker, R E; Yates, C A

2015-01-01

In this paper we explore lattice-based position-jump models of diffusion, and the implications of introducing non-local jumping; particles can jump to a range of nearby boxes rather than only to their nearest neighbours. We begin by deriving conditions for equivalence with traditional local jumping models in the continuum limit. We then generalize a previously postulated implementation of the Robin boundary condition for a non-local process of arbitrary maximum jump length, and present a novel implementation of flux boundary conditions, again generalized for a non-local process of arbitrary maximum jump length. In both these cases we validate our results using stochastic simulation. We then proceed to consider two variations on the basic diffusion model: a hybrid local/non-local scheme suitable for models involving sharp concentration gradients, and the implementation of biased jumping. In all cases we show that non-local jumping can deliver substantial time savings for stochastic simulations. (paper)

11. STABLE STATIONARY STATES OF NON-LOCAL INTERACTION EQUATIONS

KAUST Repository

FELLNER, KLEMENS

2010-12-01

In this paper, we are interested in the large-time behaviour of a solution to a non-local interaction equation, where a density of particles/individuals evolves subject to an interaction potential and an external potential. It is known that for regular interaction potentials, stable stationary states of these equations are generically finite sums of Dirac masses. For a finite sum of Dirac masses, we give (i) a condition to be a stationary state, (ii) two necessary conditions of linear stability w.r.t. shifts and reallocations of individual Dirac masses, and (iii) show that these linear stability conditions imply local non-linear stability. Finally, we show that for regular repulsive interaction potential Wε converging to a singular repulsive interaction potential W, the Dirac-type stationary states ρ̄ ε approximate weakly a unique stationary state ρ̄ ∈ L∞. We illustrate our results with numerical examples. © 2010 World Scientific Publishing Company.

12. Pressure dependence of electron density distribution and d-p-π hybridization in titanate perovskite ferroelectrics

Science.gov (United States)

Yamanaka, Takamitsu; Nakamoto, Yuki; Ahart, Muhtar; Mao, Ho-kwang

2018-04-01

Electron density distributions of PbTi O3 , BaTi O3 , and SrTi O3 were determined by synchrotron x-ray powder diffraction up to 55 GPa at 300 K and ab initio quantum chemical molecular orbital (MO) calculations, together with a combination of maximum entropy method calculations. The intensity profiles of Bragg peaks reveal split atoms in both ferroelectric PbTi O3 and BaTi O3 , reflecting the two possible positions occupied by the Ti atom. The experimentally obtained atomic structure factor was used for the determination of the deformation in electron density and the d-p-π hybridization between dx z (and dy z) of Ti and px (and py) of O in the Ti-O bond. Ab initio MO calculations proved the change of the molecular orbital coupling and of Mulliken charges with a structure transformation. The Mulliken charge of Ti in the Ti O6 octahedron increased in the ionicity with increasing pressure in the cubic phase. The bonding nature is changed with a decrease in the hybridization of the Ti-O bond and the localization of the electron density with increasing pressure. The hybridization decreases with pressure and disappears in the cubic paraelectric phase, which has a much more localized electron density distribution.

13. A general range-separated double-hybrid density-functional theory.

Science.gov (United States)

Kalai, Cairedine; Toulouse, Julien

2018-04-28

A range-separated double-hybrid (RSDH) scheme which generalizes the usual range-separated hybrids and double hybrids is developed. This scheme consistently uses a two-parameter Coulomb-attenuating-method (CAM)-like decomposition of the electron-electron interaction for both exchange and correlation in order to combine Hartree-Fock exchange and second-order Møller-Plesset (MP2) correlation with a density functional. The RSDH scheme relies on an exact theory which is presented in some detail. Several semi-local approximations are developed for the short-range exchange-correlation density functional involved in this scheme. After finding optimal values for the two parameters of the CAM-like decomposition, the RSDH scheme is shown to have a relatively small basis dependence and to provide atomization energies, reaction barrier heights, and weak intermolecular interactions globally more accurate or comparable to range-separated MP2 or standard MP2. The RSDH scheme represents a new family of double hybrids with minimal empiricism which could be useful for general chemical applications.

14. A-centers in silicon studied with hybrid density functional theory

KAUST Repository

Wang, Hao; Chroneos, Alexander; Londos, C. A.; Schwingenschlö gl, Udo; Sgourou, E. N.

2013-01-01

Density functional theory employing hybrid functional is used to gain fundamental insight into the interaction of vacancies with oxygen interstitials to form defects known as A-centers in silicon. We calculate the formation energy of the defect with respect to the Fermi energy for all possible charge states. It is found that the neutral and doubly negatively charged A-centers dominate. The findings are analyzed in terms of the density of states and discussed in view of previous experimental and theoretical studies.

15. G-centers in irradiated silicon revisited: A screened hybrid density functional theory approach

KAUST Repository

Wang, H.

2014-05-13

Electronic structure calculations employing screened hybrid density functional theory are used to gain fundamental insight into the interaction of carbon interstitial (Ci) and substitutional (Cs) atoms forming the CiCs defect known as G-center in silicon (Si). The G-center is one of the most important radiation related defects in Czochralski grown Si. We systematically investigate the density of states and formation energy for different types of CiCs defects with respect to the Fermi energy for all possible charge states. Prevalence of the neutral state for the C-type defect is established.

16. A-centers in silicon studied with hybrid density functional theory

KAUST Repository

Wang, Hao

2013-07-29

Density functional theory employing hybrid functional is used to gain fundamental insight into the interaction of vacancies with oxygen interstitials to form defects known as A-centers in silicon. We calculate the formation energy of the defect with respect to the Fermi energy for all possible charge states. It is found that the neutral and doubly negatively charged A-centers dominate. The findings are analyzed in terms of the density of states and discussed in view of previous experimental and theoretical studies.

17. Analytic derivatives for perturbatively corrected ''double hybrid'' density functionals: Theory, implementation, and applications

International Nuclear Information System (INIS)

Neese, Frank; Schwabe, Tobias; Grimme, Stefan

2007-01-01

A recently proposed new family of density functionals [S. Grimme, J. Chem. Phys. 124, 34108 (2006)] adds a fraction of nonlocal correlation as a new ingredient to density functional theory (DFT). This fractional correlation energy is calculated at the level of second-order many-body perturbation theory (PT2) and replaces some of the semilocal DFT correlation of standard hybrid DFT methods. The new ''double hybrid'' functionals (termed, e.g., B2-PLYP) contain only two empirical parameters that have been adjusted in thermochemical calculations on parts of the G2/3 benchmark set. The methods have provided the lowest errors ever obtained by any DFT method for the full G3 set of molecules. In this work, the applicability of the new functionals is extended to the exploration of potential energy surfaces with analytic gradients. The theory of the analytic gradient largely follows the standard theory of PT2 gradients with some additional subtleties due to the presence of the exchange-correlation terms in the self-consistent field operator. An implementation is reported for closed-shell as well as spin-unrestricted reference determinants. Furthermore, the implementation includes external point charge fields and also accommodates continuum solvation models at the level of the conductor like screening model. The density fitting resolution of the identity (RI) approximation can be applied to the evaluation of the PT2 part with large gains in computational efficiency. For systems with ∼500-600 basis functions the evaluation of the double hybrid gradient is approximately four times more expensive than the calculation of the standard hybrid DFT gradient. Extensive test calculations are provided for main group elements and transition metal containing species. The results reveal that the B2-PLYP functional provides excellent molecular geometries that are superior compared to those from standard DFT and MP2

18. Lower hybrid current drive at ITER-relevant high plasma densities

International Nuclear Information System (INIS)

Cesario, R.; Amicucci, L.; Cardinali, A.; Castaldo, C.; Marinucci, M.; Panaccione, L.; Pericoli-Ridolfini, V.; Tuccillo, A. A.; Tudisco, O.; Calabro, G.

2009-01-01

Recent experiments indicated that a further non-inductive current, besides bootstrap, should be necessary for developing advanced scenario for ITER. The lower hybrid current drive (LHCD) should provide such tool, but its effectiveness was still not proved in operations with ITER-relevant density of the plasma column periphery. Progress of the LH deposition modelling is presented, performed considering the wave physics of the edge, and different ITER-relevant edge parameters. Operations with relatively high edge electron temperatures are expected to reduce the LH || spectral broadening and, consequently, enabling the LH power to propagate also in high density plasmas ( || is the wavenumber component aligned to the confinement magnetic field). New results of FTU experiments are presented, performed by following the aforementioned modeling: they indicate that, for the first time, the LHCD conditions are established by operating at ITER-relevant high edge densities.

19. Effects of Plant Density on Sweet and Baby Corn (Hybrid KSC 403 Yield and Yield Components

Directory of Open Access Journals (Sweden)

H Bavi

2016-07-01

Full Text Available Introduction Sweet corn is the one of the most important types of corn. There is a high amount of sugar in the endosperm of sweet corn than dent corn. Baby corn is the ear of corn that is being harvested in the silking stage before the end of pollination. This crop has an interesting using methods as salad, conserve production and vegetative consumption. Both two sweet and baby corn is obtained from one plant in different growth stages and could be harvested from one corn hybrid. Best yield and quality of baby corn is obtained from sweet corn hybrids, because of high amounts of sugar in the grains and ears. Sweet corn and baby corn could be harvested at early dough stage (with about 30 % of humidity and early silking stage before the pollination is completed, respectively. Plant density is the most important factor in growing corn, especially in sweet and baby corn. Khuzestan province is one of the main regions of corn production in Iran. In Khuzestan, forage and silage corn have the most production among the summer crops. Corn is planted in two planting date in Khuzestan: early spring and early summer. Spring corn planting produces little grain yield due to Simultaneity of silking stage with hot early summer days. Because of little production and little research about sweet and baby corn, this study was performed and designed. Materials and Methods In order to investigate the effects of plant density and harvesting method on sweet corn and baby corn yield, an experiment was performed during 2012-13, in research farm of Ramin Agriculture and Natural Resources University of Khuzestan, located in southwest of Iran. In this experiment, four plant densities (7, 9, 11 and 13 plants.m-2 and two harvesting methods (baby corn and sweet corn were investigated in an RCB statistical design with four replications. The KSC 403 hybrid was used and investigated in the experiment, as a sweet corn hybrid. Statistical analysis was performed using SAS 9.1 through

20. Effect of magnetic and density fluctuations on the propagation of lower hybrid waves in tokamaks

Science.gov (United States)

Vahala, George; Vahala, Linda; Bonoli, Paul T.

1992-12-01

Lower hybrid waves have been used extensively for plasma heating, current drive, and ramp-up as well as sawteeth stabilization. The wave kinetic equation for lower hybrid wave propagation is extended to include the effects of both magnetic and density fluctuations. This integral equation is then solved by Monte Carlo procedures for a toroidal plasma. It is shown that even for magnetic/density fluctuation levels on the order of 10-4, there are significant magnetic fluctuation effects on the wave power deposition into the plasma. This effect is quite pronounced if the magnetic fluctuation spectrum is peaked within the plasma. For Alcator-C-Mod [I. H. Hutchinson and the Alcator Group, Proceedings of the IEEE 13th Symposium on Fusion Engineering (IEEE, New York, 1990), Cat. No. 89CH 2820-9, p. 13] parameters, it seems possible to be able to infer information on internal magnetic fluctuations from hard x-ray data—especially since the effects of fluctuations on electron power density can explain the hard x-ray data from the JT-60 tokamak [H. Kishimoto and JT-60 Team, in Plasma Physics and Controlled Fusion (International Atomic Energy Agency, Vienna, 1989), Vol. I, p. 67].

1. VV and VO2 defects in silicon studied with hybrid density functional theory

KAUST Repository

Christopoulos, Stavros Richard G

2014-12-07

The formation of VO (A-center), VV and VO2 defects in irradiated Czochralski-grown silicon (Si) is of technological importance. Recent theoretical studies have examined the formation and charge states of the A-center in detail. Here we use density functional theory employing hybrid functionals to analyze the formation of VV and VO2 defects. The formation energy as a function of the Fermi energy is calculated for all possible charge states. For the VV and VO2 defects double negatively charged and neutral states dominate, respectively.

2. Vacancy formation in MoO3: hybrid density functional theory and photoemission experiments

KAUST Repository

Salawu, Omotayo Akande

2016-09-29

Molybdenum oxide (MoO3) is an important material that is being considered for numerous technological applications, including catalysis and electrochromism. In the present study, we apply hybrid density functional theory to investigate O and Mo vacancies in the orthorhombic phase. We determine the vacancy formation energies of different defect sites as functions of the electron chemical potential, addressing different charge states. In addition, we investigate the consequences of defects for the material properties. Ultraviolet photoemission spectroscopy is employed to study the valence band of stoichiometric and O defective MoO3. We show that O vacancies result in occupied in-gap states.

3. Accurate Energies and Structures for Large Water Clusters Using the X3LYP Hybrid Density Functional

OpenAIRE

Su, Julius T.; Xu, Xin; Goddard, William A., III

2004-01-01

We predict structures and energies of water clusters containing up to 19 waters with X3LYP, an extended hybrid density functional designed to describe noncovalently bound systems as accurately as covalent systems. Our work establishes X3LYP as the most practical ab initio method today for calculating accurate water cluster structures and energies. We compare X3LYP/aug-cc-pVTZ energies to the most accurate theoretical values available (n = 2−6, 8), MP2 with basis set superposition error (BSSE)...

4. Tillage and planting density affect the performance of maize hybrids in Chitwan, Nepal

Directory of Open Access Journals (Sweden)

2015-12-01

Full Text Available To find out whether the different tillage methods at different planting densities affect the performance of maize hybrids, an experiment was carried out at National Maize Research Program, Rampur during spring season of 2013 and 2014. The experiment was laid out in strip plot design with three replications having 12 treatments. The vertical factor was tillage with conservation tillage (No Tillage + residue=NT and conventional tillage (CT and the horizontal factor were genotypes (Rampur Hybrid-2 and RML-32/RML-17 and in split planting geometries (75cm × 25cm =53333 plants/ha, 70cm × 25cm=57142 plant/ha and 60cm ×25cm= 66666 plants/ha. In both the years, the highest number of cobs (73,177 and 67638/ha was recorded at planting density of 66666/ha. NT had the highest no of kernel rows/cob (14.01 as against 12.12 in CT in 2014. The highest number of kernels (27.3 and 29.29 per row was recorded in NT during 2013 and 2014 respectively. Similarly, in 2014, the highest number of kernels were found in RML-32/RMl-17 (29.17/row and planting density of 53333/ha (28.46/row. In 2013, RML-32/RML-17 produced the highest test weight of 363.94g over the Rampur hybrid-2 with 362.17g. Significantly the highest grain yield of 9240.00 kg/ha in 2013 and 7459.80 kg/ha in 2014 at planting geometry of 65cm ×25cm were recorded. No effects was found by tillage methods for grain yields of maize in 2013, but was found in 2014 (7012.18 kg in NT compared to 6037.59 kg/ha in CT. NT and wider spaced crop matured earlier in both the years; however Rampur hybrid-2 matured earlier to RML-32/RML-17 in 2013. In 2014, harvest index of 47.85 % was recorded in planting geometry of 66666/ha, the highest benefit cost ratio of 1.36 was worked out in NT and 1.46 at the density of 66666/ha. The highest value of 2.46% of soil organic matter was recorded in NT as compared to 2.43% in CT.

5. Vacancy formation in MoO3: hybrid density functional theory and photoemission experiments

KAUST Repository

Salawu, Omotayo Akande; Chroneos, Alexander; Vasilopoulou, Maria; Kennou, Stella; Schwingenschlö gl, Udo

2016-01-01

Molybdenum oxide (MoO3) is an important material that is being considered for numerous technological applications, including catalysis and electrochromism. In the present study, we apply hybrid density functional theory to investigate O and Mo vacancies in the orthorhombic phase. We determine the vacancy formation energies of different defect sites as functions of the electron chemical potential, addressing different charge states. In addition, we investigate the consequences of defects for the material properties. Ultraviolet photoemission spectroscopy is employed to study the valence band of stoichiometric and O defective MoO3. We show that O vacancies result in occupied in-gap states.

6. Mermin Non-Locality in Abstract Process Theories

Directory of Open Access Journals (Sweden)

Stefano Gogioso

2015-11-01

Full Text Available The study of non-locality is fundamental to the understanding of quantum mechanics. The past 50 years have seen a number of non-locality proofs, but its fundamental building blocks, and the exact role it plays in quantum protocols, has remained elusive. In this paper, we focus on a particular flavour of non-locality, generalising Mermin's argument on the GHZ state. Using strongly complementary observables, we provide necessary and sufficient conditions for Mermin non-locality in abstract process theories. We show that the existence of more phases than classical points (aka eigenstates is not sufficient, and that the key to Mermin non-locality lies in the presence of certain algebraically non-trivial phases. This allows us to show that fRel, a favourite toy model for categorical quantum mechanics, is Mermin local. We show Mermin non-locality to be the key resource ensuring the device-independent security of the HBB CQ (N,N family of Quantum Secret Sharing protocols. Finally, we challenge the unspoken assumption that the measurements involved in Mermin-type scenarios should be complementary (like the pair X,Y, opening the doors to a much wider class of potential experimental setups than currently employed. In short, we give conditions for Mermin non-locality tests on any number of systems, where each party has an arbitrary number of measurement choices, where each measurement has an arbitrary number of outcomes and further, that works in any abstract process theory.

7. Long-Range Corrected Hybrid Density Functionals with Damped Atom-Atom Dispersion Corrections

Energy Technology Data Exchange (ETDEWEB)

2008-06-14

We report re-optimization of a recently proposed long-range corrected (LC) hybrid density functionals [J.-D. Chai and M. Head-Gordon, J. Chem. Phys. 128, 084106 (2008)] to include empirical atom-atom dispersion corrections. The resulting functional, {omega}B97X-D yields satisfactory accuracy for thermochemistry, kinetics, and non-covalent interactions. Tests show that for non-covalent systems, {omega}B97X-D shows slight improvement over other empirical dispersion-corrected density functionals, while for covalent systems and kinetics, it performs noticeably better. Relative to our previous functionals, such as {omega}B97X, the new functional is significantly superior for non-bonded interactions, and very similar in performance for bonded interactions.

8. Doping strategies to control A-centres in silicon: Insights from hybrid density functional theory

KAUST Repository

Wang, Hao; Chroneos, Alexander I.; Londos, Charalampos A.; Sgourou, Efstratia N.; Schwingenschlö gl, Udo

2014-01-01

Hybrid density functional theory is used to gain insights into the interaction of intrinsic vacancies (V) and oxygen-vacancy pairs (VO, known as A-centres) with the dopants (D) germanium (Ge), tin (Sn), and lead (Pb) in silicon (Si). We determine the structures as well as binding and formation energies of the DVO and DV complexes. The results are discussed in terms of the density of states and in view of the potential of isovalent doping to control A-centres in Si. We argue that doping with Sn is the most efficient isovalent doping strategy to suppress A-centres by the formation of SnVO complexes, as these are charge neutral and strongly bound. © 2014 the Owner Societies.

9. Non-local exchange correlation functionals impact on the structural, electronic and optical properties of III-V arsenides

KAUST Repository

Anua, N. Najwa

2013-08-20

Exchange correlation (XC) energy functionals play a vital role in the efficiency of density functional theory (DFT) calculations, more soundly in the calculation of fundamental electronic energy bandgap. In the present DFT study of III-arsenides, we investigate the implications of XC-energy functional and corresponding potential on the structural, electronic and optical properties of XAs (X = B, Al, Ga, In). Firstly we report and discuss the optimized structural lattice parameters and the band gap calculations performed within different non-local XC functionals as implemented in the DFT-packages: WIEN2k, CASTEP and SIESTA. These packages are representative of the available code in ab initio studies. We employed the LDA, GGA-PBE, GGA-WC and mBJ-LDA using WIEN2k. In CASTEP, we employed the hybrid functional, sX-LDA. Furthermore LDA, GGA-PBE and meta-GGA were employed using SIESTA code. Our results point to GGA-WC as a more appropriate approximation for the calculations of structural parameters. However our electronic bandstructure calculations at the level of mBJ-LDA potential show considerable improvements over the other XC functionals, even the sX-LDA hybrid functional. We report also the optical properties within mBJ potential, which show a nice agreement with the experimental measurements in addition to other theoretical results. © 2013 IOP Publishing Ltd.

10. Highly Oriented Graphene Sponge Electrode for Ultra High Energy Density Lithium Ion Hybrid Capacitors.

Science.gov (United States)

Ahn, Wook; Lee, Dong Un; Li, Ge; Feng, Kun; Wang, Xiaolei; Yu, Aiping; Lui, Gregory; Chen, Zhongwei

2016-09-28

Highly oriented rGO sponge (HOG) can be easily synthesized as an effective anode for application in high-capacity lithium ion hybrid capacitors. X-ray diffraction and morphological analyses show that successfully exfoliated rGO sponge on average consists of 4.2 graphene sheets, maintaining its three-dimensional structure with highly oriented morphology even after the thermal reduction procedure. Lithium-ion hybrid capacitors (LIC) are fabricated in this study based on a unique cell configuration which completely eliminates the predoping process of lithium ions. The full-cell LIC consisting of AC/HOG-Li configuration has resulted in remarkably high energy densities of 231.7 and 131.9 Wh kg(-1) obtained at 57 W kg(-1) and 2.8 kW kg(-1). This excellent performance is attributed to the lithium ion diffusivity related to the intercalation reaction of AC/HOG-Li which is 3.6 times higher that of AC/CG-Li. This unique cell design and configuration of LIC presented in this study using HOG as an effective anode is an unprecedented example of performance enhancement and improved energy density of LIC through successful increase in cell operation voltage window.

11. Electronic properties of B and Al doped graphane: A hybrid density functional study

Science.gov (United States)

Mapasha, R. E.; Igumbor, E.; Andriambelaza, N. F.; Chetty, N.

2018-04-01

Using a hybrid density functional theory approach parametrized by Heyd, Scuseria and Ernzerhof (HSE06 hybrid functional), we study the energetics, structural and electronic properties of a graphane monolayer substitutionally doped with the B (BCH) and Al (AlCH) atoms. The BCH defect can be integrated within a graphane monolayer at a relative low formation energy, without major structural distortions and symmetry breaking. The AlCH defect relaxes outward of the monolayer and breaks the symmetry. The density of states plots indicate that BCH doped graphane monolayer is a wide band gap semiconductor, whereas the AlCH defect introduces the spin dependent mid gap states at the vicinity of the Fermi level, revealing a metallic character with the pronounced magnetic features. We further examine the response of the Al dependent spin states on the multiple charge states doping. We find that the defect formation energy, structural and electronic properties can be altered via charge state modulation. The +1 charge doping opens an energy band gap of 1.75 eV. This value corresponds to the wavelength in the visible spectrum, suggesting an ideal material for solar cell absorbers. Our study fine tunes the graphane band gap through the foreign atom doping as well as via defect charge state modulation.

12. Electronic structure modeling of InAs/GaSb superlattices with hybrid density functional theory

Energy Technology Data Exchange (ETDEWEB)

Garwood, Tristan [Univ. of New Mexico, Albuquerque, NM (United States). Center for High Technology Materials; Modine, Normand A. [Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States); Krishna, S. [Univ. of New Mexico, Albuquerque, NM (United States). Center for High Technology Materials

2016-12-18

The application of first-principles calculations holds promise for greatly improving our understanding of semiconductor superlattices. By developing a procedure to accurately predict band gaps using hybrid density functional theory, it lays the groundwork for future studies investigating more nuanced properties of these structures. Our approach allows a priori prediction of the properties of SLS structures using only the band gaps of the constituent materials. Furthermore, it should enable direct investigation of the effects of interface structure, e.g., intermixing or ordering at the interface, on SLS properties. In this paper, we present band gap data for various InAs/GaSb type-II superlattice structures calculated using the generalized Kohn-Sham formulation of density functional theory. A PBE0-type hybrid functional was used, and the portion of the exact exchange was tuned to fit the band gaps of the binary compounds InAs and GaSb with the best agreement to bulk experimental values obtained with 18% of the exact exchange. The heterostructures considered in this study are 6 monolayer (ML) InAs/6 ML GaSb, 8 ML InAs/8 ML GaSb and 10 ML InAs/10 ML GaSb with deviations from the experimental band gaps ranging from 3% to 11%.

13. Modeling and Density Estimation of an Urban Freeway Network Based on Dynamic Graph Hybrid Automata.

Science.gov (United States)

Chen, Yangzhou; Guo, Yuqi; Wang, Ying

2017-03-29

In this paper, in order to describe complex network systems, we firstly propose a general modeling framework by combining a dynamic graph with hybrid automata and thus name it Dynamic Graph Hybrid Automata (DGHA). Then we apply this framework to model traffic flow over an urban freeway network by embedding the Cell Transmission Model (CTM) into the DGHA. With a modeling procedure, we adopt a dual digraph of road network structure to describe the road topology, use linear hybrid automata to describe multi-modes of dynamic densities in road segments and transform the nonlinear expressions of the transmitted traffic flow between two road segments into piecewise linear functions in terms of multi-mode switchings. This modeling procedure is modularized and rule-based, and thus is easily-extensible with the help of a combination algorithm for the dynamics of traffic flow. It can describe the dynamics of traffic flow over an urban freeway network with arbitrary topology structures and sizes. Next we analyze mode types and number in the model of the whole freeway network, and deduce a Piecewise Affine Linear System (PWALS) model. Furthermore, based on the PWALS model, a multi-mode switched state observer is designed to estimate the traffic densities of the freeway network, where a set of observer gain matrices are computed by using the Lyapunov function approach. As an example, we utilize the PWALS model and the corresponding switched state observer to traffic flow over Beijing third ring road. In order to clearly interpret the principle of the proposed method and avoid computational complexity, we adopt a simplified version of Beijing third ring road. Practical application for a large-scale road network will be implemented by decentralized modeling approach and distributed observer designing in the future research.

14. Non-local means filter for trim statics

KAUST Repository

Huang, Yunsong; Wang, Xin; Schuster, Gerard T.

2014-01-01

this problem, we propose a trim statics inspired by the non-local means algorithm originally developed for image denoising. This method differs from the conventional one in two fundamental respects. First, the trim statics are computed by comparing image

15. Evidence of Non-local Chemical, Thermal and Gravitational Effects

Directory of Open Access Journals (Sweden)

Hu H.

2007-04-01

Full Text Available Quantum entanglement is ubiquitous in the microscopic world and manifests itself macroscopically under some circumstances. But common belief is that it alone cannot be used to transmit information nor could it be used to produce macroscopic non- local effects. Yet we have recently found evidence of non-local effects of chemical substances on the brain produced through it. While our reported results are under independent verifications by other groups, we report here our experimental findings of non-local chemical, thermal and gravitational effects in simple physical systems such as reservoirs of water quantum-entangled with water being manipulated in a remote reservoir. With the aids of high-precision instruments, we have found that the pH value, temperature and gravity of water in the detecting reservoirs can be non-locally affected through manipulating water in the remote reservoir. In particular, the pH value changes in the same direction as that being manipulated; the temperature can change against that of local environment; and the gravity apparently can also change against local gravity. These non-local effects are all reproducible and can be used for non-local signalling and many other purposes. We suggest that they are mediated by quantum entanglement between nuclear and/or electron spins in treated water and discuss the implications of these results.

16. A Systems-Theoretical Generalization of Non-Local Correlations

Science.gov (United States)

von Stillfried, Nikolaus

Non-local correlations between quantum events are not due to a causal interaction in the sense of one being the cause for the other. In principle, the correlated events can thus occur simultaneously. Generalized Quantum Theory (GQT) formalizes the idea that non-local phenomena are not exclusive to quantum mechanics, e.g. due to some specific properties of (sub)atomic particles, but that they instead arise as a consequence of the way such particles are arranged into systems. Non-local phenomena should hence occur in any system which fulfils the necessary systems-theoretical parameters. The two most important parameters with respect to non-local correlations seem to be a conserved global property of the system as a whole and sufficient degrees of freedom of the corresponding property of its subsystems. Both factors place severe limitations on experimental observability of the phenomena, especially in terms of replicability. It has been suggested that reported phenomena of a so-called synchronistic, parapsychological or paranormal kind could be understood as instances of systems-inherent non-local correlations. From a systems-theoretical perspective, their phenomenology (including the favorable conditions for their occurrence and their lack of replicability) displays substantial similarities to non-local correlations in quantum systems and matches well with systems-theoretical parameters, thus providing circumstantial evidence for this hypothesis.

17. Role of exact exchange in thermally-assisted-occupation density functional theory: A proposal of new hybrid schemes.

Science.gov (United States)

Chai, Jeng-Da

2017-01-28

We propose hybrid schemes incorporating exact exchange into thermally assisted-occupation-density functional theory (TAO-DFT) [J.-D. Chai, J. Chem. Phys. 136, 154104 (2012)] for an improved description of nonlocal exchange effects. With a few simple modifications, global and range-separated hybrid functionals in Kohn-Sham density functional theory (KS-DFT) can be combined seamlessly with TAO-DFT. In comparison with global hybrid functionals in KS-DFT, the resulting global hybrid functionals in TAO-DFT yield promising performance for systems with strong static correlation effects (e.g., the dissociation of H 2 and N 2 , twisted ethylene, and electronic properties of linear acenes), while maintaining similar performance for systems without strong static correlation effects. Besides, a reasonably accurate description of noncovalent interactions can be efficiently achieved through the inclusion of dispersion corrections in hybrid TAO-DFT. Relative to semilocal density functionals in TAO-DFT, global hybrid functionals in TAO-DFT are generally superior in performance for a wide range of applications, such as thermochemistry, kinetics, reaction energies, and optimized geometries.

18. Edge-enriched, porous carbon-based, high energy density supercapacitors for hybrid electric vehicles.

Science.gov (United States)

Kim, Yong Jung; Yang, Cheol-Min; Park, Ki Chul; Kaneko, Katsumi; Kim, Yoong Ahm; Noguchi, Minoru; Fujino, Takeshi; Oyama, Shigeki; Endo, Morinobu

2012-03-12

Supercapacitors can store and deliver energy by a simple charge separation, and thus they could be an attractive option to meet transient high energy density in operating fuel cells and in electric and hybrid electric vehicles. To achieve such requirements, intensive studies have been carried out to improve the volumetric capacitance in supercapacitors using various types and forms of carbons including carbon nanotubes and graphenes. However, conventional porous carbons are not suitable for use as electrode material in supercapacitors for such high energy density applications. Here, we show that edge-enriched porous carbons are the best electrode material for high energy density supercapacitors to be used in vehicles as an auxiliary powertrain. Molten potassium hydroxide penetrates well-aligned graphene layers vertically and consequently generates both suitable pores that are easily accessible to the electrolyte and a large fraction of electrochemically active edge sites. We expect that our findings will motivate further research related to energy storage devices and also environmentally friendly electric vehicles. Copyright © 2012 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

19. Density convection near radiating ICRF antennas and its effect on the coupling of lower hybrid waves

International Nuclear Information System (INIS)

Ekedahl, A.; Colas, L.; Beaumont, B.; Bibet, Ph.; Bremond, S.; Kazarian, F.; Noterdaeme, J.M.; Tuccillo, A.A.

2003-01-01

Combined operation of lower hybrid (LH) and Ion Cyclotron Resonance Frequency (ICRF) waves can result in a degradation of the LH wave coupling, as observed both in the Tore-Supra and Jet tokamaks. The reflection coefficient on the part of the LH launcher magnetically connected to the powered ICRF antenna increases, suggesting a local decrease in the electron density in the connecting flux tubes. This has been confirmed by Langmuir probe measurements on the LH launchers in the latest Tore-Supra experiments. Moreover, recent experiments in Jet indicate that the LH coupling degradation depends on the ICRF power and its launched k / spectrum. The 2D density distribution around the Tore-Supra ICRF antennas has been modelled with the CELLS-code, balancing parallel losses with diffusive transport and sheath induced ExB convection, obtained from RF field mapping using the ICANT-code. The calculations are in qualitative agreement with the experimental observations, i.e. density depletion is obtained, localised mainly in the antenna shadow, and dependent on ICRF power and antenna spectrum. (authors)

20. Density Convection near Radiating ICRF Antennas and its Effect on the Coupling of Lower Hybrid Waves

International Nuclear Information System (INIS)

Ekedahl, A.; Colas, L.; Beaumont, B.; Bibet, Ph.; Bremond, S.; Kazarian, F.; Mayoral, M.-L.; Mailloux, J.; Noterdaeme, J.-M.; Tuccillo, A.A.

2003-01-01

Combined operation of Lower Hybrid (LH) and Ion Cyclotron Resonance Frequency (ICRF) waves can result in a degradation of the LH wave coupling, as observed both in the Tore Supra and JET tokamaks. The reflection coefficient on the part of the LH launcher magnetically connected to the powered ICRF antenna increases, suggesting a local decrease in the electron density in the connecting flux tubes. This has been confirmed by Langmuir probe measurements on the LH launchers in the latest Tore Supra experiments. Moreover, recent experiments in JET indicate that the LH coupling degradation depends on the ICRF power and its launched k//-spectrum. The 2D density distribution around the Tore Supra ICRF antennas has been modelled with the CELLS-code, balancing parallel losses with diffusive transport and sheath induced ExB convection, obtained from RF field mapping using the ICANT-code. The calculations are in qualitative agreement with the experimental observations, i.e. density depletion is obtained, localised mainly in the antenna shadow, and dependent on ICRF power and antenna spectrum

1. Lower-hybrid counter current drive for edge current density modification in DIII-D

International Nuclear Information System (INIS)

Fenstermacher, M.E.; Nevins, W.M.; Porkolab, M.; Bonoli, P.T.; Harvey, R.W.

1994-01-01

Each of the Advanced Tokamak operating modes in DIII-D is thought to have a distinctive current density profile. So far these modes have only been achieved transiently through experiments which ramp the plasma current and shape. Extension of these modes to steady state requires non-inductive current profile control, e.g., with lower hybrid current drive (LHCD). Calculations of LHCD have been done for DIII-D using the ACCOME and CQL3D codes, showing that counter driven current at the plasma edge can cancel some of the undesirable edge bootstrap current and potentially extend the VH-mode. Results will be presented for scenarios using 2.45 GHz LH waves launched from both the midplane and off-axis ports. The sensitivity of the results to injected power, n e and T e , and launched wave spectrum will also be shown

2. IMPLICATIONS OF NON-LOCALITY OF TRANSPORT IN GEOMORPHIC TRANSPORT LAWS: HILLSLOPES AND LANDSCAPE EVOLUTION MODELING

Science.gov (United States)

Foufoula-Georgiou, E.; Ganti, V. K.; Dietrich, W. E.

2009-12-01

Sediment transport on hillslopes can be thought of as a hopping process, where the sediment moves in a series of jumps. A wide range of processes shape the hillslopes which can move sediment to a large distance in the downslope direction, thus, resulting in a broad-tail in the probability density function (PDF) of hopping lengths. Here, we argue that such a broad-tailed distribution calls for a non-local computation of sediment flux, where the sediment flux is not only a function of local topographic quantities but is an integral flux which takes into account the upslope topographic “memory” of the point of interest. We encapsulate this non-local behavior into a simple fractional diffusive model that involves fractional (non-integer) derivatives. We present theoretical predictions from this nonlocal model and demonstrate a nonlinear dependence of sediment flux on local gradient, consistent with observations. Further, we demonstrate that the non-local model naturally eliminates the scale-dependence exhibited by any local (linear or nonlinear) sediment transport model. An extension to a 2-D framework, where the fractional derivative can be cast into a mixture of directional derivatives, is discussed together with the implications of introducing non-locality into existing landscape evolution models.

3. Non-local magnetoresistance in YIG/Pt nanostructures

Energy Technology Data Exchange (ETDEWEB)

Goennenwein, Sebastian T. B., E-mail: goennenwein@wmi.badw.de; Pernpeintner, Matthias; Gross, Rudolf; Huebl, Hans [Walther-Meißner-Institut, Bayerische Akademie der Wissenschaften, Walther-Meißner-Str. 8, 85748 Garching (Germany); Nanosystems Initiative Munich (NIM), Schellingstraße 4, 80799 München (Germany); Physik-Department, Technische Universität München, James-Franck-Str. 1, 85748 Garching (Germany); Schlitz, Richard; Ganzhorn, Kathrin [Walther-Meißner-Institut, Bayerische Akademie der Wissenschaften, Walther-Meißner-Str. 8, 85748 Garching (Germany); Physik-Department, Technische Universität München, James-Franck-Str. 1, 85748 Garching (Germany); Althammer, Matthias [Walther-Meißner-Institut, Bayerische Akademie der Wissenschaften, Walther-Meißner-Str. 8, 85748 Garching (Germany)

2015-10-26

We study the local and non-local magnetoresistance of thin Pt strips deposited onto yttrium iron garnet. The local magnetoresistive response, inferred from the voltage drop measured along one given Pt strip upon current-biasing it, shows the characteristic magnetization orientation dependence of the spin Hall magnetoresistance. We simultaneously also record the non-local voltage appearing along a second, electrically isolated, Pt strip, separated from the current carrying one by a gap of a few 100 nm. The corresponding non-local magnetoresistance exhibits the symmetry expected for a magnon spin accumulation-driven process, confirming the results recently put forward by Cornelissen et al. [“Long-distance transport of magnon spin information in a magnetic insulator at room temperature,” Nat. Phys. (published online 14 September 2015)]. Our magnetotransport data, taken at a series of different temperatures as a function of magnetic field orientation, rotating the externally applied field in three mutually orthogonal planes, show that the mechanisms behind the spin Hall and the non-local magnetoresistance are qualitatively different. In particular, the non-local magnetoresistance vanishes at liquid Helium temperatures, while the spin Hall magnetoresistance prevails.

4. New class of two-dimensional bimetallic nanoplatelets for high energy density and electrochemically stable hybrid supercapacitors

DEFF Research Database (Denmark)

Liu, Zhiting; Ma, Peng; Ulstrup, Jens

2017-01-01

Currently, the application of supercapacitors (SCs) in portable electronic devices and vehicles is limited by their low energy density. Developing high-energy density SCs without sacrificing their advantages, such as their long-term stability and high power density, has thus become an increasing...... and a 96.1% retention of the initial capacitance over 5,000 cycles. We exploited the novel 2D nanoplatelets as cathode materials to assemble a hybrid SC for full-cell tests. The resulting SCs operated in a wide potential window of 0 - 1.7 V, exhibited a high energy density over 50 Wh·kg-1, and sustained...

5. Non-local charges in local quantum field theory

International Nuclear Information System (INIS)

Buchholz, D.; Lopuszanski, J.T.; Rabsztyn, S.

1985-05-01

Non-local charges are studied in the general setting of local quantum field theory. It is shown, that these charges can be represented as polynomials in the incoming respectively outgoing fields with coefficients (kernels) which are subject to specific constraints. For the restricted class of models of a scalar, massive, self interacting particle in four dimensions, a more detailed analysis shows that all non-local charges of the generic type (genus 2) are products of generators of the Poincare group. This analysis, which is based on the macroscopic causality properties of the S-matrix, seems to indicate that less trivial examples of non-local charges can only exist in two dimensions. (orig.)

6. A non-local variable for general relativity

International Nuclear Information System (INIS)

Kozameh, C.N.; Newman, E.T.

1983-01-01

The usual description of differential geometry and general relativity is in terms of local fields, e.g. the metric, the curvature tensor, etc, which satisfy local differential equations. The authors introduce a new non-local field (Z) from which the local fields can be derived. Basically Z, though it is non-local, should be thought of as a function on the bundle of null directions on a space-time. The program can be divided into two parts; first the authors want to show the geometric meaning of and the relationship between Z and the local field. Then they want to provide field equations (non-local) for Z which will be equivalent to the vacuum Einstein equations for the local field. (Auth.)

7. Non-local quantal Noether identities and their applications

International Nuclear Information System (INIS)

Li Ziping

2002-01-01

Based on the phase-space generating functional for a system with a singular high-order Lagrangian, the quantal canonical Noether identities under the local and non-local transformation in phase space for such system have been derived. For a gauge-invariant system with a higher-order Lagrangian, the quantal Noether identities under the local and non-local transformation in configuration space have also been derived. it has been pointed out that in certain cases the quantal Noether identities may be converted to the conservation laws at the quantum level. This algorithm to derive the quantal conservation laws is significantly different from the first quantal Noether theorem. The applications to the non-Abelian CS theories with higher-order derivatives are given. The conserved quantities at the quantum level for some local and non-local transformation are found respectively

8. Non-locality of non-Abelian anyons

International Nuclear Information System (INIS)

Brennen, G K; Iblisdir, S; Pachos, J K; Slingerland, J K

2009-01-01

Entangled states of quantum systems can give rise to measurement correlations of separated observers that cannot be described by local hidden variable theories. Usually, it is assumed that entanglement between particles is generated due to some distance-dependent interaction. Yet anyonic particles in two dimensions have a nontrivial interaction that is purely topological in nature. In other words, it does not depend on the distance between two particles, but rather on their exchange history. The information encoded in anyons is inherently non-local even in the single subsystem level making the treatment of anyons non-conventional. We describe a protocol to reveal the non-locality of anyons in terms of correlations in the outcomes of measurements in two separated regions. This gives a clear operational measure of non-locality for anyonic states and it opens up the possibility to test Bell inequalities in quantum Hall liquids or spin lattices.

9. Non-locality of non-Abelian anyons

Science.gov (United States)

Brennen, G. K.; Iblisdir, S.; Pachos, J. K.; Slingerland, J. K.

2009-10-01

Entangled states of quantum systems can give rise to measurement correlations of separated observers that cannot be described by local hidden variable theories. Usually, it is assumed that entanglement between particles is generated due to some distance-dependent interaction. Yet anyonic particles in two dimensions have a nontrivial interaction that is purely topological in nature. In other words, it does not depend on the distance between two particles, but rather on their exchange history. The information encoded in anyons is inherently non-local even in the single subsystem level making the treatment of anyons non-conventional. We describe a protocol to reveal the non-locality of anyons in terms of correlations in the outcomes of measurements in two separated regions. This gives a clear operational measure of non-locality for anyonic states and it opens up the possibility to test Bell inequalities in quantum Hall liquids or spin lattices.

10. Guided SAR image despeckling with probabilistic non local weights

Science.gov (United States)

Gokul, Jithin; Nair, Madhu S.; Rajan, Jeny

2017-12-01

SAR images are generally corrupted by granular disturbances called speckle, which makes visual analysis and detail extraction a difficult task. Non Local despeckling techniques with probabilistic similarity has been a recent trend in SAR despeckling. To achieve effective speckle suppression without compromising detail preservation, we propose an improvement for the existing Generalized Guided Filter with Bayesian Non-Local Means (GGF-BNLM) method. The proposed method (Guided SAR Image Despeckling with Probabilistic Non Local Weights) replaces parametric constants based on heuristics in GGF-BNLM method with dynamically derived values based on the image statistics for weight computation. Proposed changes make GGF-BNLM method adaptive and as a result, significant improvement is achieved in terms of performance. Experimental analysis on SAR images shows excellent speckle reduction without compromising feature preservation when compared to GGF-BNLM method. Results are also compared with other state-of-the-art and classic SAR depseckling techniques to demonstrate the effectiveness of the proposed method.

11. Control of the current density profile with lower hybrid current drive on PBX-M

International Nuclear Information System (INIS)

Bell, R.E.; Bernabei, S.; Chu, T.K.; Gettelfinger, G.; Greenough, N.; Hatcher, R.; Ignat, D.; Jardin, S.; Kaita, R.; Kaye, S.; Kozub, T.; Kugel, H.; LeBlanc, B.; Okabayashi, M.; Paul, S.; Sauthoff, N.; Sesnic, S.; Sun, Y.; Takahashi, H.; Tighe, W.; Valeo, E.; von Goeler, S.; Jones, S.; Kesner, J.; Luckhardt, S.; Paoletti, F.; Levinton, F.; Timini, F.

1993-07-01

Lower hybrid current drive (LHCD) is being explored as a means to control the current density profile on PBX-M with the goal of raising the central safety factor q(O) to values of 1.5-2 to facilitate access to a full-volume second stable regime. Initial experiments have been conducted with up to 400 kW of 4.6 GHz LH power in circular and indented plasmas with modest parameters. A tangential-viewing two-dimensional hard x-ray imaging diagnostic has been used to observe the bremsstrahlung emission from the suprathermal electrons generated during LHCD. Hollow hard x-ray images have indicated off-axis localization of the driven current. A serious obstacle to the control of the current density profile with LHCD is the concomitant generation of MHD activity, which can seriously degrade the confinement of suprathermal electrons. By combining neutral beam injection with LHCD, an MHD-free condition has been obtained where q(O) is raised above 1

12. Propagation of the lower hybrid wave in a density fluctuating scrape-off layer (SOL)

International Nuclear Information System (INIS)

Madi, M; Peysson, Y; Decker, J; Kabalan, K Y

2015-01-01

The perturbation of the lower hybrid wave (LH) power spectrum by fluctuations of the plasma in the vicinity of the antenna is investigated by solving the full wave equation in a slab geometry using COMSOL Multiphysics®. The numerical model whose generality allows to study the effect of various types of fluctuations, including those with short characteristic wavelengths is validated against a coupling code in quiescent regimes. When electron density fluctuations along the toroidal direction are incorporated in the dielectric tensor over a thin perturbed layer in front of the grill, the power spectrum may be strongly modified from the antenna mouth to the plasma separatrix as the LH wave propagates. The diffraction effect by density fluctuations leads to the appearance of multiple satellite lobes with randomly varying positions and the averaged perturbation is found to be maximum for the Fourier components of the fluctuating spectrum in the vicinity of the launched LH wavelength. This highlights that fast toroidal inhomogeneities with short characteristics length scales in front of the grill may change significantly the initial LH power spectrum used in coupled ray-tracing and Fokker–Planck calculations. (paper)

13. Electrostatic lower hybrid waves excited by electromagnetic whistler mode waves scattering from planar magnetic-field-aligned plasma density irregularities

International Nuclear Information System (INIS)

Bell, T.F.; Ngo, H.D.

1990-01-01

Recent satellite observations demonstrate that high amplitude, short wavelength (5 m ≤ λ ≤ 100 m) electrostatic waves are commonly excited by electromagnetic whistler mode waves propagating in regions of the magnetosphere and topside ionosphere where small-scale magnetic-field-aligned plasma density irregularities are thought to exist. A new theoretical model of this phenomenon is presented, based upon passive linear scattering in a cold magnetoplasma. In this model the electrostatic waves are excited by linear mode coupling as the incident electromagnetic whistler mode waves scatter from the magnetic-field-aligned plasma density irregularities. The excited short wavelength waves are quasi-electrostatic whistler mode waves, a type of lower hybrid wave, whose wave normal lies near the whistler mode resonance cone where the wave refractive index becomes very large. The amplitude of the excited electrostatic lower hybrid waves is calculated for a wide range of values of input electromagnetic wave frequency, wave normal direction, electron plasma frequency, gyrofrequency, ion composition, and irregularity scale and density enhancement. Results indicate that high amplitude lower hybrid waves can be excited over a wide range of parameters for irregularity density enhancements as low as 5% whenever the scale of the irregularity is of the same order as the lower hybrid wavelength

14. Non-localized deformation in Cu−Zr multi-layer amorphous films under tension

Energy Technology Data Exchange (ETDEWEB)

Zhong, C. [International Center for New-Structured Materials (ICNSM), Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, and School of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Zhang, H. [International Center for New-Structured Materials (ICNSM), Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, and School of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Department of Chemical and Materials Engineering, University of Alberta, Edmonton, Alberta T6G 1H9 (Canada); Cao, Q.P.; Wang, X.D. [International Center for New-Structured Materials (ICNSM), Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, and School of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China); Zhang, D.X. [State Key Laboratory of Modern Optical Instrumentation, Zhejiang University, Hangzhou 310027 (China); Hu, J.W. [Hangzhou Workers Amateur University, Hangzhou 310027 (China); Liaw, P.K. [Department of Materials Science and Engineering, The University of Tennessee, Knoxville, TN 37996 (United States); Jiang, J.Z., E-mail: jiangjz@zju.edu.cn [International Center for New-Structured Materials (ICNSM), Laboratory of New-Structured Materials, State Key Laboratory of Silicon Materials, and School of Materials Science and Engineering, Zhejiang University, Hangzhou 310027 (China)

2016-09-05

In metallic glasses (MGs), plastic deformation at room temperature is dominated by highly localized shear bands. Here we report the non-localized deformation under tension in Cu−Zr multi-layer MGs with a pure amorphous structure using large-scale atomistic simulations. It is demonstrated that amorphous samples with high layer numbers, composed of Cu{sub 64}Zr{sub 36} and Cu{sub 40}Zr{sub 60}, or Cu{sub 64}Zr{sub 36} and Cu{sub 50}Zr{sub 50}, present obviously non-localized deformation behavior. We reveal that the deformation behavior of the multi-layer-structured MG films is related but not determined by the deformation behavior of the composed individual layers. The criterion for the deformation mode change for MGs with a pure amorphous structure, in generally, was suggested, i.e., the competition between the elastic-energy density stored and the energy density needed for forming one mature shear band in MGs. Our results provide a promising strategy for designing tensile ductile MGs with a pure amorphous structure at room temperature. - Highlights: • Tensile deformation behaviors in multi-layer MG films. • Films with high layer numbers confirmed with a non-localized deformation behavior. • The deformation mode is reasonably controlled by whether U{sub p} larger than U{sub SB.}.

15. 'Non-local' response of RTP ohmic plasmas to peripheral perturbations

International Nuclear Information System (INIS)

Galli, P.; Gorini, G.; Mantica, P.; Hogeweij, G.M.D.; Kloe, J. de; Lopes Cardozo, N.J.

1999-01-01

A 'non-local' response of the plasma core triggered by peripheral plasma perturbations other than laser ablation is found in the RTP tokamak. Oblique pellet injection (OPI) has been used to induce fast cooling of the peripheral plasma. In response, an inward cold pulse (T e drop) and a slightly delayed core T e rise are observed. A somewhat similar 'non-local' response is observed when the peripheral plasma is heated by modulated electron cyclotron heating or by fast current ramps, i.e. the core temperature drops in response to the peripheral heating. The plasma conditions for the occurrence of the 'non-local' response have been investigated. The core T e rise following OPI is associated with the formation of a large temperature gradient in the region 1 e rise is largest at low electron density and for large pellet deposition radii. Above a critical density the T e rise disappears and only the (weaker) drop in core T e is observed. Time dependent transport simulations show that the propagation of the inward cold pulse is consistent with local transport, while the core T e rise is a slower phenomenon requiring a large transient drop of χ e in the region 1 < q < 2. (author)

16. Optimizing hill seeding density for high-yielding hybrid rice in a single rice cropping system in South China.

Directory of Open Access Journals (Sweden)

Danying Wang

Full Text Available Mechanical hill direct seeding of hybrid rice could be the way to solve the problems of high seeding rates and uneven plant establishment now faced in direct seeded rice; however, it is not clear what the optimum hill seeding density should be for high-yielding hybrid rice in the single-season rice production system. Experiments were conducted in 2010 and 2011 to determine the effects of hill seeding density (25 cm×15 cm, 25 cm×17 cm, 25 cm×19 cm, 25 cm×21 cm, and 25 cm×23 cm; three to five seeds per hill on plant growth and grain yield of a hybrid variety, Nei2you6, in two fields with different fertility (soil fertility 1 and 2. In addition, in 2012 and 2013, comparisons among mechanical hill seeding, broadcasting, and transplanting were conducted with three hybrid varieties to evaluate the optimum seeding density. With increases in seeding spacing from 25 cm×15 cm to 25 cm×23 cm, productive tillers per hill increased by 34.2% and 50.0% in soil fertility 1 and 2. Panicles per m2 declined with increases in seeding spacing in soil fertility 1. In soil fertility 2, no difference in panicles per m2 was found at spacing ranging from 25 cm×17 cm to 25 cm×23 cm, while decreases in the area of the top three leaves and aboveground dry weight per shoot at flowering were observed. Grain yield was the maximum at 25 cm×17 cm spacing in both soil fertility fields. Our results suggest that a seeding density of 25 cm×17 cm was suitable for high-yielding hybrid rice. These results were verified through on-farm demonstration experiments, in which mechanical hill-seeded rice at this density had equal or higher grain yield than transplanted rice.

17. Non-local model analysis of heat pulse propagation

International Nuclear Information System (INIS)

Iwasaki, Takuya; Itoh, Sanae-I.; Yagi, Masatoshi

1998-01-01

A new theoretical model equation which includes the non-local effect in the heat flux is proposed to study the transient transport phenomena. A non-local heat flux, which is expressed in terms of the integral equation, is superimposed on the conventional form of the heat flux. This model is applied to describe the experimental results from the power switching [Stroth U, et al 1996 Plasma Phys. Control. Fusion 38 1087] and the power modulation experiments [Giannone L, et al 1992 Nucl. Fusion 32 1985] in the W7-AS stellarator. A small fraction of non-local component in the heat flux is found to be very effective in modifying the response against an external modulation. The transient feature of the transport property, which are observed in the response of heat pulse propagation, are qualitatively reproduced by the transport simulations based on this model. A possibility is discussed to determine the correlation length of the non-local effect experimentally by use of the results of transport simulations. (author)

18. Quantum non-locality vs. quasi-local measurements in the conditions of the Aharonov-Bohm effect

International Nuclear Information System (INIS)

Gulian, Armen M

2014-01-01

Theoretical explanation of the Meissner effect involves proportionality between current density and vector potential, which has many deep consequences. As noticed by de Gennes, superconductors in a magnetic field 'find an equilibrium state where the sum of kinetic and magnetic energies is minimum' and this state 'corresponds to the expulsion of the magnetic field'. This statement still leaves an open question: from which source is the superconducting current acquiring its kinetic energy? A naïve answer, perhaps, is from the energy of the magnetic field. However, one can consider situations (Aharonov-Bohm effect), where the classical magnetic field is locally absent in the area occupied by the current. Experiments demonstrate that despite the local absence of the magnetic field, current is, nevertheless, building up. From what source is it acquiring its energy then? Locally, only a vector potential is present. How does the vector potential facilitate the formation of the current? Is the current formation a result of a truly non-local quantum action, or does the local action of the vector potential have experimental consequences? We discuss possible experiments with a hybrid normal-metal superconductor circuitry, which can clarify this puzzling situation. Experimental answers will be important for further developments.

19. Lower hybrid current drive for edge current density modification in DIII-D: Final status report

International Nuclear Information System (INIS)

Fenstermacher, M.E.; Porkolab, M.

1993-01-01

Application of Lower Hybrid (LH) Current Drive (CD) in the DIII-D tokamak has been studied at LLNL, off and on, for several years. The latest effort began in February 1992 in response to a letter from ASDEX indicating that the 2.45 GHz, 3 MW system there was available to be used on another device. An initial assessment of the possible uses for such a system on DIII-D was made and documented in September 1992. Multiple meetings with GA personnel and members of the LH community nationwide have occurred since that time. The work continued through the submission of the 1995 Field Work Proposals in March 1993 and was then put on hold due to budget limitations. The purpose of this document is to record the status of the work in such a way that it could fairly easily be restarted at a future date. This document will take the form of a collection of Appendices giving both background and the latest results from the FY 1993 work, connected by brief descriptive text. Section 2 will describe the final workshop on LHCD in DIII-D held at GA in February 1993. This was an open meeting with attendees from GA, LLNL, MIT and PPPL. Summary documents from the meeting and subsequent papers describing the results will be included in Appendices. Section 3 will describe the status of work on the use of low frequency (2.45 GHZ) LH power and Parametric Decay Instabilities (PDI) for the special case of high dielectric in the edge regions of the DIII-D plasma. This was one of the critical issues identified at the workshop. Other potential issues for LHCD in the DIII-D scenarios are: (1) damping of the waves on fast ions from neutral beam injection, (2) runaway electrons in the low density edge plasma, (3) the validity of the WKB approximation used in the ray-tracing models in the steep edge density gradients

20. Experimental investigation of density behaviors in front of the lower hybrid launcher in experimental advanced superconducting tokamak

International Nuclear Information System (INIS)

Zhang, L.; Ding, B. J.; Li, M. H.; Kong, E. H.; Wei, W.; Liu, F. K.; Shan, J. F.; Wu, Z. G.; Zhu, L.; Ma, W. D.; Tong, Y. Y.; Li, Y. C.; Wang, M.; Zhao, L. M.; Hu, H. C.; Liu, L.

2013-01-01

A triple Langmuir probe is mounted on the top of the Lower Hybrid (LH) antenna to measure the electron density near the LH grills in Experimental Advanced Superconducting Tokamak. In this work, the LH power density ranges from 2.3 MWm −2 to 10.3 MWm −2 and the rate of puffing gas varies from 1.7 × 10 20 el/s to 14 × 10 20 el/s. The relation between the edge density (from 0.3 × n e-cutoff to 20 × n e-cutoff , where n e-cutoff is the cutoff density, n e-cutoff = 0.74 × 10 17 m −3 for 2.45 GHz lower hybrid current drive) near the LH grill and the LH power reflection coefficients is investigated. The factors, including the gap between the LH grills and the last closed magnetic flux surface, line-averaged density, LH power, edge safety factor, and gas puffing, are analyzed. The experiments show that injection of LH power is beneficial for increasing edge density. Gas puffing is beneficial for increasing grill density but excess gas puffing is unfavorable for coupling and current drive

1. Rare earth substitutional impurities in germanium: A hybrid density functional theory study

Science.gov (United States)

Igumbor, E.; Omotoso, E.; Tunhuma, S. M.; Danga, H. T.; Meyer, W. E.

2017-10-01

The Heyd, Scuseria, and Ernzerhof (HSE06) hybrid functional by means of density functional theory has been used to model the electronic and structural properties of rare earth (RE) substitutional impurities in germanium (REGe) . The formation and charge state transition energies for the REGe (RE = Ce, Pr, Er and Eu) were calculated. The energy of formation for the neutral charge state of the REGe lies between -0.14 and 3.13 eV. The formation energy result shows that the Pr dopant in Ge (PrGe) has the lowest formation energy of -0.14 eV, and is most energetically favourable under equilibrium conditions. The REGe induced charge state transition levels within the band gap of Ge. Shallow acceptor levels were induced by both the Eu (EuGe) and Pr (PrGe) dopants in Ge. The CeGe and ErGe exhibited properties of negative-U ordering with effective-U values of -0.85 and -1.07 eV, respectively.

2. A neural network detection system for lower-hybrid cavities in electron plasma density measured by the FREJA satellite

International Nuclear Information System (INIS)

Waldemark, J.; Karlsson, Jan

1995-03-01

This paper presents a lower-hybrid cavity detection system, CDS, for measurements of electron plasma density on the FREJA satellite wave experiment. The system can reduce the amount of data to be analysed by as much as 96% and still retain more than 85% of the desired information. The CDS is a combination of a hybrid neural network, HNN and expert rules. The HNN is a Self Organizing Map, SOM, combined with a feed forward back propagation neural net, BP. The CDS can be controlled by the user to operate with various degrees of sensitivity. Maximum detection capability is as high as 95% with data reduction lowered to 85%. 10 refs

3. Stability issues of black hole in non-local gravity

Science.gov (United States)

Myung, Yun Soo; Park, Young-Jai

2018-04-01

We discuss stability issues of Schwarzschild black hole in non-local gravity. It is shown that the stability analysis of black hole for the unitary and renormalizable non-local gravity with γ2 = - 2γ0 cannot be performed in the Lichnerowicz operator approach. On the other hand, for the unitary and non-renormalizable case with γ2 = 0, the black hole is stable against the metric perturbations. For non-unitary and renormalizable local gravity with γ2 = - 2γ0 = const (fourth-order gravity), the small black holes are unstable against the metric perturbations. This implies that what makes the problem difficult in stability analysis of black hole is the simultaneous requirement of unitarity and renormalizability around the Minkowski spacetime.

4. Generalized ward identities for non-local transformation

International Nuclear Information System (INIS)

Li Ziping; Li Ruijie

2002-01-01

Based on the phase-space generating functional of Green function for a system with a singular higher-order Lagrangian, the generalized canonical Ward identities under the local and non-local transformation in phase space for such a system have been derived. Starting from the configuration-space generating functional for a gauge-invariant system, the generalized Ward identities were deduced under the local, non-local and global transformation, respectively. The applications to the non-Abelian Chern-Simons theories with higher derivatives were given. Some relationships among the proper vertices have been deduced, in which one does not need to carry out the integration over canonical momenta in phase-space generating functional. The Ward-Takahashi identities for BRS transformation are also obtained

5. On non local elasticity and its relation with lattice dynamics

International Nuclear Information System (INIS)

Idiodi, J.O.A.

1984-11-01

In this paper we have modelled a three-dimensional discrete lattice by a nonlocal continuum which possesses dispersive phonons. Previous efforts in the development of non-local theories appear not to have paid much attention to establishing actual contact with the nontrivial models frequently employed in lattice dynamics. As a first attempt in this direction, we present in this paper explicit results for the form of a non-local stress-tensor that describes exactly the lattice dynamical model of Gazis, Herman and Wallis. This model takes into account angular stiffness forces involving consecutive nearest neighbours forming a right angle at equilibrium. In addition, a general result for the surface eigenmodes of a semi-finite isotropic medium is derived. One of the justifications for this kind of study is the simpler approach it offers to the problems of interest in lattice dynamics. (author)

6. Cosmological perturbations in non-local higher-derivative gravity

International Nuclear Information System (INIS)

Craps, Ben; Jonckheere, Tim De; Koshelev, Alexey S.

2014-01-01

We study cosmological perturbations in a non-local higher-derivative model of gravity introduced by Biswas, Mazumdar and Siegel. We extend previous work, which had focused on classical scalar perturbations around a cosine hyperbolic bounce solution, in three ways. First, we point out the existence of a Starobinsky solution in this model, which is more attractive from a phenomenological point of view (even though it has no bounce). Second, we study classical vector and tensor pertuxsxrbations. Third, we show how to quantize scalar and tensor perturbations in a de Sitter phase (for choices of parameters such that the model is ghost-free). Our results show that the model is well-behaved at this level, and are very similar to corresponding results in local f(R) models. In particular, for the Starobinsky solution of non-local higher-derivative gravity, we find the same tensor-to-scalar ratio as for the conventional Starobinsky model

7. An asymmetric supercapacitor with ultrahigh energy density based on nickle cobalt sulfide nanocluster anchoring multi-wall carbon nanotubes hybrid

Science.gov (United States)

Wen, Ping; Fan, Mingjin; Yang, Desuo; Wang, Yan; Cheng, Hualei; Wang, Jinqing

2016-07-01

The development of novel electrode materials with high energy density and long cycling life is critical to realize electrochemical capacitive energy storage for practical applications. In this paper, the hybrids of nickle cobalt sulfide/multi-wall carbon nanotubes (NiCo2S4/MWCNTs) with different contents of MWCNTs are prepared using a facile one-pot solvothermal reaction. As novel active materials for supercapacitors, the electrochemistry tests show that the hybrid of NiCo2S4/MWCNTs-5 is able to deliver a high specific capacitance of 2080 F g-1 at the current density of 1 A g-1, even superior rate capability of 61% capacitance retention after a 20-fold increase in current densities, when the content of MWCNTs is up to 5%. More importantly, an asymmetric supercapacitor assembled by NiCo2S4/MWCNTs-5 as positive electrode and reduced graphene oxide (rGO) as negative electrode delivers a high energy density of 51.8 Wh Kg-1 at a power density of 865 W kg-1, and 85.7% of its initial capacitance is retained at the current density of 4 A g-1 after 5000 charge-discharge cycles, exhibiting potential prospect for practical applications.

8. Multiple-Trace Operators and Non-Local String Theories

International Nuclear Information System (INIS)

Silverstein, Eva M.

2001-01-01

We propose that a novel deformation of string perturbation theory, involving non-local interactions between strings, is required to describe the gravity duals of field theories deformed by multiple-trace operators. The new perturbative expansion involves a new parameter, which is neither the string coupling nor the coefficient of a vertex operator on the worldsheet. We explore some of the properties of this deformation, focusing on a special case where the deformation in the field theory is exactly marginal

9. Ground state solutions for non-local fractional Schrodinger equations

Directory of Open Access Journals (Sweden)

Yang Pu

2015-08-01

Full Text Available In this article, we study a time-independent fractional Schrodinger equation with non-local (regional diffusion $$(-\\Delta^{\\alpha}_{\\rho}u + V(xu = f(x,u \\quad \\text{in }\\mathbb{R}^{N},$$ where $\\alpha \\in (0,1$, $N > 2\\alpha$. We establish the existence of a non-negative ground state solution by variational methods.

10. Non-local deformation of a supersymmetric field theory

Energy Technology Data Exchange (ETDEWEB)

Zhao, Qin [National University of Singapore, Department of Physics, Singapore (Singapore); Faizal, Mir [University of Lethbridge, Department of Physics and Astronomy, Lethbridge (Canada); University of British Columbia - Okanagan, Irving K. Barber School of Arts and Sciences, Kelowna, BC (Canada); Shah, Mushtaq B.; Ganai, Prince A. [National Institute of Technology, Department of Physics, Srinagar, Kashmir (India); Bhat, Anha [National Institute of Technology, Department of Metallurgical and Materials Engineering, Srinagar (India); Zaz, Zaid [University of Kashmir, Department of Electronics and Communication Engineering, Srinagar, Kashmir (India); Masood, Syed; Raza, Jamil; Irfan, Raja Muhammad [International Islamic University, Department of Physics, Islamabad (Pakistan)

2017-09-15

In this paper, we will analyze a supersymmetric field theory deformed by generalized uncertainty principle and Lifshitz scaling. It will be observed that this deformed supersymmetric field theory contains non-local fractional derivative terms. In order to construct such a deformed N = 1 supersymmetric theory, a harmonic extension of functions will be used. However, the supersymmetry will only be preserved for a free theory and will be broken by the inclusion of interaction terms. (orig.)

11. Non-local gravity with a Weyl-square term

CERN Document Server

Cusin, Giulia; Maggiore, Michele; Mancarella, Michele

2016-01-01

Recent work has shown that modifications of General Relativity based on the addition of a non-local term $R\\,\\Box^{-2}R$ produce a dynamical model of dark energy, which is cosmologically viable both at the background level and at the level of cosmological perturbations. We explore a more general class of models based on the addition of terms proportional to R_{\\mu\ 12. Critical thresholds in flocking hydrodynamics with non-local alignment. Science.gov (United States) Tadmor, Eitan; Tan, Changhui 2014-11-13 We study the large-time behaviour of Eulerian systems augmented with non-local alignment. Such systems arise as hydrodynamic descriptions of agent-based models for self-organized dynamics, e.g. Cucker & Smale (2007 IEEE Trans. Autom. Control 52, 852-862. (doi:10.1109/TAC.2007.895842)) and Motsch & Tadmor (2011 J. Stat. Phys. 144, 923-947. (doi:10.1007/s10955-011-0285-9)) models. We prove that, in analogy with the agent-based models, the presence of non-local alignment enforces strong solutions to self-organize into a macroscopic flock. This then raises the question of existence of such strong solutions. We address this question in one- and two-dimensional set-ups, proving global regularity for subcritical initial data. Indeed, we show that there exist critical thresholds in the phase space of the initial configuration which dictate the global regularity versus a finite-time blow-up. In particular, we explore the regularity of non-local alignment in the presence of vacuum. © 2014 The Author(s) Published by the Royal Society. All rights reserved. 13. Axonal diameter and density estimated with 7-Tesla hybrid diffusion imaging in transgenic Alzheimer rats Science.gov (United States) Daianu, Madelaine; Jacobs, Russell E.; Town, Terrence; Thompson, Paul M. 2016-03-01 Diffusion-weighted MR imaging (DWI) is a powerful tool to study brain tissue microstructure. DWI is sensitive to subtle changes in the white matter (WM), and can provide insight into abnormal brain changes in diseases such as Alzheimer's disease (AD). In this study, we used 7-Tesla hybrid diffusion imaging (HYDI) to scan 3 transgenic rats (line TgF344-AD; that model the full clinico-pathological spectrum of the human disease) ex vivo at 10, 15 and 24 months. We acquired 300 DWI volumes across 5 q-sampling shells (b=1000, 3000, 4000, 8000, 12000 s/mm2). From the top three b-value shells with highest signal-to-noise ratios, we reconstructed markers of WM disease, including indices of axon density and diameter in the corpus callosum (CC) - directly quantifying processes that occur in AD. As expected, apparent anisotropy progressively decreased with age; there were also decreases in the intra- and extra-axonal MR signal along axons. Axonal diameters were larger in segments of the CC (splenium and body, but not genu), possibly indicating neuritic dystrophy - characterized by enlarged axons and dendrites as previously observed at the ultrastructural level (see Cohen et al., J. Neurosci. 2013). This was further supported by increases in MR signals trapped in glial cells, CSF and possibly other small compartments in WM structures. Finally, tractography detected fewer fibers in the CC at 10 versus 24 months of age. These novel findings offer great potential to provide technical and scientific insight into the biology of brain disease. 14. Density Functional Theory Simulations of Semiconductors for Photovoltaic Applications: Hybrid Organic-Inorganic Perovskites and III/V Heterostructures Directory of Open Access Journals (Sweden) Jacky Even 2014-01-01 Full Text Available Potentialities of density functional theory (DFT based methodologies are explored for photovoltaic materials through the modeling of the structural and optoelectronic properties of semiconductor hybrid organic-inorganic perovskites and GaAs/GaP heterostructures. They show how the properties of these bulk materials, as well as atomistic relaxations, interfaces, and electronic band-lineups in small heterostructures, can be thoroughly investigated. Some limitations of available standard DFT codes are discussed. Recent improvements able to treat many-body effects or based on density-functional perturbation theory are also reviewed in the context of issues relevant to photovoltaic technologies. 15. Functionalized carbon nanotube based hybrid electrochemical capacitors using neutral bromide redox-active electrolyte for enhancing energy density Science.gov (United States) Tang, Xiaohui; Lui, Yu Hui; Chen, Bolin; Hu, Shan 2017-06-01 A hybrid electrochemical capacitor (EC) with enhanced energy density is realized by integrating functionalized carbon nanotube (FCNT) electrodes with redox-active electrolyte that has a neutral pH value (1 M Na2SO4 and 0.5 M KBr mixed aqueous solution). The negative electrode shows an electric double layer capacitor-type behavior. On the positive electrode, highly reversible Br-/Br3- redox reactions take place, presenting a battery-type behavior, which contributes to increase the capacitance of the hybrid cell. The voltage window of the whole cell is extended up to 1.5 V because of the high over-potentials of oxygen and hydrogen evolution reactions in the neutral electrolyte. Compared with raw CNT, the FCNT has better wettability in the aqueous electrolyte and contributes to increase the electric double layer capacitance of the cell. As a result, the maximum energy density of 28.3 Wh kg-1 is obtained from the hybrid EC at 0.5 A g-1 without sacrificing its power density, which is around 4 times larger than that of the electrical double layer capacitor constructed by FCNT electrodes and 1 M Na2SO4 electrolyte. Moreover, the discharge capacity retained 86.3% of its initial performance after 10000 cycles of galvanostatic charge and discharge test (10 A/g), suggesting its long life cycle even at high current loading. 16. Diallel analyze of yield and progress of the severity of leaf diseases in maize hybrids in two population density Directory of Open Access Journals (Sweden) Marcos Ventura Faria 2015-02-01 Full Text Available Seven commercial maize hybrids (AS1575, 2B688, Penta, GNZ2004, AG8021, Sprint e P30F53 were intercrossed in a complete diallel, excluded reciprocal, obtaining 21 crosses. The 28 treatments were evaluated in two environments characterized by different densities (62,500 and 90,000 plants ha-1, with the aim of selecting the most promising parents for generating base population to obtain lines. Two experiments were carried out in Guarapuava-PR, at randomized block design with three replications. We estimated the general (GCA and specific (SCA combining abilities for yield and disease severity assessed by the area under the common rust (Puccinia sorghi progress curve (AURPC and the area under the leaf spot (Cercospora zeae-maydis progress curve (AULPC. The effects of GCA and SCA were significant for grain yield and diseases severity in both densities, revealing the importance of both additive and non-additive effects. There GCA x densities interaction was significant only for grain yield. Crossings P30F53 x AG8021 and P30F53 x Penta had negative estimates of SCA for AURPC and AULPC on the environments average. Hybrids GNZ 2004 and P30F53 stood out showing positive GCA for grain yield and negative for AURPC and AULPC in both densities and therefore are recommended for generating base populations for obtaining lines adapted for both densities, conventional and denser plantings, given the current trends in management of maize. 17. A space-jump derivation for non-local models of cell-cell adhesion and non-local chemotaxis. Science.gov (United States) Buttenschön, Andreas; Hillen, Thomas; Gerisch, Alf; Painter, Kevin J 2018-01-01 Cellular adhesion provides one of the fundamental forms of biological interaction between cells and their surroundings, yet the continuum modelling of cellular adhesion has remained mathematically challenging. In 2006, Armstrong et al. proposed a mathematical model in the form of an integro-partial differential equation. Although successful in applications, a derivation from an underlying stochastic random walk has remained elusive. In this work we develop a framework by which non-local models can be derived from a space-jump process. We show how the notions of motility and a cell polarization vector can be naturally included. With this derivation we are able to include microscopic biological properties into the model. We show that particular choices yield the original Armstrong model, while others lead to more general models, including a doubly non-local adhesion model and non-local chemotaxis models. Finally, we use random walk simulations to confirm that the corresponding continuum model represents the mean field behaviour of the stochastic random walk. 18. Scattering of lower-hybrid waves by drift-wave density fluctuations: solutions of the radiative transfer equation International Nuclear Information System (INIS) Andrews, P.L.; Perkins, F.W. 1983-01-01 The investigation of the scattering of lower-hybrid waves by density fluctuations arising from drift waves in tokamaks is distinguished by the presence in the wave equation of a large, random, derivative-coupling term. The propagation of the lower-hybrid waves is well represented by a radiative transfer equation when the scale size of the density fluctuations is small compared to the overall plasma size. The radiative transfer equation is solved in two limits: first, the forward scattering limit, where the scale size of density fluctuations is large compared to the lower-hybrid perpendicular wavelength, and second, the large-angle scattering limit, where this inequality is reversed. The most important features of these solutions are well represented by analytical formulas derived by simple arguments. Based on conventional estimates for density fluctuations arising from drift waves and a parabolic density profile, the optical depth tau for scattering through a significant angle, is given by tauroughly-equal(2/N 2 /sub parallel/) (#betta#/sub p/i0/#betta#) 2 (m/sub e/c 2 /2T/sub i/)/sup 1/2/ [c/α(Ω/sub i/Ω/sub e/)/sup 1/2/ ], where #betta#/sub p/i0 is the central ion plasma frequency and T/sub i/ denotes the ion temperature near the edge of the plasma. Most of the scattering occurs near the surface. The transmission through the scattering region scales as tau - 1 and the emerging intensity has an angular spectrum proportional to cos theta, where sin theta = k/sub perpendicular/xB/sub p//(k/sub perpendicular/B/sub p/), and B/sub p/ is the poloidal field 19. Towards a test of non-locality without 'supplementary assumptions' International Nuclear Information System (INIS) Barbieri, M.; De Martini, F.; Di Nepi, G.; Mataloni, P. 2005-01-01 We have experimentally tested the non-local properties of the two-photon states generated by a high brilliance source of entanglement which virtually allows the direct measurement of the full set of photon pairs created by the basic QED process implied by the parametric quantum scattering. Standard Bell measurements and Bell's inequality violation test have been realized over the entire cone of emission of the degenerate pairs. By the same source we have verified Hardy's ladder theory up to the 20th step and the contradiction between the standard quantum theory and the local realism has been tested for 41% of entangled pairs 20. Non-local quasi-linear parabolic equations International Nuclear Information System (INIS) Amann, H 2005-01-01 This is a survey of the most common approaches to quasi-linear parabolic evolution equations, a discussion of their advantages and drawbacks, and a presentation of an entirely new approach based on maximal L p regularity. The general results here apply, above all, to parabolic initial-boundary value problems that are non-local in time. This is illustrated by indicating their relevance for quasi-linear parabolic equations with memory and, in particular, for time-regularized versions of the Perona-Malik equation of image processing 1. Density Functional Theory applied to magnetic materials: Mn{sub 3}O{sub 4} at different hybrid functionals Energy Technology Data Exchange (ETDEWEB) Ribeiro, R.A.P. [Department of Chemistry, State University of Ponta Grossa, Av. General Carlos Cavalcanti, 4748, 84030-900 Ponta Grossa, PR (Brazil); Lazaro, S.R. de, E-mail: srlazaro@upeg.br [Department of Chemistry, State University of Ponta Grossa, Av. General Carlos Cavalcanti, 4748, 84030-900 Ponta Grossa, PR (Brazil); Pianaro, S.A. [Department of Materials Engineering, State University of Ponta Grossa, Av. General Carlos Cavalcanti, 4748, 84030-900 Ponta Grossa, PR (Brazil) 2015-10-01 Antiferromagnetic Mn{sub 3}O{sub 4} in spinel structure was investigated employing the Density Functional Theory at different hybrid functionals with default HF exchange percentage. Structural, electronic and magnetic properties were examined. Structural results were in agreement with experimental and Hartree–Fock results showing that the octahedral site was distorted by the Jahn–Teller effect, which changed the electron density distribution. Band-gap results for B3LYP and B3PW hybrid functionals were closer to the experimental when compared to PBE0. Mulliken Population Analysis revealed magnetic moments very close to ideal d{sup 4} and d{sup 5} electron configurations of Mn{sup 3+} and Mn{sup 2+}, respectively. Electron density maps are useful to determine that oxygen atoms mediate the electron transfer between octahedral and tetrahedral clusters. Magnetic properties were investigated from theoretical results for exchange coupling constants. Intratetrahedral and tetra-octahedral interactions were observed to be antiferromagnetic, whereas, octahedral sites presented antiferromagnetic interactions in the same layer and ferromagnetic in adjacent layers. Results showed that only default B3LYP was successful to describe magnetic properties of antiferromagnetic materials in agreement with experimental results. - Highlights: • We study structural, electronic and magnetic properties of antiferromagnetic Mn{sub 3}O{sub 4}. • B3LYP, B3PW and PBE0 hybrid functionals are compared. • B3LYP and B3PW hybrid functionals are better to band-gap calculations. • Only default B3LYP was successful to describe exchange interactions for Mn{sub 3}O{sub 4}. 2. An efficient method for hybrid density functional calculation with spin-orbit coupling Science.gov (United States) Wang, Maoyuan; Liu, Gui-Bin; Guo, Hong; Yao, Yugui 2018-03-01 In first-principles calculations, hybrid functional is often used to improve accuracy from local exchange correlation functionals. A drawback is that evaluating the hybrid functional needs significantly more computing effort. When spin-orbit coupling (SOC) is taken into account, the non-collinear spin structure increases computing effort by at least eight times. As a result, hybrid functional calculations with SOC are intractable in most cases. In this paper, we present an approximate solution to this problem by developing an efficient method based on a mixed linear combination of atomic orbital (LCAO) scheme. We demonstrate the power of this method using several examples and we show that the results compare very well with those of direct hybrid functional calculations with SOC, yet the method only requires a computing effort similar to that without SOC. The presented technique provides a good balance between computing efficiency and accuracy, and it can be extended to magnetic materials. 3. Hybrid density functional study on the mechanism for the enhanced photocatalytic properties of the ultrathin hybrid layered nanocomposite g-C3N4/BiOCl Science.gov (United States) Yao, Wenzhi; Zhang, Jihua; Wang, Yuanxu; Ren, Fengzhu 2018-03-01 To investigate the origin of the high photocatalytic performance of experimentally synthesized g-C3N4/ BiOCl, we studied its geometry structure, electronic structure, and photocatalytic properties by means of hybrid density-functional theory (DFT). The calculated band alignment of g-C3N4 and few-layer BiOCl sheets clearly shows that g-C3N4/ BiOCl is a standard type-II nanocomposite. The density of states, Bader charge, partial charge density, charge density difference, and the effective masses show that electron-hole pair can be effectively separated in the g-C3N4/BiOCl interface. The calculated absorption coefficients indicate an obvious redshift of the absorption edge. The band gap of g-C3N4/BiOCl can be modulated by external electric field, and a semiconductor-semimetal transition is observed. The type-II vdW heterostructure is still maintained during the changes of external electric field. Especially, when the electric field reaches to +0.7 V/Å, the impurity states have been eliminated with the band gap of 2.3 eV. An analysis of optical properties shows that the absorption coefficient in the visible-light region is enhanced considerably as the electric-field strength increases. Our calculation results suggest that the ultrathin hybrid layered g-C3N4/BiOCl nanocomposite may have significant advantages for visible-light photocatalysis. 4. An open-source framework for analyzing N-electron dynamics. II. Hybrid density functional theory/configuration interaction methodology. Science.gov (United States) Hermann, Gunter; Pohl, Vincent; Tremblay, Jean Christophe 2017-10-30 In this contribution, we extend our framework for analyzing and visualizing correlated many-electron dynamics to non-variational, highly scalable electronic structure method. Specifically, an explicitly time-dependent electronic wave packet is written as a linear combination of N-electron wave functions at the configuration interaction singles (CIS) level, which are obtained from a reference time-dependent density functional theory (TDDFT) calculation. The procedure is implemented in the open-source Python program detCI@ORBKIT, which extends the capabilities of our recently published post-processing toolbox (Hermann et al., J. Comput. Chem. 2016, 37, 1511). From the output of standard quantum chemistry packages using atom-centered Gaussian-type basis functions, the framework exploits the multideterminental structure of the hybrid TDDFT/CIS wave packet to compute fundamental one-electron quantities such as difference electronic densities, transient electronic flux densities, and transition dipole moments. The hybrid scheme is benchmarked against wave function data for the laser-driven state selective excitation in LiH. It is shown that all features of the electron dynamics are in good quantitative agreement with the higher-level method provided a judicious choice of functional is made. Broadband excitation of a medium-sized organic chromophore further demonstrates the scalability of the method. In addition, the time-dependent flux densities unravel the mechanistic details of the simulated charge migration process at a glance. © 2017 Wiley Periodicals, Inc. © 2017 Wiley Periodicals, Inc. 5. Effect of non-local equilibrium on minimal thermal resistance porous layered systems International Nuclear Information System (INIS) Leblond, Genevieve; Gosselin, Louis 2008-01-01 In this paper, the cooling of a heat-generating surface by a stacking of porous media (e.g., metallic foam) through which fluid flows parallel to the surface is considered. A two-temperature model is proposed to account for non-local thermal equilibrium (non-LTE). A scale analysis is performed to determine temperatures profiles in the boundary layer regime. The hot spot temperature is minimized with respect to the three design variables of each layer: porosity, pore diameter, and material. Global cost and mass are constrained. The optimization is performed with a hybrid genetic algorithm (GA) including local search to enhance convergence and repeatability. Results demonstrate that the optimized stacks do not operate in LTE. Therefore, we show that assuming LTE might result in underestimation of the hot spot temperature, and into different final designs as well 6. A non-local computational boundary condition for duct acoustics Science.gov (United States) Zorumski, William E.; Watson, Willie R.; Hodge, Steve L. 1994-01-01 A non-local boundary condition is formulated for acoustic waves in ducts without flow. The ducts are two dimensional with constant area, but with variable impedance wall lining. Extension of the formulation to three dimensional and variable area ducts is straightforward in principle, but requires significantly more computation. The boundary condition simulates a nonreflecting wave field in an infinite duct. It is implemented by a constant matrix operator which is applied at the boundary of the computational domain. An efficient computational solution scheme is developed which allows calculations for high frequencies and long duct lengths. This computational solution utilizes the boundary condition to limit the computational space while preserving the radiation boundary condition. The boundary condition is tested for several sources. It is demonstrated that the boundary condition can be applied close to the sound sources, rendering the computational domain small. Computational solutions with the new non-local boundary condition are shown to be consistent with the known solutions for nonreflecting wavefields in an infinite uniform duct. 7. Gauge unification, non-local breaking, open strings International Nuclear Information System (INIS) Trapletti, M. 2005-01-01 The issue of non-local GUT symmetry breaking is addressed in the context of open string model building. We study Z N xZ M ' orbifolds with all the GUT-breaking orbifold elements acting freely, as rotations accompanied by translations in the internal space. We consider open strings quantized on these backgrounds, distinguishing whether the translational action is parallel or perpendicular to the D-branes. GUT breaking is impossible in the purely perpendicular case, non-local GUT breaking is instead allowed in the purely parallel case. In the latter, the scale of breaking is set by the compactification moduli, and there are no fixed points with reduced gauge symmetry, where dangerous explicit GUT-breaking terms could be located. We investigate the mixed parallel+perpendicular case in a Z 2 xZ 2 ' example, having also a simplified field theory realization. It is a new S 1 /Z 2 xZ 2 ' orbifold-GUT model, with bulk gauge symmetry SU(5)xSU(5) broken locally to the Standard Model gauge group. In spite of the locality of the GUT symmetry breaking, there is no localized contribution to the running of the coupling constants, and the unification scale is completely set by the length of S 1 8. A comparison of non-local electron transport models relevant to inertial confinement fusion Science.gov (United States) Sherlock, Mark; Brodrick, Jonathan; Ridgers, Christopher 2017-10-01 We compare the reduced non-local electron transport model developed by Schurtz et al. to Vlasov-Fokker-Planck simulations. Two new test cases are considered: the propagation of a heat wave through a high density region into a lower density gas, and a 1-dimensional hohlraum ablation problem. We find the reduced model reproduces the peak heat flux well in the ablation region but significantly over-predicts the coronal preheat. The suitability of the reduced model for computing non-local transport effects other than thermal conductivity is considered by comparing the computed distribution function to the Vlasov-Fokker-Planck distribution function. It is shown that even when the reduced model reproduces the correct heat flux, the distribution function is significantly different to the Vlasov-Fokker-Planck prediction. Two simple modifications are considered which improve agreement between models in the coronal region. This work was performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. 9. Magnetism in Sc-doped ZnO with zinc vacancies: A hybrid density functional and GGA + U approaches KAUST Repository Kanoun, Mohammed; Goumri-Said, Souraya; Schwingenschlö gl, Udo; Manchon, Aurelien 2012-01-01 We investigate the zinc vacancy effects on the electronic structures and magnetic properties of Sc-doped ZnO, by performing first-principles calculations within both GGA + U and Heyd-Scuseria-Ernzerhof hybrid functional methods. We find that Sc impurities stabilize considerably Zn vacancies. The electronic and magnetic analysis shows a half metallic ferromagnetic character with a total magnetic moment of 2.01 μ B. The magnetism mainly stems from the O 2p states around the Zn vacancies. Calculations with the hybrid density functional agree with the GGA + U results but give an accurate description of the electronic structure for pure ZnO and Sc-doped ZnO with Zn vacancies. © 2012 Elsevier B.V. All rights reserved. 10. Magnetism in Sc-doped ZnO with zinc vacancies: A hybrid density functional and GGA + U approaches KAUST Repository Kanoun, Mohammed 2012-04-01 We investigate the zinc vacancy effects on the electronic structures and magnetic properties of Sc-doped ZnO, by performing first-principles calculations within both GGA + U and Heyd-Scuseria-Ernzerhof hybrid functional methods. We find that Sc impurities stabilize considerably Zn vacancies. The electronic and magnetic analysis shows a half metallic ferromagnetic character with a total magnetic moment of 2.01 μ B. The magnetism mainly stems from the O 2p states around the Zn vacancies. Calculations with the hybrid density functional agree with the GGA + U results but give an accurate description of the electronic structure for pure ZnO and Sc-doped ZnO with Zn vacancies. © 2012 Elsevier B.V. All rights reserved. 11. Reproductive sink of sweet corn in response to plant density and hybrid Science.gov (United States) Improvements in plant density tolerance have played an essential role in grain corn yield gains for ~80 years; however, plant density effects on sweet corn biomass allocation to the ear (the reproductive ‘sink’) is poorly quantified. Moreover, optimal plant densities for modern white-kernel shrunke... 12. Surface density dependence of PCR amplicon hybridization on PNA/DNA probe layers DEFF Research Database (Denmark) Yao, Danfeng; Kim, Junyoung; Yu, Fang 2005-01-01 at an intermediate sodium concentration (approximately 100 mM). These effects were mainly ascribed to the electrostatic cross talk among the hybridized DNA molecules and the secondary structure of PCR amplicons. For the negatively charged DNA probes, the hybridization reaction was subjected additionally to the DNA....../DNA electrostatic barrier, particularly in lower ionic strength range (e.g., 10 approximately 150 mM Na(+)). The electrostatic cross talk was shown to be largely reduced if the PNA probe layer was sufficiently diluted by following a strategic templated immobilization method. As a consequence, a pseudo... 13. Sign-changing solutions for non-local elliptic equations Directory of Open Access Journals (Sweden) Huxiao Luo 2017-07-01 Full Text Available This article concerns the existence of sign-changing solutions for equations driven by a non-local integrodifferential operator with homogeneous Dirichlet boundary conditions, $$\\displaylines{ -\\mathcal{L}_Ku=f(x,u,\\quad x\\in \\Omega, \\cr u=0,\\quad x\\in \\mathbb{R}^n\\setminus\\Omega, }$$ where\\Omega\\subset\\mathbb{R}^n\\; (n\\geq2is a bounded, smooth domain and the nonlinear term f satisfies suitable growth assumptions. By using Brouwer's degree theory and Deformation Lemma and arguing as in [2], we prove that there exists a least energy sign-changing solution. Our results generalize and improve some results obtained in [27 14. Bound and scattering states with non-local potentials. Energy Technology Data Exchange (ETDEWEB) Viviani, M; Girlanda, L; Kievsky, A; Marcucci, L E; Rosati, S; Schiavilla, R 2007-06-01 The application of the hyperspherical harmonics method to the case of non-local potentials is described. Given the properties of the hyperspherical harmonic functions, there are no difficulties in considering the approach in both coordinate and momentum space. The results for the 3H and 4He binding energies and n - 3H scattering lengths are found to be in good agreement with those obtained with other different techniques. A study of the 4He form factor is also reported, with a careful investigation of the contribution from isospin symmetry violation. Its effect on parity violating elastic scattering of polarized electrons from 4He is investigated. In particular, a simple analysis of the recently measured left-right asymmetry at low Q2 shows that the contribution of these isospin admixture are found of comparable magnitude to that associated with strangeness components in the nucleon electric form factor. 15. Inflationary magnetogenesis and non-local actions: the conformal anomaly Energy Technology Data Exchange (ETDEWEB) El-Menoufi, Basem Kamal, E-mail: bmahmoud@physics.umass.edu [Department of Physics, University of Massachusetts Amherst, MA 01003 (United States) 2016-02-01 We discuss the possibility of successful magnetogenesis during inflation by employing the one-loop effective action of massless QED. The action is strictly non-local and results from the long distance fluctuations of massless charged particles present at the inflationary scale. Most importantly, it encodes the conformal anomaly of QED which is crucial to avoid the vacuum preservation in classical electromagnetism. In particular, we find a blue spectrum for the magnetic field with spectral index n{sub B} ≅ 2 − α{sub e} where α{sub e} depends on both the number of e-folds during inflation as well as the coefficient of the one-loop beta function. In particular, the sign of the beta function has important bearing on the final result. A low reheating temperature is required for the present day magnetic field to be consistent with the lower bound inferred on the field in the intergalactic medium. 16. Quantum gravitational collapse: non-singularity and non-locality International Nuclear Information System (INIS) Greenwood, Eric; Stojkovic, Dejan 2008-01-01 We investigate gravitational collapse in the context of quantum mechanics. We take primary interest in the behavior of the collapse near the horizon and near the origin (classical singularity) from the point of view of an infalling observer. In the absence of radiation, quantum effects near the horizon do not change the classical conclusions for an infalling observer, meaning the horizon is not an obstacle for him. However, quantum effects are able to remove the classical singularity at the origin, since the wave function is non-singular at the origin. Also, near the classical singularity, some non-local effects become important. In the Schrodinger equation describing behavior near the origin, derivatives of the wave function at one point are related to the value of the wave function at some other distant point. 17. Non-local means filter for trim statics KAUST Repository Huang, Yunsong 2014-08-05 Structures will be mispositioned across prestack migration gathers in the presence of inaccuracies in the velocity model. Stacking these misaligned gathers runs the risk of destroying important structures in the stacked migration image. To mitigate this problem, we propose a trim statics inspired by the non-local means algorithm originally developed for image denoising. This method differs from the conventional one in two fundamental respects. First, the trim statics are computed by comparing image patches instead of individual image traces. Second, no global pilot trace is needed because only two migration images at a time participate in trim statics and are stacked into one image. A multitude of migration images are stacked recursively in this two-to-one fashion. Tests with a Gulf of Mexico dataset show a noticeable improvement in the feature coherency of the stacked migration image. 18. Non-local matrix generalizations of W-algebras International Nuclear Information System (INIS) Bilal, A. 1995-01-01 There is a standard way to define two symplectic (hamiltonian) structures, the first and second Gelfand-Dikii brackets, on the space of ordinary m th -order linear differential operators L=-d m +U 1 d m-1 +U 2 d m-2 +..+U m . In this paper, I consider in detail the case where the U k are nxn-matrix-valued functions, with particular emphasis on the (more interesting) second Gelfand-Dikii bracket. Of particular interest is the reduction to the symplectic submanifold U 1 =0. This reduction gives rise to matrix generalizations of (the classical version of) the non-linear W m -algebras, called V n,m -algebras. The non-commutativity of the matrices leads to non-local terms in these V n,m -algebras. I show that these algebras contain a conformal Virasoro subalgebra and that combinations W k of the U k can be formed that are nxn-matrices of conformally primary fields of spin k, in analogy with the scalar case n=1. In general however, the V m,n -algebras have a much richer structure than the W m -algebras as can be seen on the examples of the non-linear and non-local Poisson brackets {(U 2 ) ab (σ),(U 2 ) cd (σ')}, {(U 2 ) ab (σ),(W 3 ) cd (σ')} and {(W 3 ) ab (σ),(W 3 ) cd (σ')} which I work out explicitly for all m and n. A matrix Miura transformation is derived, mapping these complicated (second Gelfand-Dikii) brackets of the U k to a set of much simpler Poisson brackets, providing the analogue of the free-field representation of the W m -algebras. (orig.) 19. A non-local model analysis of heat pulse propagation International Nuclear Information System (INIS) Iwasaki, T.; Itoh, S.I.; Yagi, M.; Stroth, U. 1998-01-01 The anomalous transport in high temperature plasma has been studied for a long time, from the beginning of the fusion research. Since the electron channel in stellarators and tokamaks is clearly anomalous, it is of fundamental importance to investigate the electron heat diffusivity coefficient, χ e and to understand the physical mechanism. Recently, the experimental data for the transient transport of the heat pulse propagation in fusion plasma has been accumulated. An observation was reported on W7-AS which the heat flux changes faster than the change of the temperature profile, responding to the switching on off of the central heating power. The observation on the transient response has simulated the transport modeling, e.g., the critical marginality which implies the existence of a finite threshold in ∇T for the excitation of the turbulence, or the model in which the thermal conductivity is assumed to depend on the heating power. Extensive study is made by use of these models, and the critical marginally model seems to be insufficient to explain various transient transport. The rapid change of the plasma state and its hysteresis nature were successfully modeled by a heating-power-dependent model. The foundation of this model, however, is left for future work. The development of the transport modeling remains to be an urgent problem. In this paper, we investigate the role of the non-locality of the plasma transport in the study of the heat pulse propagation. For this purpose, a model equation is proposed, in which the non-local effect is taken into account in the heat flux. The properties of this model are investigated by performing a transport simulation. The organization of this paper is as follows: In Sec. II, the model equation is proposed and the properties of the model are explained. Using the model equation, the switching on off experiment is simulated in Sec. III. Summary and discussion are given in Sec. IV. (author) 20. Electron transport in polycyclic aromatic hydrocarbons/boron nitride hybrid structures: density functional theory combined with the nonequilibrium Green's function. Science.gov (United States) Panahi, S F K S; Namiranian, Afshin; Soleimani, Maryam; Jamaati, Maryam 2018-02-07 We investigate the electronic transport properties of two types of junction based on single polyaromatic hydrocarbons (PAHs) and PAHs embedded in boron nitride (h-BN) nanoribbons, using nonequilibrium Green's functions (NEGF) and density functional theory (DFT). In the PAH junctions, a Fano resonance line shape at the Fermi energy in the transport feature can be clearly seen. In hybrid junctions, structural asymmetries enable interactions between the electronic states, leading to observation of interface-based transport. Our findings reveal that the interface of PAH/h-BN strongly affects the transport properties of the structures. 1. Theoretical investigation of pressure-induced structural transitions in americium using GGA+U and hybrid density functional theory methods DEFF Research Database (Denmark) Verma, Ashok K.; Modak, P.; Sharma, Surinder M. 2013-01-01 First-principles calculations have been performed for americium (Am) metal using the generalized gradient approximation + orbital-dependent onsite Coulomb repulsion via Hubbard interaction (GGA+U) and hybrid density functional theory (HYB-DFT) methods to investigate various ground state properties......-I to Am-II transition. Good agreement was found between calculated and experimental equations of states for all phases, but the first three phases need larger U (α) parameters (where α represents the fraction of Hartree-Fock exchange energy replacing the DFT exchange energy) than the fourth phase in order... 2. Non-local ground-state functional for quantum spin chains with translational broken symmetry Energy Technology Data Exchange (ETDEWEB) Libero, Valter L.; Penteado, Poliana H.; Veiga, Rodrigo S. [Universidade de Sao Paulo (IFSC/USP), Sao Carlos, SP (Brazil). Inst. de Fisica 2011-07-01 Full text. Thanks to the development and use of new materials with special doping, it becomes relevant the study of Heisenberg spin-chains with broken translational symmetry, induced for instance by finite-size effects, bond defects or by impurity spin in the chain. The exact numerical results demands huge computational efforts, due to the size of the Hilbert space involved and the lack of symmetry to exploit. Density Functional Theory (DFT) has been considered a simple alternative to obtain ground-state properties for such systems. Usually, DFT starts with a uniform system to build the correlation energy and after implement a local approximation to construct local functionals. Based on our prove of the Hohenberg-Kohn theorem for Heisenberg models, and in order to describe more realistic models, we have recently developed a non-local exchange functional for the ground-state energy of quantum-spin chains. A alternating-bond chain is used to obtain the correlation energy and a local unit-cell approximation - LUCA, is defined in the context of DFT. The alternating chain is a good starting point to construct functionals since it is intrinsically non-homogeneous, therefore instead of the usual local approximation (like LDA for electronic systems) we need to introduce an approximation based upon a unit cell concept, that renders a non-local functional in the bond exchange interaction. The agreement with exact numerical data (obtained only for small chains, although the functional can be applied for chains with arbitrary size) is significantly better than in our previous local formulation, even for chains with several ferromagnetic or antiferromagnetic bond defects. These results encourage us to extend the concept of LUCA for chains with alternating-spin magnitudes. We also have constructed a non-local functional based on an alternating-spin chain, instead of a local alternating-bond, using spin-wave-theory. Because of its non-local nature, this functional is expected to 3. Non-local ground-state functional for quantum spin chains with translational broken symmetry International Nuclear Information System (INIS) Libero, Valter L.; Penteado, Poliana H.; Veiga, Rodrigo S. 2011-01-01 Full text. Thanks to the development and use of new materials with special doping, it becomes relevant the study of Heisenberg spin-chains with broken translational symmetry, induced for instance by finite-size effects, bond defects or by impurity spin in the chain. The exact numerical results demands huge computational efforts, due to the size of the Hilbert space involved and the lack of symmetry to exploit. Density Functional Theory (DFT) has been considered a simple alternative to obtain ground-state properties for such systems. Usually, DFT starts with a uniform system to build the correlation energy and after implement a local approximation to construct local functionals. Based on our prove of the Hohenberg-Kohn theorem for Heisenberg models, and in order to describe more realistic models, we have recently developed a non-local exchange functional for the ground-state energy of quantum-spin chains. A alternating-bond chain is used to obtain the correlation energy and a local unit-cell approximation - LUCA, is defined in the context of DFT. The alternating chain is a good starting point to construct functionals since it is intrinsically non-homogeneous, therefore instead of the usual local approximation (like LDA for electronic systems) we need to introduce an approximation based upon a unit cell concept, that renders a non-local functional in the bond exchange interaction. The agreement with exact numerical data (obtained only for small chains, although the functional can be applied for chains with arbitrary size) is significantly better than in our previous local formulation, even for chains with several ferromagnetic or antiferromagnetic bond defects. These results encourage us to extend the concept of LUCA for chains with alternating-spin magnitudes. We also have constructed a non-local functional based on an alternating-spin chain, instead of a local alternating-bond, using spin-wave-theory. Because of its non-local nature, this functional is expected to 4. A non-local structural derivative model for characterization of ultraslow diffusion in dense colloids Science.gov (United States) Liang, Yingjie; Chen, Wen 2018-03-01 Ultraslow diffusion has been observed in numerous complicated systems. Its mean squared displacement (MSD) is not a power law function of time, but instead a logarithmic function, and in some cases grows even more slowly than the logarithmic rate. The distributed-order fractional diffusion equation model simply does not work for the general ultraslow diffusion. Recent study has used the local structural derivative to describe ultraslow diffusion dynamics by using the inverse Mittag-Leffler function as the structural function, in which the MSD is a function of inverse Mittag-Leffler function. In this study, a new stretched logarithmic diffusion law and its underlying non-local structural derivative diffusion model are proposed to characterize the ultraslow diffusion in aging dense colloidal glass at both the short and long waiting times. It is observed that the aging dynamics of dense colloids is a class of the stretched logarithmic ultraslow diffusion processes. Compared with the power, the logarithmic, and the inverse Mittag-Leffler diffusion laws, the stretched logarithmic diffusion law has better precision in fitting the MSD of the colloidal particles at high densities. The corresponding non-local structural derivative diffusion equation manifests clear physical mechanism, and its structural function is equivalent to the first-order derivative of the MSD. 5. On non-local energy transfer via zonal flow in the Dimits shift International Nuclear Information System (INIS) St-Onge, Denis A. 2017-01-01 The two-dimensional Terry–Horton equation is shown to exhibit the Dimits shift when suitably modified to capture both the nonlinear enhancement of zonal/drift-wave interactions and the existence of residual Rosenbluth–Hinton states. This phenomenon persists through numerous simplifications of the equation, including a quasilinear approximation as well as a four-mode truncation. It is shown that the use of an appropriate adiabatic electron response, for which the electrons are not affected by the flux-averaged potential, results in an E×B nonlinearity that can efficiently transfer energy non-locally to length scales of the order of the sound radius. The size of the shift for the nonlinear system is heuristically calculated and found to be in excellent agreement with numerical solutions. The existence of the Dimits shift for this system is then understood as an ability of the unstable primary modes to efficiently couple to stable modes at smaller scales, and the shift ends when these stable modes eventually destabilize as the density gradient is increased. This non-local mechanism of energy transfer is argued to be generically important even for more physically complete systems. 6. On non-local energy transfer via zonal flow in the Dimits shift Science.gov (United States) St-Onge, Denis A. 2017-10-01 The two-dimensional Terry-Horton equation is shown to exhibit the Dimits shift when suitably modified to capture both the nonlinear enhancement of zonal/drift-wave interactions and the existence of residual Rosenbluth-Hinton states. This phenomenon persists through numerous simplifications of the equation, including a quasilinear approximation as well as a four-mode truncation. It is shown that the use of an appropriate adiabatic electron response, for which the electrons are not affected by the flux-averaged potential, results in an nonlinearity that can efficiently transfer energy non-locally to length scales of the order of the sound radius. The size of the shift for the nonlinear system is heuristically calculated and found to be in excellent agreement with numerical solutions. The existence of the Dimits shift for this system is then understood as an ability of the unstable primary modes to efficiently couple to stable modes at smaller scales, and the shift ends when these stable modes eventually destabilize as the density gradient is increased. This non-local mechanism of energy transfer is argued to be generically important even for more physically complete systems. 7. High density lower hybrid current drive and Ion Bernstein Waves heating experiments on FTU International Nuclear Information System (INIS) Pericoli-Ridolfini, V.; Panaccione, L.; Podda, S. 1999-01-01 An investigation of the efficiency of CD in the LH range of frequency on FTU was performed up to densities above 1x10 20 m -3 . The dependence on temperature, density, magnetic field was elucidated. Preliminary results on IBW are reported. (author) 8. Hybrid Density Functional Study of the Local Structures and Energy Levels of CaAl2O4:Ce3. Science.gov (United States) Lou, Bibo; Jing, Weiguo; Lou, Liren; Zhang, Yongfan; Yin, Min; Duan, Chang-Kui 2018-05-03 First-principles calculations were carried out for the electronic structures of Ce 3+ in calcium aluminate phosphors, CaAl 2 O 4 , and their effects on luminescence properties. Hybrid density functional approaches were used to overcome the well-known underestimation of band gaps of conventional density functional approaches and to calculate the energy levels of Ce 3+ ions more accurately. The obtained 4f-5d excitation and emission energies show good consistency with measured values. A detailed energy diagram of all three sites is obtained, which explains qualitatively all of the luminescent phenomena. With the results of energy levels calculated by combining the hybrid functional of Heyd, Scuseria, and Ernzerhof (HSE06) and the constraint occupancy approach, we are able to construct a configurational coordinate diagram to analyze the processes of capture of a hole or an electron and luminescence. This approach can be applied for systematic high-throughput calculations in predicting Ce 3+ activated luminescent materials with a moderate computing requirement. 9. Fabrication and materials properties of high-density polyethylene (HDPE)/biphasic calcium phosphate (BCP) hybrid bone plates International Nuclear Information System (INIS) Jo, Sun Young; Youn, Min Ho; Lim, Youn Mook; Gwon, Hui Jeong; Park, Jong Seok; Nho, Young Chang 2010-01-01 Biphasic calcium phosphate-reinforced high-density polyethylene (BCP/HDPE) hybrid composite is a new orthopedic biomaterial, which was made to simulate a natural bone composition. Calcium phosphate systems and HDPE hybrid composites have been used in biomedical applications without any inflammatory response. Differences in natural bone of both materials have motivated the use of coupling agents to improve their interfacial interfacial interactions. The composites were prepared using medical grade BCP powder and granular polyethylene. This material was produced by replacing the mineral component and collagen soft tissue of the bone with BCP and HDPE, respectively. As expected, increased volume fraction of either reinforcement type over 0 ∼ 50 vol.% resulted in a increased Vickers hardness and Young's modulus. Thus, BCP particle-reinforced HDPE composites possessed improved material and mechanical properties. BCP particles-reinforced composites were anisotropic due to an alignment of the particles in the matrix during a processing. On the other hand, bending and tensile strength was dramatically changed in the matrix. To change the material and mechanical properties of HDPE/BCP composites, the process of a blending was used, and its effect on the microstructure and mechanical proprieties of HDPE/BCP composites were investigated by means of FT-IR/ATR spectroscopy, XRD, FE-SEM, Vickers Hardness Testing Machine, Universal Testing Machine, Mercury Porosimeter and Ultrasonic Flaw Detector at room temperature. For the evaluation of the cell viability and proliferation onto the external surface of HDPE/BCP hybrid plates with a HaCaT cell line, which is a multipotent cell line able to differentiate towards different phenotypes under the action of biological factors, has been evaluated with in vitro studies and quantified by colormetric assays. These findings indicate that the HDPE/BCP hybrid plates are biocompatible and non-toxic 10. Doping and defects in YBa2Cu3O7: Results from hybrid density functional theory KAUST Repository Schwingenschlö gl, Udo; Schuster, Cosima 2012-01-01 7 in two prototypical configurations: Ca doped (hole doping) and O deficient (electron doping). By means of first principles calculations for fully relaxed structures, we evaluate the orbital occupations. We find that the change of the charge density 11. Noninvasive prenatal diagnosis. Use of density gradient centrifugation, magnetically activated cell sorting and in situ hybridization DEFF Research Database (Denmark) Campagnoli, C; Multhaupt, H A; Ludomirski, A 1997-01-01 OBJECTIVE: To develop a noninvasive method suitable for clinical prenatal diagnosis. STUDY DESIGN: Fetal nucleated erythrocytes were separated from peripheral blood of 17 healthy pregnant women using small magnetically activated cell sorting columns (MiniMACS) following density gradient centrifug... 12. Non-local correlations within dynamical mean field theory Energy Technology Data Exchange (ETDEWEB) Li, Gang 2009-03-15 The contributions from the non-local fluctuations to the dynamical mean field theory (DMFT) were studied using the recently proposed dual fermion approach. Straight forward cluster extensions of DMFT need the solution of a small cluster, where all the short-range correlations are fully taken into account. All the correlations beyond the cluster scope are treated in the mean-field level. In the dual fermion method, only a single impurity problem needs to be solved. Both the short and long-range correlations could be considered on equal footing in this method. The weak-coupling nature of the dual fermion ensures the validity of the finite order diagram expansion. The one and two particle Green's functions calculated from the dual fermion approach agree well with the Quantum Monte Carlo solutions, and the computation time is considerably less than with the latter method. The access of the long-range order allows us to investigate the collective behavior of the electron system, e.g. spin wave excitations. (orig.) 13. Non-Local Diffusion of Energetic Electrons during Solar Flares Science.gov (United States) Bian, N. H.; Emslie, G.; Kontar, E. 2017-12-01 The transport of the energy contained in suprathermal electrons in solar flares plays a key role in our understanding of many aspects of flare physics, from the spatial distributions of hard X-ray emission and energy deposition in the ambient atmosphere to global energetics. Historically the transport of these particles has been largely treated through a deterministic approach, in which first-order secular energy loss to electrons in the ambient target is treated as the dominant effect, with second-order diffusive terms (in both energy and angle) generally being either treated as a small correction or even neglected. Here, we critically analyze this approach, and we show that spatial diffusion through pitch-angle scattering necessarily plays a very significant role in the transport of electrons. We further show that a satisfactory treatment of the diffusion process requires consideration of non-local effects, so that the electron flux depends not just on the local gradient of the electron distribution function but on the value of this gradient within an extended region encompassing a significant fraction of a mean free path. Our analysis applies generally to pitch-angle scattering by a variety of mechanisms, from Coulomb collisions to turbulent scattering. We further show that the spatial transport of electrons along the magnetic field of a flaring loop can be modeled as a Continuous Time Random Walk with velocity-dependent probability distribution functions of jump sizes and occurrences, both of which can be expressed in terms of the scattering mean free path. 14. Black supernovae and black holes in non-local gravity Energy Technology Data Exchange (ETDEWEB) Bambi, Cosimo [Center for Field Theory and Particle Physics and Department of Physics, Fudan University,200433 Shanghai (China); Theoretical Astrophysics, Eberhard-Karls Universität Tübingen,72076 Tübingen (Germany); Malafarina, Daniele [Department of Physics, Nazarbayev University,010000 Astana (Kazakhstan); Modesto, Leonardo [Center for Field Theory and Particle Physics and Department of Physics, Fudan University,200433 Shanghai (China) 2016-04-22 In a previous paper, we studied the interior solution of a collapsing body in a non-local theory of gravity super-renormalizable at the quantum level. We found that the classical singularity is replaced by a bounce, after which the body starts expanding. A black hole, strictly speaking, never forms. The gravitational collapse does not create an event horizon but only an apparent one for a finite time. In this paper, we solve the equations of motion assuming that the exterior solution is static. With such an assumption, we are able to reconstruct the solution in the whole spacetime, namely in both the exterior and interior regions. Now the gravitational collapse creates an event horizon in a finite comoving time, but the central singularity is approached in an infinite time. We argue that these black holes should be unstable, providing a link between the scenarios with and without black holes. Indeed, we find a non catastrophic ghost-instability of the metric in the exterior region. Interestingly, under certain conditions, the lifetime of our black holes exactly scales as the Hawking evaporation time. 15. Cosmological evolution of generalized non-local gravity Energy Technology Data Exchange (ETDEWEB) Zhang, Xue; Wu, Ya-Bo; Liu, Yu-Chen; Chen, Bo-Hai; Chai, Yun-Tian; Shu, Shuang [Department of Physics, Liaoning Normal University, Dalian 116029 (China); Li, Song, E-mail: zxue0128@163.com, E-mail: ybwu61@163.com, E-mail: sli@cnu.edu.cn, E-mail: wuli11liuyuchen@163.com, E-mail: bchenphy@163.com, E-mail: chaiyuntian1881@sina.com, E-mail: sshu1230@163.com [Department of Physics, Capital Normal University, Beijing 100048 (China) 2016-07-01 We construct a class of generalized non-local gravity (GNLG) model which is the modified theory of general relativity (GR) obtained by adding a term m {sup 2} {sup n} {sup -2} R □{sup -} {sup n} R to the Einstein-Hilbert action. Concretely, we not only study the gravitational equation for the GNLG model by introducing auxiliary scalar fields, but also analyse the classical stability and examine the cosmological consequences of the model for different exponent n . We find that the half of the scalar fields are always ghost-like and the exponent n must be taken even number for a stable GNLG model. Meanwhile, the model spontaneously generates three dominant phases of the evolution of the universe, and the equation of state parameters turn out to be phantom-like. Furthermore, we clarify in another way that exponent n should be even numbers by the spherically symmetric static solutions in Newtonian gauge. It is worth stressing that the results given by us can include ones in refs. [28, 34] as the special case of n =2. 16. Non-local correlations within dynamical mean field theory International Nuclear Information System (INIS) Li, Gang 2009-03-01 The contributions from the non-local fluctuations to the dynamical mean field theory (DMFT) were studied using the recently proposed dual fermion approach. Straight forward cluster extensions of DMFT need the solution of a small cluster, where all the short-range correlations are fully taken into account. All the correlations beyond the cluster scope are treated in the mean-field level. In the dual fermion method, only a single impurity problem needs to be solved. Both the short and long-range correlations could be considered on equal footing in this method. The weak-coupling nature of the dual fermion ensures the validity of the finite order diagram expansion. The one and two particle Green's functions calculated from the dual fermion approach agree well with the Quantum Monte Carlo solutions, and the computation time is considerably less than with the latter method. The access of the long-range order allows us to investigate the collective behavior of the electron system, e.g. spin wave excitations. (orig.) 17. Path entanglement of photons by non-local bunching International Nuclear Information System (INIS) Eisenberg, H.; Hodelin, J.; Khoury, G.; Bouwmeester, D. 2005-01-01 Full Text:Path entangled photon states can be used to overcome classical limits on the accuracy of interferometric measurements such as the diffraction limit. These states are superpositions of finding n photons in one out of two (or more) paths. Using stimulated parametric down-conversion, we propose and demonstrate a method for generating heralded multiphoton path entanglement, without applying post-selection. parametric down-conversion is relatively easy to produce compared to pure Fock states as demanded by other proposals. By a special coincidence detection at one down converted arm, the photons of the second arm non-locally bunch into the desired state. Entanglement in photon number is created between two polarization modes rather than two paths. A polarization beam-splitter and a 2 wave plate can translate between the two representations. The experimental generation of a two-photon path entangled state was detected by observing interference at half the photon wavelength. The scheme is generally extendable to higher photon numbers 18. Axonal diameter and density estimated with 7-Tesla hybrid diffusion imaging in transgenic Alzheimer rats OpenAIRE Daianu, Madelaine; Jacobs, Russell E.; Town, Terrence; Thompson, Paul M. 2016-01-01 Diffusion-weighted MR imaging (DWI) is a powerful tool to study brain tissue microstructure. DWI is sensitive to subtle changes in the white matter (WM), and can provide insight into abnormal brain changes in diseases such as Alzheimer’s disease (AD). In this study, we used 7-Tesla hybrid diffusion imaging (HYDI) to scan 3 transgenic rats (line TgF344-AD; that model the full clinico-pathological spectrum of the human disease) ex vivo at 10, 15 and 24 months. We acquired 300 DWI volumes across... 19. Relativistic Adiabatic Time-Dependent Density Functional Theory Using Hybrid Functionals and Noncollinear Spin Magnetization DEFF Research Database (Denmark) Bast, Radovan; Jensen, Hans Jørgen Aagaard; Saue, Trond 2009-01-01 into reduction of algebra from quaternion to complex or real. For hybrid GGAs with noncollinear spin magnetization we derive a new computationally advantageous equation for the full second variational derivatives of such exchange-correlation functionals. We apply our implementation to calculations on the ns2...... → ns1np1 excitation energies in the Zn, Cd, and Hg atoms (n = 4-6) and (vertical) excitation energies of UO2+ 2 ; and we test the performance of various functionals by comparison with experimental data (group 12 atoms) or higher-level computational results (UO2+2 ). The results indicate... 20. Study on lower hybrid current drive efficiency at high density towards long-pulse regimes in Experimental Advanced Superconducting Tokamak International Nuclear Information System (INIS) Li, M. H.; Ding, B. J.; Zhang, J. Z.; Gan, K. F.; Wang, H. Q.; Zhang, L.; Wei, W.; Li, Y. C.; Wu, Z. G.; Ma, W. D.; Jia, H.; Chen, M.; Yang, Y.; Feng, J. Q.; Wang, M.; Xu, H. D.; Shan, J. F.; Liu, F. K.; Peysson, Y. 2014-01-01 Significant progress on both L- and H-mode long-pulse discharges has been made recently in Experimental Advanced Superconducting Tokamak (EAST) with lower hybrid current drive (LHCD) [J. Li et al., Nature Phys. 9, 817 (2013) And B. N. Wan et al., Nucl. Fusion 53, 104006 (2013).]. In this paper, LHCD experiments at high density in L-mode plasmas have been investigated in order to explore possible methods of improving current drive (CD) efficiency, thus to extend the operational space in long-pulse and high performance plasma regime. It is observed that the normalized bremsstrahlung emission falls much more steeply than 1/n e-av (line-averaged density) above n e-av = 2.2 × 10 19 m −3 indicating anomalous loss of CD efficiency. A large broadening of the operating line frequency (f = 2.45 GHz), measured by a radio frequency (RF) probe located outside the EAST vacuum vessel, is generally observed during high density cases, which is found to be one of the physical mechanisms resulting in the unfavorable CD efficiency. Collisional absorption of lower hybrid wave in the scrape off layer (SOL) may be another cause, but this assertion needs more experimental evidence and numerical analysis. It is found that plasmas with strong lithiation can improve CD efficiency largely, which should be benefited from the changes of edge parameters. In addition, several possible methods are proposed to recover good efficiency in future experiments for EAST 1. Stability of stationary states of non-local equations with singular interaction potentials KAUST Repository Fellner, Klemens 2011-04-01 We study the large-time behaviour of a non-local evolution equation for the density of particles or individuals subject to an external and an interaction potential. In particular, we consider interaction potentials which are singular in the sense that their first derivative is discontinuous at the origin.For locally attractive singular interaction potentials we prove under a linear stability condition local non-linear stability of stationary states consisting of a finite sum of Dirac masses. For singular repulsive interaction potentials we show the stability of stationary states of uniformly bounded solutions under a convexity condition.Finally, we present numerical simulations to illustrate our results. © 2010 Elsevier Ltd. 2. New approach to improve the energy density of hybrid electret-dielectric elastomer generators Science.gov (United States) Lagomarsini, Clara; Jean-Mistral, Claire; Monfray, Stephane; Sylvestre, Alain 2017-04-01 Harvesting human kinetic energy to produce electricity is an attractive alternative to batteries for applications in wearable electronic devices and smart textile. Dielectric elastomers generators (DEGs) represent one of the most promising technologies for these applications. Nevertheless, one of the main disadvantages of these structures is the need of an external polarization source to perform the energetic cycle. In the present work, a hybrid electret-dielectric elastomer generator in DEG mode is presented. In this configuration, the electret material is used as polarization source of a classical DEG, i.e. an electrostatic generator based on electrical capacitance variation. The electrical energy output in this mode (1.06mJ.g-1) could be higher than the one obtained using a classical electret mode (0.55mJ.g-1), i.e. charges recombination. In this paper, the operation principle of the hybrid generator will be fully described and the design rules for the realization of the prototype will be presented. The experimental data obtained from the prototype will be compared to the results of FEM simulations. 3. Electrically and Thermally Conductive Low Density Polyethylene-Based Nanocomposites Reinforced by MWCNT or Hybrid MWCNT/Graphene Nanoplatelets with Improved Thermo-Oxidative Stability OpenAIRE Sandra Paszkiewicz; Anna Szymczyk; Daria Pawlikowska; Jan Subocz; Marek Zenker; Roman Masztak 2018-01-01 In this paper, the electrical and thermal conductivity and morphological behavior of low density polyethylene (LDPE)/multi-walled carbon nanotubes (MWCNTs) + graphene nanoplatelets (GNPs) hybrid nanocomposites (HNCs) have been studied. The distribution of MWCNTs and the hybrid of MWCNTs/GNPs within the polymer matrix has been investigated with scanning electron microscopy (SEM). The results showed that the thermal and electrical conductivity of the LDPE-based nanocomposites increased along wi... 4. Non-local means denoising of dynamic PET images. Directory of Open Access Journals (Sweden) Joyita Dutta Full Text Available Dynamic positron emission tomography (PET, which reveals information about both the spatial distribution and temporal kinetics of a radiotracer, enables quantitative interpretation of PET data. Model-based interpretation of dynamic PET images by means of parametric fitting, however, is often a challenging task due to high levels of noise, thus necessitating a denoising step. The objective of this paper is to develop and characterize a denoising framework for dynamic PET based on non-local means (NLM.NLM denoising computes weighted averages of voxel intensities assigning larger weights to voxels that are similar to a given voxel in terms of their local neighborhoods or patches. We introduce three key modifications to tailor the original NLM framework to dynamic PET. Firstly, we derive similarities from less noisy later time points in a typical PET acquisition to denoise the entire time series. Secondly, we use spatiotemporal patches for robust similarity computation. Finally, we use a spatially varying smoothing parameter based on a local variance approximation over each spatiotemporal patch.To assess the performance of our denoising technique, we performed a realistic simulation on a dynamic digital phantom based on the Digimouse atlas. For experimental validation, we denoised [Formula: see text] PET images from a mouse study and a hepatocellular carcinoma patient study. We compared the performance of NLM denoising with four other denoising approaches - Gaussian filtering, PCA, HYPR, and conventional NLM based on spatial patches.The simulation study revealed significant improvement in bias-variance performance achieved using our NLM technique relative to all the other methods. The experimental data analysis revealed that our technique leads to clear improvement in contrast-to-noise ratio in Patlak parametric images generated from denoised preclinical and clinical dynamic images, indicating its ability to preserve image contrast and high 5. Non-local means denoising of dynamic PET images. Science.gov (United States) Dutta, Joyita; Leahy, Richard M; Li, Quanzheng 2013-01-01 Dynamic positron emission tomography (PET), which reveals information about both the spatial distribution and temporal kinetics of a radiotracer, enables quantitative interpretation of PET data. Model-based interpretation of dynamic PET images by means of parametric fitting, however, is often a challenging task due to high levels of noise, thus necessitating a denoising step. The objective of this paper is to develop and characterize a denoising framework for dynamic PET based on non-local means (NLM). NLM denoising computes weighted averages of voxel intensities assigning larger weights to voxels that are similar to a given voxel in terms of their local neighborhoods or patches. We introduce three key modifications to tailor the original NLM framework to dynamic PET. Firstly, we derive similarities from less noisy later time points in a typical PET acquisition to denoise the entire time series. Secondly, we use spatiotemporal patches for robust similarity computation. Finally, we use a spatially varying smoothing parameter based on a local variance approximation over each spatiotemporal patch. To assess the performance of our denoising technique, we performed a realistic simulation on a dynamic digital phantom based on the Digimouse atlas. For experimental validation, we denoised [Formula: see text] PET images from a mouse study and a hepatocellular carcinoma patient study. We compared the performance of NLM denoising with four other denoising approaches - Gaussian filtering, PCA, HYPR, and conventional NLM based on spatial patches. The simulation study revealed significant improvement in bias-variance performance achieved using our NLM technique relative to all the other methods. The experimental data analysis revealed that our technique leads to clear improvement in contrast-to-noise ratio in Patlak parametric images generated from denoised preclinical and clinical dynamic images, indicating its ability to preserve image contrast and high intensity details while 6. Obtaining source current density related to irregularly structured electromagnetic target field inside human body using hybrid inverse/FDTD method. Science.gov (United States) Han, Jijun; Yang, Deqiang; Sun, Houjun; Xin, Sherman Xuegang 2017-01-01 Inverse method is inherently suitable for calculating the distribution of source current density related with an irregularly structured electromagnetic target field. However, the present form of inverse method cannot calculate complex field-tissue interactions. A novel hybrid inverse/finite-difference time domain (FDTD) method that can calculate the complex field-tissue interactions for the inverse design of source current density related with an irregularly structured electromagnetic target field is proposed. A Huygens' equivalent surface is established as a bridge to combine the inverse and FDTD method. Distribution of the radiofrequency (RF) magnetic field on the Huygens' equivalent surface is obtained using the FDTD method by considering the complex field-tissue interactions within the human body model. The obtained magnetic field distributed on the Huygens' equivalent surface is regarded as the next target. The current density on the designated source surface is derived using the inverse method. The homogeneity of target magnetic field and specific energy absorption rate are calculated to verify the proposed method. 7. Studying the varied shapes of gold clusters by an elegant optimization algorithm that hybridizes the density functional tight-binding theory and the density functional theory Science.gov (United States) Yen, Tsung-Wen; Lim, Thong-Leng; Yoon, Tiem-Leong; Lai, S. K. 2017-11-01 We combined a new parametrized density functional tight-binding (DFTB) theory (Fihey et al. 2015) with an unbiased modified basin hopping (MBH) optimization algorithm (Yen and Lai 2015) and applied it to calculate the lowest energy structures of Au clusters. From the calculated topologies and their conformational changes, we find that this DFTB/MBH method is a necessary procedure for a systematic study of the structural development of Au clusters but is somewhat insufficient for a quantitative study. As a result, we propose an extended hybridized algorithm. This improved algorithm proceeds in two steps. In the first step, the DFTB theory is employed to calculate the total energy of the cluster and this step (through running DFTB/MBH optimization for given Monte-Carlo steps) is meant to efficiently bring the Au cluster near to the region of the lowest energy minimum since the cluster as a whole has explicitly considered the interactions of valence electrons with ions, albeit semi-quantitatively. Then, in the second succeeding step, the energy-minimum searching process will continue with a skilledly replacement of the energy function calculated by the DFTB theory in the first step by one calculated in the full density functional theory (DFT). In these subsequent calculations, we couple the DFT energy also with the MBH strategy and proceed with the DFT/MBH optimization until the lowest energy value is found. We checked that this extended hybridized algorithm successfully predicts the twisted pyramidal structure for the Au40 cluster and correctly confirms also the linear shape of C8 which our previous DFTB/MBH method failed to do so. Perhaps more remarkable is the topological growth of Aun: it changes from a planar (n =3-11) → an oblate-like cage (n =12-15) → a hollow-shape cage (n =16-18) and finally a pyramidal-like cage (n =19, 20). These varied forms of the cluster's shapes are consistent with those reported in the literature. 8. VV and VO2 defects in silicon studied with hybrid density functional theory KAUST Repository Christopoulos, Stavros Richard G; Wang, Hao; Chroneos, Alexander I.; Londos, Charalampos A.; Sgourou, Efstratia N.; Schwingenschlö gl, Udo 2014-01-01 The formation of VO (A-center), VV and VO2 defects in irradiated Czochralski-grown silicon (Si) is of technological importance. Recent theoretical studies have examined the formation and charge states of the A-center in detail. Here we use density 9. Application of Inkjet Printing in High-Density Pixelated RGB Quantum Dot-Hybrid LEDs KAUST Repository Haverinen, Hanna; Jabbour, Ghassan E. 2012-01-01 to fabricate high-density, pixelated (quarter video graphics array (QVGA) format), monochromatic and RGB quantum dots light-emitting diodes (QDLEDs), where inkjet printing is used to deposit the light-emitting layer of QDs. It shows some of the factors 10. Preparation and flammability of high density polyethylene/paraffin/organophilic montmorillonite hybrids as a form stable phase change material International Nuclear Information System (INIS) Cai, Yibing; Hu, Yuan; Song, Lei; Kong, Qinghong; Yang, Rui; Zhang, Yinping; Chen, Zuyao; Fan, Weicheng 2007-01-01 A kind of form stable phase change material (PCM) based on high density polyethylene (HDPE), paraffin, organophilic montmorillonite (OMT) and intumescent flame retardant (IFR) hybrids is prepared by using a twin screw extruder technique. This kind of form stable PCM is made of paraffin as a dispersed phase change material and HDPE as a supporting material. The structure of the montmorillonite (MMT) and OMT is characterized by X-ray diffraction (XRD) and high resolution electron microscopy (HREM). The analysis indicates that the MMT is a kind of lamellar structure, and the structure does not change after organic modification. However, the structure of the hybrid is evidenced by the XRD and scanning electronic microscope (SEM). Its thermal stability, latent heat and flame retardant properties are given by the Thermogravimetry analysis (TGA), differential scanning calorimeter (DSC) method and cone calorimeter, respectively. Synergy is observed between the OMT and IFR. The XRD result indicates that the paraffin intercalates into the silicate layers of the OMT, thus forming a typically intercalated hybrid. The SEM investigation and DSC result show that the additives of OMT and IFR have hardly any effect on the HDPE/paraffin three dimensional netted structure and the latent heat. In TGA curves, although the onset of weight loss of flame-retardant form stable PCMs occur at a lower temperature than that of form stable PCM, flame-retardant form stable PCMs produce a large amount of char residue at 700 o C. The synergy between OMT and IFR leads to the decrease of the heat release rate (HRR), contributing to improvement of the flammability performance 11. Few-layered MnO2/SWCNT hybrid in-plane supercapacitor with high energy density Science.gov (United States) Dutta, Shibsankar; Pal, Shreyasi; De, Sukanta 2018-05-01 In this present work we have synthesized few layered MnO2 nanosheets by mixed solvent exfoliation process for the application as electrode material of in-plane supercapacitor. The Structure and surface morphology of the as prepared samples are characterized by Raman, Transmission electron microscopy and Scanning electron microscopy. The patterns of the hybrids were directly fabricated by (50: 50 wt %) mixture of MnO2 and SWCNT dispersions with the help of a customized mask, and directly transferred onto a flexible PET substrate. Remarkably, the prepared in-plane supercapacitors deliver high energy density of 2.62mWh/cm2. Furthermore, our supercapacitors shows exceptional flexibility and stable performance under bending conditions 12. Flexible and freestanding supercapacitor based on nanostructured poly(m-aminophenol)/carbon nanofiber hybrid mats with high energy and power densities Science.gov (United States) Choudhury, Arup; Dey, Baban; Sinha Mahapatra, Susanta; Kim, Doo-Won; Yang, Kap-Seung; Yang, Duck-Joo 2018-04-01 Nanostructured poly(m-aminophenol) (PmAP) coated freestanding carbon nanofiber (CNF) mats were fabricated through simple in situ rapid-mixing polymerization of m-aminophenol in the presence of a CNF mat for flexible solid-state supercapacitors. The surface compositions, morphology and pore structure of the hybrid mats were characterized by using various techniques, e.g., FTIR, Raman, XRD, FE-SEM, TEM, and N2 absorption. The results show that the PmAP nanoparticles were homogeneously deposited on CNF surfaces and formed a thin flexible hybrid mat, which were directly used to made electrodes for electrochemical analysis without using any binders or conductive additives. The electrochemical performances of the hybrid mats were easily tailored by varying the PmAP loading on a hybrid electrode. The PmAP/CNF-10 hybrid electrode with a relatively low PmAP loading (> 42 wt%) showed a high specific capacitance of 325.8 F g-1 and a volumetric capacitance of 273.6 F cm-3 at a current density of 0.5 A g-1, together with a specific capacitance retention of 196.2 F g-1 at 20 A g-1. The PmAP/CNF-10 hybrid electrode showed good cycling stability with 88.2% capacitance retention after 5000 cycles. A maximum energy density of 45.2 Wh kg-1 and power density of 20.4 kW kg-1 were achieved for the PmAP/CNF-10 hybrid electrode. This facile and cost-effective synthesis of a flexible binder-free PmAP/CNF hybrid mat with excellent capacitive performances encourages its possible commercial exploitation. 13. Doping and defects in YBa2Cu3O7: Results from hybrid density functional theory KAUST Repository Schwingenschlögl, Udo 2012-06-21 Modified orbital occupation and inhomogeneous charge distribution in high-Tc oxide compounds due to doping and/or defects play a huge role for the material properties. To establish insight into the charge redistribution, we address metallic YBa2Cu3O7 in two prototypical configurations: Ca doped (hole doping) and O deficient (electron doping). By means of first principles calculations for fully relaxed structures, we evaluate the orbital occupations. We find that the change of the charge density, in particular in the CuO2 planes, shows a complex spatial pattern instead of the expected uniform (de-)population of the valence states. 14. A Morphing framework to couple non-local and local anisotropic continua KAUST Repository Azdoud, Yan 2013-05-01 In this article, we develop a method to couple anisotropic local continua with anisotropic non-local continua with central long-range forces. First, we describe anisotropic non-local models based on spherical harmonic descriptions. We then derive compatible classic continuum models. Finally, we apply the morphing method to these anisotropic non-local models and present three-dimensional numerical examples to validate the efficiency of the technique. © 2013 Elsevier Ltd. All rights reserved. 15. Multiple scattering theory for non-local and multichannel potentials Czech Academy of Sciences Publication Activity Database Natoli, C.R.; Krüger, P.; Hatada, K.; Hayakawa, K.; Sébilleau, D.; Šipr, Ondřej 2012-01-01 Roč. 24, č. 36 (2012), s. 1-20 ISSN 0953-8984 Institutional research plan: CEZ:AV0Z10100521 Keywords : multichannel scattering * correlation s * density matrix Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.355, year: 2012 16. A Hohenberg-Kohn theorem for non-local potentials International Nuclear Information System (INIS) Meron, E.; Katriel, J. 1977-01-01 It is shown that within any class of commuting one-body potentials a Hohenberg-Kohn type theorem is satisfied with respect to an appropriately defined density. The Hohenberg-Kohn theorem for local potentials follows as a special case. (Auth.) 17. Spectroscopic Investigation of the Canopy Configurations in Nanoparticle Organic Hybrid Materials of Various Grafting Densities during CO 2 Capture KAUST Repository Petit, Camille; Park, Youngjune; Lin, Kun-Yi Andrew; Park, Ah-Hyung Alissa 2012-01-01 Novel liquid-like nanoparticle organic hybrid materials (NOHMs) made of polyetheramine chains tethered onto functionalized silica nanoparticles were synthesized and characterized before and after exposure to CO 2 using NMR, Raman, and ATR FT-IR spectroscopies in order to investigate the effect of the grafting densities on the NOHM canopy structure. Considering the promising tunable properties for CO 2 capture of NOHMs, this study was conducted to provide important structural information to better design NOHMs for CO 2 capture. In order to minimize the CO 2 absorption via enthalpic effect and provide a more accurate assessment of the structural effects, the NOHMs were synthesized without task-specific groups. A greater chain ordering and decreased intermolecular interactions were observed in NOHMs compared to the unbound polymer. This was attributed to the specific structural arrangement of the frustrated canopy. The distinct configuration of grafted polymer chains caused different CO 2 packing and CO 2-induced swelling behaviors between the NOHMs and the unbound polymer. The grafting density influenced the ordering and coupling of the polymer chains and CO 2-induced swelling. Its effect on the CO 2 packing behavior was less pronounced. © 2011 American Chemical Society. 18. Spectroscopic Investigation of the Canopy Configurations in Nanoparticle Organic Hybrid Materials of Various Grafting Densities during CO 2 Capture KAUST Repository Petit, Camille 2012-01-12 Novel liquid-like nanoparticle organic hybrid materials (NOHMs) made of polyetheramine chains tethered onto functionalized silica nanoparticles were synthesized and characterized before and after exposure to CO 2 using NMR, Raman, and ATR FT-IR spectroscopies in order to investigate the effect of the grafting densities on the NOHM canopy structure. Considering the promising tunable properties for CO 2 capture of NOHMs, this study was conducted to provide important structural information to better design NOHMs for CO 2 capture. In order to minimize the CO 2 absorption via enthalpic effect and provide a more accurate assessment of the structural effects, the NOHMs were synthesized without task-specific groups. A greater chain ordering and decreased intermolecular interactions were observed in NOHMs compared to the unbound polymer. This was attributed to the specific structural arrangement of the frustrated canopy. The distinct configuration of grafted polymer chains caused different CO 2 packing and CO 2-induced swelling behaviors between the NOHMs and the unbound polymer. The grafting density influenced the ordering and coupling of the polymer chains and CO 2-induced swelling. Its effect on the CO 2 packing behavior was less pronounced. © 2011 American Chemical Society. 19. A comprehensive hybridization model allows whole HERV transcriptome profiling using high density microarray. Science.gov (United States) Becker, Jérémie; Pérot, Philippe; Cheynet, Valérie; Oriol, Guy; Mugnier, Nathalie; Mommert, Marine; Tabone, Olivier; Textoris, Julien; Veyrieras, Jean-Baptiste; Mallet, François 2017-04-08 Human endogenous retroviruses (HERVs) have received much attention for their implications in the etiology of many human diseases and their profound effect on evolution. Notably, recent studies have highlighted associations between HERVs expression and cancers (Yu et al., Int J Mol Med 32, 2013), autoimmunity (Balada et al., Int Rev Immunol 29:351-370, 2010) and neurological (Christensen, J Neuroimmune Pharmacol 5:326-335, 2010) conditions. Their repetitive nature makes their study particularly challenging, where expression studies have largely focused on individual loci (De Parseval et al., J Virol 77:10414-10422, 2003) or general trends within families (Forsman et al., J Virol Methods 129:16-30, 2005; Seifarth et al., J Virol 79:341-352, 2005; Pichon et al., Nucleic Acids Res 34:e46, 2006). To refine our understanding of HERVs activity, we introduce here a new microarray, HERV-V3. This work was made possible by the careful detection and annotation of genomic HERV/MaLR sequences as well as the development of a new hybridization model, allowing the optimization of probe performances and the control of cross-reactions.﻿﻿﻿ RESULTS: HERV-V3 offers an almost complete coverage of HERVs and their ancestors (mammalian apparent LTR-retrotransposons, MaLRs) at the locus level along with four other repertoires (active LINE-1 elements, lncRNA, a selection of 1559 human genes and common infectious viruses). We demonstrate that HERV-V3 analytical performances are comparable with commercial Affymetrix arrays, and that for a selection of tissue/pathological specific loci, the patterns of expression measured on HERV-V3 is consistent with those reported in the literature. Given its large HERVs/MaLRs coverage and additional repertoires, HERV-V3 opens the door to multiple applications such as enhancers and alternative promoters identification, biomarkers identification as well as the characterization of genes and HERVs/MaLRs modulation caused by viral infection. 20. Non-local currents in 2D QFT: an alternative To - the quantum inverse scattering method International Nuclear Information System (INIS) Bernard, D.; Leclair, A.; Cornell Univ., Ithaca, NY 1990-01-01 The formalism based on non-local charges that we propose provides an alternative to the quantum inverse scattering method for solving integrable quantum field theories in 2D. The content of the paper is: 1. Introduction: historical background. 2. The NLC approach to 2D QFT: a summary. 3 Exchange algebras and on-shell conservation laws: why non-local charges are useful. 4. The lattice construction: the geometrical origin of non-local conserved currents. 5. The continuum construction: how to deal with non-local conserved currents. 6. Examples: Yangian and quantum group currents. 7 Conclusions: open problems. 22 refs., 4 figs 1. A Hybrid Density Functional Theory/Molecular Mechanics Approach for Linear Response Properties in Heterogeneous Environments. Science.gov (United States) Rinkevicius, Zilvinas; Li, Xin; Sandberg, Jaime A R; Mikkelsen, Kurt V; Ågren, Hans 2014-03-11 We introduce a density functional theory/molecular mechanical approach for computation of linear response properties of molecules in heterogeneous environments, such as metal surfaces or nanoparticles embedded in solvents. The heterogeneous embedding environment, consisting from metallic and nonmetallic parts, is described by combined force fields, where conventional force fields are used for the nonmetallic part and capacitance-polarization-based force fields are used for the metallic part. The presented approach enables studies of properties and spectra of systems embedded in or placed at arbitrary shaped metallic surfaces, clusters, or nanoparticles. The capability and performance of the proposed approach is illustrated by sample calculations of optical absorption spectra of thymidine absorbed on gold surfaces in an aqueous environment, where we study how different organizations of the gold surface and how the combined, nonadditive effect of the two environments is reflected in the optical absorption spectrum. 2. Correction: General optimization procedure towards the design of a new family of minimal parameter spin-component-scaled double-hybrid density functional theory. Science.gov (United States) Roch, Loïc M; Baldridge, Kim K 2018-02-07 Correction for 'General optimization procedure towards the design of a new family of minimal parameter spin-component-scaled double-hybrid density functional theory' by Loïc M. Roch and Kim K. Baldridge, Phys. Chem. Chem. Phys., 2017, 19, 26191-26200. 3. Application of double-hybrid density functionals to charge transfer in N-substituted pentacenequinones. Science.gov (United States) Sancho-García, J C 2012-05-07 A set of N-heteroquinones, deriving from oligoacenes, have been recently proposed as n-type organic semiconductors with high electron mobilities in thin-film transistors. Generally speaking, this class of compounds self-assembles in neighboring π-stacks linked by weak hydrogen bonds. We aim at theoretically characterizing here the sequential charge transport (hopping) process expected to take place across these arrays of molecules. To do so, we need to accurately address the preferred packing of these materials simultaneously to single-molecule properties related to charge-transfer events, carefully employing dispersion-corrected density functional theory methods to accurately extract the key molecular parameters governing this phenomenon at the nanoscale. This study confirms the great deal of interest around these compounds, since controlled functionalization of model molecules (i.e., pentacene) allows to efficiently tune the corresponding charge mobilities, and the capacity of modern quantum-chemical methods to predict it after rationalizing the underlying structure-property relationships. 4. High Density Polyethylene Composites Reinforced with Hybrid Inorganic Fillers: Morphology, Mechanical and Thermal Expansion Performance Directory of Open Access Journals (Sweden) Birm-June Kim 2013-09-01 Full Text Available The effect of individual and combined talc and glass fibers (GFs on mechanical and thermal expansion performance of the filled high density polyethylene (HDPE composites was studied. Several published models were adapted to fit the measured tensile modulus and strength of various composite systems. It was shown that the use of silane-modified GFs had a much larger effect in improving mechanical properties and in reducing linear coefficient of thermal expansion (LCTE values of filled composites, compared with the use of un-modified talc particles due to enhanced bonding to the matrix, larger aspect ratio, and fiber alignment for GFs. Mechanical properties and LCTE values of composites with combined talc and GF fillers varied with talc and GF ratio at a given total filler loading level. The use of a larger portion of GFs in the mix can lead to better composite performance, while the use of talc can help lower the composite costs and increase its recyclability. The use of 30 wt % combined filler seems necessary to control LCTE values of filled HDPE in the data value range generally reported for commercial wood plastic composites. Tensile modulus for talc-filled composite can be predicted with rule of mixture, while a PPA-based model can be used to predict the modulus and strength of GF-filled composites. 5. High Density Polyethylene Composites Reinforced with Hybrid Inorganic Fillers: Morphology, Mechanical and Thermal Expansion Performance. Science.gov (United States) Huang, Runzhou; Xu, Xinwu; Lee, Sunyoung; Zhang, Yang; Kim, Birm-June; Wu, Qinglin 2013-09-17 The effect of individual and combined talc and glass fibers (GFs) on mechanical and thermal expansion performance of the filled high density polyethylene (HDPE) composites was studied. Several published models were adapted to fit the measured tensile modulus and strength of various composite systems. It was shown that the use of silane-modified GFs had a much larger effect in improving mechanical properties and in reducing linear coefficient of thermal expansion (LCTE) values of filled composites, compared with the use of un-modified talc particles due to enhanced bonding to the matrix, larger aspect ratio, and fiber alignment for GFs. Mechanical properties and LCTE values of composites with combined talc and GF fillers varied with talc and GF ratio at a given total filler loading level. The use of a larger portion of GFs in the mix can lead to better composite performance, while the use of talc can help lower the composite costs and increase its recyclability. The use of 30 wt % combined filler seems necessary to control LCTE values of filled HDPE in the data value range generally reported for commercial wood plastic composites. Tensile modulus for talc-filled composite can be predicted with rule of mixture, while a PPA-based model can be used to predict the modulus and strength of GF-filled composites. 6. Application of Inkjet Printing in High-Density Pixelated RGB Quantum Dot-Hybrid LEDs KAUST Repository Haverinen, Hanna 2012-05-23 Recently, an intriguing solution to obtain better color purity has been to introduce inorganic emissive quantum dots (QDs) into an otherwise OLED structure. The emphasis of this chapter is to present a simple discussion of the first attempts to fabricate high-density, pixelated (quarter video graphics array (QVGA) format), monochromatic and RGB quantum dots light-emitting diodes (QDLEDs), where inkjet printing is used to deposit the light-emitting layer of QDs. It shows some of the factors that have to be considered in order to achieve the desired accuracy and printing quality. The successful operation of the RGB printed devices indicates the potential of the inkjet printing approach in the fabrication of full-color QDLEDs for display application. However, further optimization of print quality is still needed in order to eliminate the formation of pinholes, thus maximizing energy transfer from organic layers to the QDs and in turn increasing the performance of the devices. Controlled Vocabulary Terms: ink jet printing; LED displays; LED lamps; organic light emitting diodes; quantum dots 7. Synthesis of Polyimides in Molecular-Scale Confinement for Low-Density Hybrid Nanocomposites. Science.gov (United States) Isaacson, Scott G; Fostvedt, Jade I; Koerner, Hilmar; Baur, Jeffery W; Lionti, Krystelle; Volksen, Willi; Dubois, Geraud; Dauskardt, Reinhold H 2017-11-08 In this work, we exploit a confinement-induced molecular synthesis and a resulting bridging mechanism to create confined polyimide thermoset nanocomposites that couple molecular confinement-enhanced toughening with an unprecedented combination of high-temperature properties at low density. We describe a synthesis strategy that involves the infiltration of individual polymer chains through a nanoscale porous network while simultaneous imidization reactions increase the molecular backbone stiffness. In the extreme limit where the confinement length scale is much smaller than the polymer's molecular size, confinement-induced molecular mechanisms give rise to exceptional mechanical properties. We find that polyimide oligomers can undergo cross-linking reactions even in such molecular-scale confinement, increasing the molecular weight of the organic phase and toughening the nanocomposite through a confinement-induced energy dissipation mechanism. This work demonstrates that the confinement-induced molecular bridging mechanism can be extended to thermoset polymers with multifunctional properties, such as excellent thermo-oxidative stability and high service temperatures (>350 °C). 8. High energy density layered-spinel hybrid cathodes for lithium ion rechargeable batteries Energy Technology Data Exchange (ETDEWEB) Basu, S., E-mail: sbasumajumder@yahoo.com [Department of Physics, Indian Institute of Technology Kharagpur, Kharagpur 721 302 (India); Dahiya, P.P.; Akhtar, Mainul [Materials Science Center, Indian Institute of Technology Kharagpur, Kharagpur 721 302 (India); Ray, S.K. [Department of Physics, Indian Institute of Technology Kharagpur, Kharagpur 721 302 (India); Chang, J.K. [Institute of Materials Science and Engineering, National Central University, Taiwan (China); Majumder, S.B. [Materials Science Center, Indian Institute of Technology Kharagpur, Kharagpur 721 302 (India) 2016-11-15 Highlights: • Structural integration of layered domains in spinel matrix of the composite particles. • Highest discharge capacity (275 mAh g{sup −1}) in composite with 30.0 mole% Li{sub 2}MnO{sub 3}. • Reasonably good rate capability of layered-spinel composite cathode. • Capacity fading with cycling is related to cubic to tetragonal structural phase transition. - Abstract: High energy density Li{sub 2}MnO{sub 3} (layered)–LiMn{sub 1.5}Ni{sub 0.5}O{sub 4} (spinel) composite cathodes have been synthesized using auto-combustion route. Rietveld refinements together with the analyses of high resolution transmission electron micrographs confirm the structural integration of Li{sub 2}MnO{sub 3} nano-domains into the LiMn{sub 1.5}Ni{sub 0.5}O{sub 4} matrix of the composite cathodes. The discharge capacity of the composite cathodes are due to the intercalation of Li{sup +} ion in the tetrahedral (8a) and octahedral (16c) sites of the spinel component and also the insertion of Li{sup +} in the freshly prepared MnO{sub 2} lattice, formed after Li{sub 2}O extraction from the Li{sub 2}MnO{sub 3} domains. The capacity fading of the composite cathodes are explained to be due to the layered to spinel transition of the Li{sub 2}MnO{sub 3} component and Li{sup +} insertion into the octahedral site of the spinel lattices which trigger cubic to tetragonal phase transition resulting volume expansion which eventually retard the Li{sup +} intercalation with cycling. 9. A generalized non-local optical response theory for plasmonic nanostructures DEFF Research Database (Denmark) Mortensen, N. Asger; Raza, Søren; Wubs, Martijn 2014-01-01 for their description. Here instead we present a comparatively simple semiclassical generalized non-local optical response theory that unifies quantum pressure convection effects and induced charge diffusion kinetics, with a concomitant complex-valued generalized non-local optical response parameter. Our theory... 10. Local and non-local equivalent potentials for p-12C scattering International Nuclear Information System (INIS) Lovell, A.; Amos, K. 2000-01-01 A Newton-Sabatier fixed energy inversion scheme has been used to equate inherently non-local p- 12 C potentials at a variety of energies to pion threshold, with exactly phase equivalent local ones. Those energy dependent local potentials then have been recast in the form of non-local Frahn-Lemmer interactions 11. Bosonization, dual transformation and non-local hidden symmetry in two dimensions International Nuclear Information System (INIS) Hata, Hiroyuki 1985-01-01 The non-local hidden symmetry is investigated in the bosonized non-abelian Thirring model and the dual representation of the chiral model. In these representations the first non-local symmetry is spontaneously broken in naive pertubation theory. (orig.) 12. Surface effects on static bending of nanowires based on non-local elasticity theory Directory of Open Access Journals (Sweden) Quan Wu 2015-10-01 Full Text Available The surface elasticity and non-local elasticity effects on the elastic behavior of statically bent nanowires are investigated in the present investigation. Explicit solutions are presented to evaluate the surface stress and non-local elasticity effects with various boundary conditions. Compared with the classical Euler beam, a nanowire with surface stress and/or non-local elasticity can be either stiffer or less stiff, depending on the boundary conditions. The concept of surface non-local elasticity was proposed and its physical interpretation discussed to explain the combined effect of surface elasticity and non-local elasticity. The effect of the nanowire size on its elastic bending behavior was investigated. The results obtained herein are helpful to characterize mechanical properties of nanowires and aid nanowire-based devices design. 13. Three-body models of the 6ΛΛHe and 9ΛBe hypernuclei with non-local interactions International Nuclear Information System (INIS) Theeten, M.; Baye, D.; Descouvemont, P. 2005-01-01 A three-body model involving non-local interactions is developed in configuration space. It is based on a hyperspherical-harmonics expansion and the Lagrange-mesh method. The 6 ΛΛ He and 9 Λ Be hypernuclei are studied as three-body αΛΛ and ααΛ systems. Recently proposed quark-model based ΛN and ΛΛ interactions are used. A non-local Λα interaction is obtained by folding the ΛN interaction with a Gaussian α density. Various phenomenological αα interactions are employed. The results agree within 1 keV with recent Faddeev calculations in momentum space. Energies and radii of 6 ΛΛ He and 9 Λ Be are compared with a purely local model. The B(E2) between the 9 Λ Be bound states is also calculated. The role of non-locality is discussed 14. Magnetic Exchange Couplings from Semilocal Functionals Evaluated Nonself-Consistently on Hybrid Densities: Insights on Relative Importance of Exchange, Correlation, and Delocalization. Science.gov (United States) Phillips, Jordan J; Peralta, Juan E 2012-09-11 Semilocal functionals generally yield poor magnetic exchange couplings for transition-metal complexes, typically overpredicting in magnitude the experimental values. Here we show that semilocal functionals evaluated nonself-consistently on densities from hybrid functionals can yield magnetic exchange couplings that are greatly improved with respect to their self-consistent semilocal values. Furthermore, when semilocal functionals are evaluated nonself-consistently on densities from a "half-and-half" hybrid, their errors with respect to experimental values can actually be lower than those from self-consistent calculations with standard hybrid functionals such as PBEh or TPSSh. This illustrates that despite their notoriously poor performance for exchange couplings, for many systems semilocal functionals are capable of delivering accurate relative energies for magnetic states provided that their electron delocalization error is corrected. However, while self-consistent calculations with hybrids uniformly improve results for all complexes, evaluating nonself-consistently with semilocal functionals does not give a balanced improvement for both ferro- and antiferromagnetically coupled complexes, indicating that there is more at play with the overestimation problem than simply the delocalization error. Additionally, we show that for some systems the conventional wisdom of choice of exchange functional mattering more than correlation does not hold. This combined with results from the nonself-consistent calculations provide insight on clarifying the relative roles of exchange, correlation, and delocalization in calculating magnetic exchange coupling parameters in Kohn-Sham Density Functional Theory. 15. Effects of B site doping on electronic structures of InNbO4 based on hybrid density functional calculations Science.gov (United States) Lu, M. F.; Zhou, C. P.; Li, Q. Q.; Zhang, C. L.; Shi, H. F. 2018-01-01 In order to improve the photocatalytic activity under visible-light irradiation, we adopted first principle calculations based on density functional theory (DFT) to calculate the electronic structures of B site transition metal element doped InNbO4. The results indicated that the complete hybridization of Nb 4d states and some Ti 3d states contributed to the new conduction band of Ti doped InNbO4, barely changing the position of band edge. For Cr doping, some localized Cr 3d states were introduced into the band gap. Nonetheless, the potential of localized levels was too positive to cause visible-light reaction. When it came to Cu doping, the band gap was almost same with that of InNbO4 as well as some localized Cu 3d states appeared above the top of VB. The introduction of localized energy levels benefited electrons to migrate from valence band (VB) to conduction band (CB) by absorbing lower energy photons, realizing visible-light response. 16. Non-local electron transport through normal and topological ladder-like atomic systems Science.gov (United States) Kurzyna, Marcin; Kwapiński, Tomasz 2018-05-01 We propose a locally protected ladder-like atomic system (nanoconductor) on a substrate that is insensitive to external perturbations. The system corresponds to coupled atomic chains fabricated on different surfaces. Electron transport properties of such conductors are studied theoretically using the model tight-binding Su-Schriffer-Hegger (SSH) Hamiltonian and Green's function formalism. We have found that the conductance of the system is almost insensitive to single adatoms and oscillates as a function of the side chain length with very large periods. Non-local character of the electron transport was observed also for topological SSH chains where nontrivial end states survive in the presence of disturbances as well as for different substrates. We have found that the careful inspection of the density of states or charge waves can provide the information about the atom energy levels and hopping amplitudes. Moreover, the ladder-like geometry allows one to distinguish between normal and topological zero-energy states. It is important that topological chains do not reveal Friedel oscillations which are observed in non-topological chains. 17. Local and non-local potentials for deuteron elastic scattering International Nuclear Information System (INIS) Ramirez, J.A. 1976-01-01 The nucleon--nucleus local potential (central and spin--orbit) and the deuteron--nucleus nonlocal potential (central, spin--orbit, spin--radial tensor) are calculated by the folding-model (FM). Simple analytic expressions are obtained for the nucleon--nucleus potential by the use of Gaussians to represent the nucleon--nucleus potential and the charge and mass densities of the target. The analytic expressions give qualitative descriptions of phenomenological nucleon--nucleus interactions. A systematic target--mass dependence of realistic local FM deueron potentials is also included. Local-equivalent, energy-dependent, deuteron potentials are obtained from the nonlocal FM deuteron potentials and the energy dependence of the local potential parameters are presented. The local FM deuteron potential is tested for 60 Ni(d,d) 60 Ni at E/sub α/ = 15 MeV by comparing the predictions of the FM potentials with data in which all five polarization moments were measured. A qualitative fit to the data is obtained, but it overestimates the volume integral of the central potential by 7%. Energy-dependence effects are estimated by evaluating the local-equivalent potentials at E/sub α/ = 30 MeV and comparing the predictions to the E/sub α/ = 15 MeV potentials. The energy dependence of the central potential dominates the angular dependence of all five observables while the energy dependence of the spin--orbit and tensor potentials produces only scale changes (approx. 3%) in the vector and tensor analyzing powers. The scattering formalism for a spin-1 on a spin-0 target nucleus, and a description of the coupled--channels computer code DDUNC1 which treats the spin--radial tensor potential exactly, are included 18. The small length scale effect for a non-local cantilever beam: a paradox solved. Science.gov (United States) Challamel, N; Wang, C M 2008-08-27 Non-local continuum mechanics allows one to account for the small length scale effect that becomes significant when dealing with microstructures or nanostructures. This paper presents some simplified non-local elastic beam models, for the bending analyses of small scale rods. Integral-type or gradient non-local models abandon the classical assumption of locality, and admit that stress depends not only on the strain value at that point but also on the strain values of all points on the body. There is a paradox still unresolved at this stage: some bending solutions of integral-based non-local elastic beams have been found to be identical to the classical (local) solution, i.e. the small scale effect is not present at all. One example is the Euler-Bernoulli cantilever nanobeam model with a point load which has application in microelectromechanical systems and nanoelectromechanical systems as an actuator. In this paper, it will be shown that this paradox may be overcome with a gradient elastic model as well as an integral non-local elastic model that is based on combining the local and the non-local curvatures in the constitutive elastic relation. The latter model comprises the classical gradient model and Eringen's integral model, and its application produces small length scale terms in the non-local elastic cantilever beam solution. 19. High order scheme for the non-local transport in ICF plasmas Energy Technology Data Exchange (ETDEWEB) Feugeas, J.L.; Nicolai, Ph.; Schurtz, G. [Bordeaux-1 Univ., Centre Lasers Intenses et Applications (UMR 5107), 33 - Talence (France); Charrier, P.; Ahusborde, E. [Bordeaux-1 Univ., MAB, 33 - Talence (France) 2006-06-15 A high order practical scheme for a model of non-local transport is here proposed to be used in multidimensional radiation hydrodynamic codes. A high order scheme is necessary to solve non-local problems on strongly deformed meshes that are on hot point or ablation front zones. It is shown that the errors made by a classical 5 point scheme on a disturbed grid can be of the same order of magnitude as the non-local effects. The use of a 9 point scheme in a simulation of inertial confinement fusion appears to be essential. 20. The hybrid nanostructure of MnCo2O4.5 nanoneedle/carbon aerogel for symmetric supercapacitors with high energy density Science.gov (United States) Hao, Pin; Zhao, Zhenhuan; Li, Liyi; Tuan, Chia-Chi; Li, Haidong; Sang, Yuanhua; Jiang, Huaidong; Wong, C. P.; Liu, Hong 2015-08-01 Current applications of carbon-based supercapacitors are limited by their low energy density. One promising strategy to enhance the energy density is to couple metal oxides with carbon materials. In this study, a porous MnCo2O4.5 nanoneedle/carbon aerogel hybrid nanostructure was synthesized by assembling MnCo2O4.5 nanoneedle arrays on the surface of channel walls of hierarchical porous carbon aerogels derived from chitosan for the supercapacitor application. The synthetic process of the hybrid nanostructure involves two steps, i.e. the growth of Mn-Co precursors on carbon aerogel by a hydrothermal process and the conversion of the precursor into MnCo2O4.5 nanoneedles by calcination. The carbon aerogel exhibits a high electrical conductivity, high specific surface area and porous structure, ensuring high electrochemical performance of the hybrid nanostructure when coupled with the porous MnCo2O4.5 nanoneedles. The symmetric supercapacitor using the MnCo2O4.5 nanoneedle/carbon aerogel hybrid nanostructure as the active electrode material exhibits a high energy density of about 84.3 Wh kg-1 at a power density of 600 W kg-1. The voltage window is as high as 1.5 V in neutral aqueous electrolytes. Due to the unique nanostructure of the electrodes, the capacitance retention reaches 86% over 5000 cycles.Current applications of carbon-based supercapacitors are limited by their low energy density. One promising strategy to enhance the energy density is to couple metal oxides with carbon materials. In this study, a porous MnCo2O4.5 nanoneedle/carbon aerogel hybrid nanostructure was synthesized by assembling MnCo2O4.5 nanoneedle arrays on the surface of channel walls of hierarchical porous carbon aerogels derived from chitosan for the supercapacitor application. The synthetic process of the hybrid nanostructure involves two steps, i.e. the growth of Mn-Co precursors on carbon aerogel by a hydrothermal process and the conversion of the precursor into MnCo2O4.5 nanoneedles by 1. 1D Ni-Co oxide and sulfide nanoarray/carbon aerogel hybrid nanostructures for asymmetric supercapacitors with high energy density and excellent cycling stability. Science.gov (United States) Hao, Pin; Tian, Jian; Sang, Yuanhua; Tuan, Chia-Chi; Cui, Guanwei; Shi, Xifeng; Wong, C P; Tang, Bo; Liu, Hong 2016-09-15 The fabrication of supercapacitor electrodes with high energy density and excellent cycling stability is still a great challenge. A carbon aerogel, possessing a hierarchical porous structure, high specific surface area and electrical conductivity, is an ideal backbone to support transition metal oxides and bring hope to prepare electrodes with high energy density and excellent cycling stability. Therefore, NiCo 2 S 4 nanotube array/carbon aerogel and NiCo 2 O 4 nanoneedle array/carbon aerogel hybrid supercapacitor electrode materials were synthesized by assembling Ni-Co precursor needle arrays on the surface of the channel walls of hierarchical porous carbon aerogels derived from chitosan in this study. The 1D nanostructures grow on the channel surface of the carbon aerogel vertically and tightly, contributing to the enhanced electrochemical performance with ultrahigh energy density. The energy density of NiCo 2 S 4 nanotube array/carbon aerogel and NiCo 2 O 4 nanoneedle array/carbon aerogel hybrid asymmetric supercapacitors can reach up to 55.3 Wh kg -1 and 47.5 Wh kg -1 at a power density of 400 W kg -1 , respectively. These asymmetric devices also displayed excellent cycling stability with a capacitance retention of about 96.6% and 92% over 5000 cycles. 2. Off-shell t-matrix for an exponential potential with non-local core interaction International Nuclear Information System (INIS) Sarkar, S.B.; Talukdar, B.; Chattarji, D. 1975-01-01 The wave function approach of Van Leeuwen and Reiner to the t-matrix is generalized to the case of a non-local potential. The transition matrix element for this potential is obtained. The results are used to compute the s-wave part of the t-matrix for a non-local square well potential combined with an outside exponential potential. (Auth.) 3. The Green’s functions for peridynamic non-local diffusion Science.gov (United States) Wang, L. J.; Xu, J. F. 2016-01-01 In this work, we develop the Green’s function method for the solution of the peridynamic non-local diffusion model in which the spatial gradient of the generalized potential in the classical theory is replaced by an integral of a generalized response function in a horizon. We first show that the general solutions of the peridynamic non-local diffusion model can be expressed as functionals of the corresponding Green’s functions for point sources, along with volume constraints for non-local diffusion. Then, we obtain the Green’s functions by the Fourier transform method for unsteady and steady diffusions in infinite domains. We also demonstrate that the peridynamic non-local solutions converge to the classical differential solutions when the non-local length approaches zero. Finally, the peridynamic analytical solutions are applied to an infinite plate heated by a Gauss source, and the predicted variations of temperature are compared with the classical local solutions. The peridynamic non-local diffusion model predicts a lower rate of variation of the field quantities than that of the classical theory, which is consistent with experimental observations. The developed method is applicable to general diffusion-type problems. PMID:27713658 4. Positronium annihilation in liquids in the framework of non-local interaction International Nuclear Information System (INIS) Mukherjee, Tapas; Dutta, Dhanadeep 2012-01-01 In the bubble model of ortho positronium (o-Ps) annihilation in liquid the origin of the trapping of o-Ps is the electron-exchange repulsive interaction between the electron of o-Ps and the electron of the medium. The corresponding effective interaction is non-local in nature. However, in the prevalent bubble model, this effective interaction is usually treated as local (model) potential (sharp or smooth). In the present study, we have taken an approach to consider this trapping interaction as non-local in nature, which is included through a model separable non-local function to tackle the problem in analytically solvable manner. The analytical calculations show that this non-local interaction effectively acts as a gauge potential in the energy of the Ps atom in parameter (bubble radius) space. The computed bubble variables obtained using experimental Ps annihilation data are shown. A comparison between the present data with the calculated results using prevalent bubble model has been presented. Discussions have been made on the input parameter dependencies of the computed data. - Highlights: ► Bubble model has been modified by considering positronium-atom non-local interaction. ► No straight forward correlation between bubble size and effective potential is observed. ► Non-local potential acts as a guage potential. 5. Experimental benchmark of non-local-thermodynamic-equilibrium plasma atomic physics codes International Nuclear Information System (INIS) Nagels-Silvert, V. 2004-09-01 The main purpose of this thesis is to get experimental data for the testing and validation of atomic physics codes dealing with non-local-thermodynamical-equilibrium plasmas. The first part is dedicated to the spectroscopic study of xenon and krypton plasmas that have been produced by a nanosecond laser pulse interacting with a gas jet. A Thomson scattering diagnostic has allowed us to measure independently plasma parameters such as electron temperature, electron density and the average ionisation state. We have obtained time integrated spectra in the range between 5 and 10 angstroms. We have identified about one hundred xenon rays between 8.6 and 9.6 angstroms via the use of the Relac code. We have discovered unknown rays for the krypton between 5.2 and 7.5 angstroms. In a second experiment we have extended the wavelength range to the X UV domain. The Averroes/Transpec code has been tested in the ranges from 9 to 15 angstroms and from 10 to 130 angstroms, the first range has been well reproduced while the second range requires a more complex data analysis. The second part is dedicated to the spectroscopic study of aluminium, selenium and samarium plasmas in femtosecond operating rate. We have designed an interferometry diagnostic in the frequency domain that has allowed us to measure the expanding speed of the target's backside. Via the use of an adequate isothermal model this parameter has led us to know the plasma electron temperature. Spectra and emission times of various rays from the aluminium and selenium plasmas have been computed satisfactorily with the Averroes/Transpec code coupled with Film and Multif hydrodynamical codes. (A.C.) 6. A solid-state hybrid density functional theory study of Prussian blue analogues and related chlorides at pressure Energy Technology Data Exchange (ETDEWEB) Middlemiss, Derek S; Lawton, Lorreta M; Wilson, Chick C [Department of Chemistry and WestCHEM Research School, University Avenue, University of Glasgow, Glasgow G12 8QQ (United Kingdom)], E-mail: c.c.wilson@chem.gla.ac.uk 2008-08-20 The variations with pressure in the structural, electronic and magnetic properties of a series of Prussian blue analogues (PBAs) K{sup I}M{sup II}[Cr{sup III}(CN){sub 6}] (M = V{sup II}, Mn{sup II} and Ni{sup II}) and associated isomorphous chlorides K{sup I}M{sup II}Cr{sup III}Cl{sub 6} are investigated within a series of solid-state hybrid density functional calculations. The sensitivity of the computed properties to the choice of Hamiltonian is tested by application of functionals containing 35%, 65% and 100% admixtures of Fock exchange. Magnetic coupling constants (J) are obtained at a range of cell volumes (V), with fits of the Bloch relationship (J {proportional_to} V{sup -{epsilon}}, {epsilon} typically 3-4) yielding exponents {epsilon} in the ranges 5.16-6.34, 8.48-12.07 and 4.00-4.51 for the antiferromagnetic (AF) V{sup II}Cr{sup III}-, ferrimagnetic (FI) Mn{sup II}Cr{sup III}- and ferromagnetic (FO) Ni{sup II}Cr{sup III} PBAs, respectively; and 3.33-4.99, 1.86-3.09 and 1.65-3.28 for the AF V{sup II}Cr{sup III}-, FO Mn{sup II}Cr{sup III}- and FO Ni{sup II}Cr{sup III} chlorides, respectively. The Mn{sup II}Cr{sup III} PBA range encloses the high values {epsilon}{approx}9-10 obtained in a recent joint experimental and theoretical study, and it is suggested that this strong magnetostructural effect arises due to the presence of competing AF and FO interactions in this material. Estimates of the spin ordering temperatures derived from the combination of the 35%-functional couplings with a mean field approach are in good agreement with experiment in the V{sup II}Cr{sup III} and Ni{sup II}Cr{sup III} PBAs, but are too low in the Mn{sup II}Cr{sup III} system. The variations with pressure in the structural parameters, charges and spin moments are also detailed, the PBA and chloride energy-volume data yielding bulk moduli in the ranges 39-53 and 36-50 GPa, respectively. Finally, the energies governing CN{sup -} ligand isomerization are estimated and successfully 7. Measurements of the parallel wavenumber of lower hybrid waves in the scrape-off layer of a high-density tokamak International Nuclear Information System (INIS) Baek, S. G.; Wallace, G. M.; Parker, R. R.; Shiraiwa, S.; Bonoli, P. T.; Brunner, D.; Faust, I.; LaBombard, B. L.; Wukitch, S.; Shinya, T.; Takase, Y. 2016-01-01 In lower hybrid current drive (LHCD) experiments on tokamaks, the parallel wavenumber of lower hybrid waves is an important physics parameter that governs the wave propagation and absorption physics. However, this parameter has not been experimentally well-characterized in the present-day high density tokamaks, despite the advances in the wave physics modeling. In this paper, we present the first measurement of the dominant parallel wavenumber of lower hybrid waves in the scrape-off layer (SOL) of the Alcator C-Mod tokamak with an array of magnetic loop probes. The electric field strength measured with the probe in typical C-Mod plasmas is about one-fifth of that of the electric field at the mouth of the grill antenna. The amplitude and phase responses of the measured signals on the applied power spectrum are consistent with the expected wave energy propagation. At higher density, the observed k || increases for the fixed launched k || , and the wave amplitude decreases rapidly. This decrease is correlated with the loss of LHCD efficiency at high density, suggesting the presence of loss mechanisms. Evidence of the spectral broadening mechanisms is observed in the frequency spectra. However, no clear modifications in the dominant k || are observed in the spectrally broadened wave components, as compared to the measured k || at the applied frequency. It could be due to (1) the probe being in the SOL and (2) the limited k || resolution of the diagnostic. Future experiments are planned to investigate the roles of the observed spectral broadening mechanisms on the LH density limit problem in the strong single pass damping regime. 8. Hybrid composites CSIR Research Space (South Africa) Jacob John, Maya 2009-04-01 Full Text Available mixed short sisal/glass hybrid fibre reinforced low density polyethylene composites was investigated by Kalaprasad et al [25].Chemical surface modifications such as alkali, acetic anhydride, stearic acid, permanganate, maleic anhydride, silane... 9. More about the comparison of local and non-local NN interaction models International Nuclear Information System (INIS) Amghar, A.; Desplanques, B. 2003-01-01 The effect of non-locality in the NN interaction with an off-energy shell character has been studied in the past in relation with the possibility that some models could be approximately phase-shifts equivalent. This work is extended to a non-locality implying terms that involve an anticommutator with the operator p 2 . It includes both scalar and tensor components. The most recent 'high accuracy' models are considered in the analysis. After studying the deuteron wave functions, electromagnetic properties of various models are compared with the idea that these ones differ by their non-locality but are equivalent up to a unitary transformation. It is found that the extra non-local tensor interaction considered in this work tends to re-enforce the role of the term considered in previous works, allowing one to explain almost completely the difference in the deuteron D-state probabilities evidenced by the comparison of the Bonn-QB and Paris models for instance. Conclusions for the effect of the non-local scalar interaction are not so clear. In many cases, it was found that these terms could explain part of the differences that the comparison of predictions for various models evidences but cases where they could not were also found. Some of these last ones have been analyzed in order to pointing out the origin of the failure 10. Electrically and Thermally Conductive Low Density Polyethylene-Based Nanocomposites Reinforced by MWCNT or Hybrid MWCNT/Graphene Nanoplatelets with Improved Thermo-Oxidative Stability Directory of Open Access Journals (Sweden) Sandra Paszkiewicz 2018-04-01 Full Text Available In this paper, the electrical and thermal conductivity and morphological behavior of low density polyethylene (LDPE/multi-walled carbon nanotubes (MWCNTs + graphene nanoplatelets (GNPs hybrid nanocomposites (HNCs have been studied. The distribution of MWCNTs and the hybrid of MWCNTs/GNPs within the polymer matrix has been investigated with scanning electron microscopy (SEM. The results showed that the thermal and electrical conductivity of the LDPE-based nanocomposites increased along with the increasing content of carbon nanofillers. However, one could observe greater improvement in the thermal and electrical conductivity when only MWCNTs have been incorporated. Moreover, the improvement in tensile properties and thermal stability has been observed when carbon nanofillers have been mixed with LDPE. At the same time, the increasing content of MWCNTs and MWCNTs/GNPs caused an increase in the melt viscosity with only little effect on phase transition temperatures. 11. Electrically and Thermally Conductive Low Density Polyethylene-Based Nanocomposites Reinforced by MWCNT or Hybrid MWCNT/Graphene Nanoplatelets with Improved Thermo-Oxidative Stability. Science.gov (United States) Paszkiewicz, Sandra; Szymczyk, Anna; Pawlikowska, Daria; Subocz, Jan; Zenker, Marek; Masztak, Roman 2018-04-22 In this paper, the electrical and thermal conductivity and morphological behavior of low density polyethylene (LDPE)/multi-walled carbon nanotubes (MWCNTs) + graphene nanoplatelets (GNPs) hybrid nanocomposites (HNCs) have been studied. The distribution of MWCNTs and the hybrid of MWCNTs/GNPs within the polymer matrix has been investigated with scanning electron microscopy (SEM). The results showed that the thermal and electrical conductivity of the LDPE-based nanocomposites increased along with the increasing content of carbon nanofillers. However, one could observe greater improvement in the thermal and electrical conductivity when only MWCNTs have been incorporated. Moreover, the improvement in tensile properties and thermal stability has been observed when carbon nanofillers have been mixed with LDPE. At the same time, the increasing content of MWCNTs and MWCNTs/GNPs caused an increase in the melt viscosity with only little effect on phase transition temperatures. 12. Composition and partition functions of partially ionized hydrogen plasma in Non-Local Thermal Equilibrium (Non-LThE) and Non-Local Chemical Equilibrium (Non-LChE) International Nuclear Information System (INIS) Chen Kuan; Eddy, T.L. 1993-01-01 A GTME (Generalized MultiThermodynamic Equilibrium) plasma model is developed for plasmas in both Non-LThE (Non-Local Thermal Equilibrium) and Non-LChE (Non-Local Chemical Equilibrium). The model uses multitemperatures for thermal nonequilibrium and non-zero chemical affinities as a measure of the deviation from chemical equilibrium. The plasma is treated as an ideal gas with the Debye-Hueckel approximation employed for pressure correction. The proration method is used when the cutoff energy level is between two discrete levels. The composition and internal partition functions of a hydrogen plasma are presented for electron temperatures ranging from 5000 to 35000 K and pressures from 0.1 to 1000 kPa. Number densities of 7 different species of hydrogen plasma and internal partition functions of different energy modes (rotational, vibrational, and electronic excitation) are computed for three affinity values. The results differ from other plasma properties in that they 1) are not based on equilibrium properties; and 2) are expressed as a function of different energy distribution parameters (temperatures) within each energy mode of each species as appropriate. The computed number densities and partition functions are applicable to calculating the thermodynamic, transport, and radiation properties of a hydrogen plasma not in thermal and chemical equilibria. The nonequilibrium plasma model and plasma compositions presented in this paper are very useful to the diagnosis of high-speed and/or low-pressure plasma flows in which the assumptions of local thermal and chemical equilibrium are invalid. (orig.) 13. On the non-local obstruction to interacting higher spins in flat space Energy Technology Data Exchange (ETDEWEB) Taronna, Massimo [Physique Théorique et Mathématique,Université Libre de Bruxelles and International Solvay Institutes,ULB-Campus Plaine CP231, 1050 Brussels (Belgium) 2017-05-04 Owing to a renewed interest in flat space higher spin gauge theories, in this note we provide further details and clarifications on the results presented in arXiv:1107.5843 and arXiv: 1209.5755, which investigated their locality properties. Focusing, for simplicity, on quartic couplings with one of the external legs having non-zero integer spin (which can be considered as a prototype for Weinberg-type arguments), we review the appearance of 1/◻ non-localities. In particular, we emphasise that it appears to be not possible to eliminate all of the aforementioned non-localities in the general quartic Noether procedure solution with a judicious choice of coupling constants and spectrum. We also discuss the light-cone gauge fixing in d=4, and argue that the non-local obstruction discussed in the covariant language cannot be avoided using light-cone gauge formalism. 14. Non-local spatial frequency response of photopolymer materials containing chain transfer agents: I. Theoretical modelling International Nuclear Information System (INIS) Guo, Jinxin; Gleeson, Michael R; Liu, Shui; Sheridan, John T 2011-01-01 The non-local photopolymerization driven diffusion (NPDD) model predicts that a reduction in the non-local response length within a photopolymer material will improve its high spatial frequency response. The introduction of a chain transfer agent reduces the average molecular weight of polymer chains formed during free radical polymerization. Therefore a chain transfer agent (CTA) provides a practical method to reduce the non-local response length. An extended NPDD model is presented, which includes the chain transfer reaction and most major photochemical processes. The addition of a chain transfer agent into an acrylamide/polyvinyl alcohol photopolymer material is simulated and the predictions of the model are examined. The predictions of the model are experimentally examined in part II of this paper 15. Purely non-local Hamiltonian formalism, Kohno connections and ∨-systems International Nuclear Information System (INIS) Arsie, Alessandro; Lorenzoni, Paolo 2014-01-01 In this paper, we extend purely non-local Hamiltonian formalism to a class of Riemannian F-manifolds, without assumptions on the semisimplicity of the product ○ or on the flatness of the connection ∇. In the flat case, we show that the recurrence relations for the principal hierarchy can be re-interpreted using a local and purely non-local Hamiltonian operators and in this case they split into two Lenard-Magri chains, one involving the even terms, the other involving the odd terms. Furthermore, we give an elementary proof that the Kohno property and the ∨-system condition are equivalent under suitable assumptions and we show how to associate a purely non-local Hamiltonian structure to any ∨-system, including degenerate ones 16. Non-local two phase flow momentum transport in S BWR International Nuclear Information System (INIS) Espinosa P, G.; Salinas M, L.; Vazquez R, A. 2015-09-01 The non-local momentum transport equations derived in this work contain new terms related with non-local transport effects due to accumulation, convection, diffusion and transport properties for two-phase flow. For instance, they can be applied in the boundary between a two-phase flow and a solid phase, or in the boundary of the transition region of two-phase flows where the local volume averaging equations fail. The S BWR was considered to study the non-local effects on the two-phase flow thermal-hydraulic core performance in steady-state, and the results were compared with the classical local averaging volume conservation equations. (Author) 17. Effect of the interface resistance in non-local Hanle measurements International Nuclear Information System (INIS) Villamor, Estitxu; Hueso, Luis E.; Casanova, Fèlix 2015-01-01 We use lateral spin valves with varying interface resistance to measure non-local Hanle effect in order to extract the spin-diffusion length of the non-magnetic channel. A general expression that describes spin injection and transport, taking into account the influence of the interface resistance, is used to fit our results. Whereas the fitted spin-diffusion length value is in agreement with the one obtained from standard non-local measurements in the case of a finite interface resistance, in the case of transparent contacts a clear disagreement is observed. The use of a corrected expression, recently proposed to account for the anisotropy of the spin absorption at the ferromagnetic electrodes, still yields a deviation of the fitted spin-diffusion length which increases for shorter channel distances. This deviation shows how sensitive the non-local Hanle fittings are, evidencing the complexity of obtaining spin transport information from such type of measurements 18. Instantaneous Non-Local Computation of Low T-Depth Quantum Circuits DEFF Research Database (Denmark) Speelman, Florian 2016-01-01 -depth of a quantum circuit, able to perform non-local computation of quantum circuits with a (poly-)logarithmic number of layers of T gates with quasi-polynomial entanglement. Our proofs combine ideas from blind and delegated quantum computation with the garden-hose model, a combinatorial model of communication......Instantaneous non-local quantum computation requires multiple parties to jointly perform a quantum operation, using pre-shared entanglement and a single round of simultaneous communication. We study this task for its close connection to position-based quantum cryptography, but it also has natural...... applications in the context of foundations of quantum physics and in distributed computing. The best known general construction for instantaneous non-local quantum computation requires a pre-shared state which is exponentially large in the number of qubits involved in the operation, while efficient... 19. The status and prospects of quantum non-local field theory International Nuclear Information System (INIS) Cornish, N.J.; Melbourne Univ., Parkville 1991-01-01 A critical review of the physical constraints on the form the non-locality can take is presented. The conclusion of this review is that non-locality must be restricted to interactions with the vacuum sea of virtual particles. A successful formulation of such a theory, Quantum Nonlocal Field Theory (QNFT), is applied to scalar electrodynamics and serves to illustrate how gauge invariance and manifest finiteness can be achieved. The importance of the infinite dimensional symmetry groups that occur in QNFT are discussed as an alternative to supersymmetry, the ability to generate masses by breaking the non-local symmetry with a non-invariant functional measure is given a critical assessment. To demonstrate some of the many novel applications QNFT may make possible, three disparate examples are mooted, the existence of electroweak monopoles, an mechanism for CP violation and the formulation of a finite perturbative theory of Quantum Gravity. 21 refs., ills 20. Analysis of the cable equation with non-local and non-singular kernel fractional derivative Science.gov (United States) Karaagac, Berat 2018-02-01 Recently a new concept of differentiation was introduced in the literature where the kernel was converted from non-local singular to non-local and non-singular. One of the great advantages of this new kernel is its ability to portray fading memory and also well defined memory of the system under investigation. In this paper the cable equation which is used to develop mathematical models of signal decay in submarine or underwater telegraphic cables will be analysed using the Atangana-Baleanu fractional derivative due to the ability of the new fractional derivative to describe non-local fading memory. The existence and uniqueness of the more generalized model is presented in detail via the fixed point theorem. A new numerical scheme is used to solve the new equation. In addition, stability, convergence and numerical simulations are presented. 1. Extended non-local games and monogamy-of-entanglement games. Science.gov (United States) Johnston, Nathaniel; Mittal, Rajat; Russo, Vincent; Watrous, John 2016-05-01 We study a generalization of non-local games-which we call extended non-local games -in which the players, Alice and Bob, initially share a tripartite quantum state with the referee. In such games, the winning conditions for Alice and Bob may depend on the outcomes of measurements made by the referee, on its part of the shared quantum state, in addition to Alice and Bob's answers to randomly selected questions. Our study of this class of games was inspired by the monogamy-of-entanglement games introduced by Tomamichel, Fehr, Kaniewski and Wehner, which they also generalize. We prove that a natural extension of the Navascués-Pironio-Acín hierarchy of semidefinite programmes converges to the optimal commuting measurement value of extended non-local games, and we prove two extensions of results of Tomamichel et al. concerning monogamy-of-entanglement games. 2. Non-local two phase flow momentum transport in S BWR Energy Technology Data Exchange (ETDEWEB) Espinosa P, G.; Salinas M, L.; Vazquez R, A., E-mail: gepe@xanum.uam.mx [Universidad Autonoma Metropolitana, Unidad Iztapalapa, Area de Ingenieria en Recursos Energeticos, Apdo. Postal 55-535, 09340 Ciudad de Mexico (Mexico) 2015-09-15 The non-local momentum transport equations derived in this work contain new terms related with non-local transport effects due to accumulation, convection, diffusion and transport properties for two-phase flow. For instance, they can be applied in the boundary between a two-phase flow and a solid phase, or in the boundary of the transition region of two-phase flows where the local volume averaging equations fail. The S BWR was considered to study the non-local effects on the two-phase flow thermal-hydraulic core performance in steady-state, and the results were compared with the classical local averaging volume conservation equations. (Author) 3. Simulation of delamination crack growth in composite laminates: application of local and non-local interface damage models International Nuclear Information System (INIS) Ijaz, H.; Asad, M. 2015-01-01 The use of composite laminates is increasing in these days due to higher strength and low density values in comparison of metals. Delamination is a major source of failure in composite laminates. Damage mechanics based theories are employed to simulate the delamination phenomena between composite laminates. These damage models are inherently local and can cause the concentration of stresses around the crack tip. In the present study integral type non-local damage formulation is proposed to avoid the localization problem associated to damage formulation. A comprehensive study is carried out for the models and classical local damage model are performed and results are compared with available experimental data for un IMS/924 Carbon/fiber epoxy composite laminate. (author) 4. Chimera states and the interplay between initial conditions and non-local coupling Science.gov (United States) Kalle, Peter; Sawicki, Jakub; Zakharova, Anna; Schöll, Eckehard 2017-03-01 Chimera states are complex spatio-temporal patterns that consist of coexisting domains of coherent and incoherent dynamics. We study chimera states in a network of non-locally coupled Stuart-Landau oscillators. We investigate the impact of initial conditions in combination with non-local coupling. Based on an analytical argument, we show how the coupling phase and the coupling strength are linked to the occurrence of chimera states, flipped profiles of the mean phase velocity, and the transition from a phase- to an amplitude-mediated chimera state. 5. Modeling non-locality of plasmonic excitations with a fictitious film Science.gov (United States) Kong, Jiantao; Shvonski, Alexander; Kempa, Krzysztof Non-local effects, requiring a wavevector (q) dependent dielectric response are becoming increasingly important in studies of plasmonic and metamaterial structures. The phenomenological hydrodynamic approximation (HDA) is the simplest, and most often used model, but it often fails. We show that the d-function formalism, exact to first order in q, is a powerful and simple-to-use alternative. Recently, we developed a mapping of the d-function formalism into a purely local fictitious film. This geometric mapping allows for non-local extensions of any local calculation scheme, including FDTD. We demonstrate here, that such mapped FDTD simulation of metallic nanoclusters agrees very well with various experiments. 6. Probing the structural and dynamical properties of liquid water with models including non-local electron correlation International Nuclear Information System (INIS) Del Ben, Mauro; Hutter, Jürg; VandeVondele, Joost 2015-01-01 Water is a ubiquitous liquid that displays a wide range of anomalous properties and has a delicate structure that challenges experiment and simulation alike. The various intermolecular interactions that play an important role, such as repulsion, polarization, hydrogen bonding, and van der Waals interactions, are often difficult to reproduce faithfully in atomistic models. Here, electronic structure theories including all these interactions at equal footing, which requires the inclusion of non-local electron correlation, are used to describe structure and dynamics of bulk liquid water. Isobaric-isothermal (NpT) ensemble simulations based on the Random Phase Approximation (RPA) yield excellent density (0.994 g/ml) and fair radial distribution functions, while various other density functional approximations produce scattered results (0.8-1.2 g/ml). Molecular dynamics simulation in the microcanonical (NVE) ensemble based on Møller-Plesset perturbation theory (MP2) yields dynamical properties in the condensed phase, namely, the infrared spectrum and diffusion constant. At the MP2 and RPA levels of theory, ice is correctly predicted to float on water, resolving one of the anomalies as resulting from a delicate balance between van der Waals and hydrogen bonding interactions. For several properties, obtaining quantitative agreement with experiment requires correction for nuclear quantum effects (NQEs), highlighting their importance, for structure, dynamics, and electronic properties. A computed NQE shift of 0.6 eV for the band gap and absorption spectrum illustrates the latter. Giving access to both structure and dynamics of condensed phase systems, non-local electron correlation will increasingly be used to study systems where weak interactions are of paramount importance 7. Robust Non-Local TV-L1 Optical Flow Estimation with Occlusion Detection. Science.gov (United States) Zhang, Congxuan; Chen, Zhen; Wang, Mingrun; Li, Ming; Jiang, Shaofeng 2017-06-05 In this paper, we propose a robust non-local TV-L1 optical flow method with occlusion detection to address the problem of weak robustness of optical flow estimation with motion occlusion. Firstly, a TV-L1 form for flow estimation is defined using a combination of the brightness constancy and gradient constancy assumptions in the data term and by varying the weight under the Charbonnier function in the smoothing term. Secondly, to handle the potential risk of the outlier in the flow field, a general non-local term is added in the TV-L1 optical flow model to engender the typical non-local TV-L1 form. Thirdly, an occlusion detection method based on triangulation is presented to detect the occlusion regions of the sequence. The proposed non-local TV-L1 optical flow model is performed in a linearizing iterative scheme using improved median filtering and a coarse-to-fine computing strategy. The results of the complex experiment indicate that the proposed method can overcome the significant influence of non-rigid motion, motion occlusion, and large displacement motion. Results of experiments comparing the proposed method and existing state-of-the-art methods by respectively using Middlebury and MPI Sintel database test sequences show that the proposed method has higher accuracy and better robustness. 8. Magnetic field and contact resistance dependence of non-local charge imbalance International Nuclear Information System (INIS) Kleine, A; Baumgartner, A; Trbovic, J; Schoenenberger, C; Golubev, D S; Zaikin, A D 2010-01-01 Crossed Andreev reflection (CAR) in metallic nanostructures, a possible basis for solid-state electron entangler devices, is usually investigated by detecting non-local voltages in multi-terminal superconductor/normal metal devices. This task is difficult because other subgap processes may mask the effects of CAR. One of these processes is the generation of charge imbalance (CI) and the diffusion of non-equilibrium quasi-particles in the superconductor. Here we demonstrate a characteristic dependence of non-local CI on a magnetic field applied parallel to the superconducting wire, which can be understood by a generalization of the standard description of CI to non-local experiments. These results can be used to distinguish CAR and CI and to extract CI relaxation times in superconducting nanostructures. In addition, we investigate the dependence of non-local CI on the resistance of the injector and detector contacts and demonstrate a quantitative agreement with a recent theory using only material and junction characteristics extracted from separate direct measurements. 9. Non-local effect in Brillouin optical time-domain analyzer based on Raman amplification International Nuclear Information System (INIS) Jia Xinhong; Rao Yunjiang; Wang Zinan; Zhang Weili; Ran Zengling; Deng Kun; Yang Zixin 2012-01-01 Compared with conventional Brillouin optical time-domain analyzer (BOTDA), the BOTDA based on Raman amplification allows longer sensing range, higher signal-to-noise ratio and higher measurement accuracy. However, the non-local effect induced by pump depletion significantly restricts the probe optical power injected to sensing fiber, thereby limiting the further extension for sensing distance. In this paper, the coupled equations including the interaction of probe light, Brillouin and Raman pumps are applied to the study on the non-local characteristics of BOTDA based on Raman amplification. The results show that, the system error induced by non-local effect worsens with increased powers of probe wave and Raman pump. The frequency-division-multiplexing (cascading the fibers with various Brillouin frequency shifts) and time-division-multiplexing (modulating both of the Brillouin pump and probe lights) technologies are efficient approaches to suppress the non-local effect, through shortening the effective interaction range between Brillouin pump and probe lights. (authors) 10. Quality Assurance of Non-Local Accounting Programs Conducted in Hong Kong Science.gov (United States) Cheng, Mei-Ai; Leung, Noel W. 2014-01-01 This study examines the current government policy and institutional practice on quality assurance of non-local accounting programs conducted in Hong Kong. Both international guidelines, national regulations and institutional frameworks in higher education and transnational higher education, and professional practice in accounting education are… 11. Improved non-local electron thermal transport model for two-dimensional radiation hydrodynamics simulations International Nuclear Information System (INIS) Cao, Duc; Moses, Gregory; Delettrez, Jacques 2015-01-01 An implicit, non-local thermal conduction algorithm based on the algorithm developed by Schurtz, Nicolai, and Busquet (SNB) [Schurtz et al., Phys. Plasmas 7, 4238 (2000)] for non-local electron transport is presented and has been implemented in the radiation-hydrodynamics code DRACO. To study the model's effect on DRACO's predictive capability, simulations of shot 60 303 from OMEGA are completed using the iSNB model, and the computed shock speed vs. time is compared to experiment. Temperature outputs from the iSNB model are compared with the non-local transport model of Goncharov et al. [Phys. Plasmas 13, 012702 (2006)]. Effects on adiabat are also examined in a polar drive surrogate simulation. Results show that the iSNB model is not only capable of flux-limitation but also preheat prediction while remaining numerically robust and sacrificing little computational speed. Additionally, the results provide strong incentive to further modify key parameters within the SNB theory, namely, the newly introduced non-local mean free path. This research was supported by the Laboratory for Laser Energetics of the University of Rochester 12. Improved non-local electron thermal transport model for two-dimensional radiation hydrodynamics simulations Energy Technology Data Exchange (ETDEWEB) Cao, Duc; Moses, Gregory [University of Wisconsin—Madison, 1500 Engineering Drive, Madison, Wisconsin 53706 (United States); Delettrez, Jacques [Laboratory for Laser Energetics of the University of Rochester, 250 East River Road, Rochester, New York 14623 (United States) 2015-08-15 An implicit, non-local thermal conduction algorithm based on the algorithm developed by Schurtz, Nicolai, and Busquet (SNB) [Schurtz et al., Phys. Plasmas 7, 4238 (2000)] for non-local electron transport is presented and has been implemented in the radiation-hydrodynamics code DRACO. To study the model's effect on DRACO's predictive capability, simulations of shot 60 303 from OMEGA are completed using the iSNB model, and the computed shock speed vs. time is compared to experiment. Temperature outputs from the iSNB model are compared with the non-local transport model of Goncharov et al. [Phys. Plasmas 13, 012702 (2006)]. Effects on adiabat are also examined in a polar drive surrogate simulation. Results show that the iSNB model is not only capable of flux-limitation but also preheat prediction while remaining numerically robust and sacrificing little computational speed. Additionally, the results provide strong incentive to further modify key parameters within the SNB theory, namely, the newly introduced non-local mean free path. This research was supported by the Laboratory for Laser Energetics of the University of Rochester. 13. Local and non-local Schroedinger cat states in cavity QED International Nuclear Information System (INIS) Haroche, S. 2005-01-01 Full text: I will review recent experiments performed on mesoscopic state superpositions of field states in cavity QED. Proposals to extend these studies to Schroedinger cat states delocalized in two cavities will be discussed. New versions of Bell's inequality tests will probe the non-local behavior of these cats and study their sensitivity to decoherence. (author) 14. A NEW COMBINED LOCAL AND NON-LOCAL PBL MODEL FOR METEOROLOGY AND AIR QUALITY MODELING Science.gov (United States) A new version of the Asymmetric Convective Model (ACM) has been developed to describe sub-grid vertical turbulent transport in both meteorology models and air quality models. The new version (ACM2) combines the non-local convective mixing of the original ACM with local eddy diff... 15. Nehari manifold for non-local elliptic operator with concave–convex ... Indian Academy of Sciences (India) Introduction. We consider the following p-fractional Laplace equation ... ators of elliptic type due to concrete real world applications in finance, thin obstacle .... Due to the non-localness of the operator LK, we define the linear space as follows:. 16. A new approach to non-local boundary value problems for ordinary differential systems Czech Academy of Sciences Publication Activity Database Rontó, András; Rontó, M.; Shchobak, N. 2015-01-01 Roč. 250, č. 1 (2015), s. 689-700 ISSN 0096-3003 Institutional support: RVO:67985840 Keywords : non-local problem * parametrisation * successive approximations Subject RIV: BA - General Mathematics Impact factor: 1.345, year: 2015 http://www.sciencedirect.com/science/article/pii/S0096300314015434 17. Improved non-local electron thermal transport model for two-dimensional radiation hydrodynamics simulations Science.gov (United States) Cao, Duc; Moses, Gregory; Delettrez, Jacques 2015-08-01 An implicit, non-local thermal conduction algorithm based on the algorithm developed by Schurtz, Nicolai, and Busquet (SNB) [Schurtz et al., Phys. Plasmas 7, 4238 (2000)] for non-local electron transport is presented and has been implemented in the radiation-hydrodynamics code DRACO. To study the model's effect on DRACO's predictive capability, simulations of shot 60 303 from OMEGA are completed using the iSNB model, and the computed shock speed vs. time is compared to experiment. Temperature outputs from the iSNB model are compared with the non-local transport model of Goncharov et al. [Phys. Plasmas 13, 012702 (2006)]. Effects on adiabat are also examined in a polar drive surrogate simulation. Results show that the iSNB model is not only capable of flux-limitation but also preheat prediction while remaining numerically robust and sacrificing little computational speed. Additionally, the results provide strong incentive to further modify key parameters within the SNB theory, namely, the newly introduced non-local mean free path. This research was supported by the Laboratory for Laser Energetics of the University of Rochester. 18. Measurements and non-local thermodynamic equilibrium modeling of mid-Z plasma emission International Nuclear Information System (INIS) Jacquet, L.; Primout, M.; Kaiser, P.; Clouët, J. F.; Girard, F.; Villette, B.; Reverdin, C.; Oudot, G. 2015-01-01 The x-ray yields from laser-irradiated thin foils of iron, copper, zinc, and germanium have been measured in the soft and multi-keV x-ray ranges at the OMEGA laser at the Laboratory for Laser Energetics. The incident laser power had a pre-pulse to enhance the x-ray emission of a 1 ns flat-top main pulse. The experimental results have been compared with post-shot simulations performed with the two-dimensional radiation-hydrodynamics code FCI2. A new non-local thermodynamic equilibrium model, NOO-RAD, have been incorporated into FCI2. In this approach, the plasma ionization state is in-line calculated by the atomic physics NOHEL package. In the soft x-ray bands, both simulations using RADIOM [M. Busquet, Phys. Fluids B 5, 4191 (1993)] and NOO-RAD clearly over-predict the powers and energies measured by a broad-band spectrometer. In one case (the iron foil), the discrepancy between the measured and simulated x-ray output is nevertheless significantly reduced when NOO-RAD is used in the simulations. In the multi-keV x-ray bands, the simulations display a strong sensitivity to the coupling between the electron thermal conductivity and the NLTE models, and for some particular combinations of these, provide a close match to the measured emission. The comparison between the measured and simulated H-like to He-like line-intensity ratios deduced from high-resolution spectra indicates higher experimental electron temperatures were achieved, compared to the simulated ones. Measurements of the plasma conditions have been achieved using the Thomson-scattering diagnostic. The electron temperatures are found to range from 3 to 5 keV at the end of the laser pulse and are greater than predicted by the simulations. The measured flow velocities are in reasonable agreement with the calculated ones. This last finding gives us confidence in our numerical predictions for the plasma parameters, which are over that time mainly determined by hydrodynamics, such as the mass densities and 19. Measurements and non-local thermodynamic equilibrium modeling of mid-Z plasma emission Science.gov (United States) Jacquet, L.; Primout, M.; Kaiser, P.; Clouët, J. F.; Girard, F.; Villette, B.; Reverdin, C.; Oudot, G. 2015-12-01 The x-ray yields from laser-irradiated thin foils of iron, copper, zinc, and germanium have been measured in the soft and multi-keV x-ray ranges at the OMEGA laser at the Laboratory for Laser Energetics. The incident laser power had a pre-pulse to enhance the x-ray emission of a 1 ns flat-top main pulse. The experimental results have been compared with post-shot simulations performed with the two-dimensional radiation-hydrodynamics code FCI2. A new non-local thermodynamic equilibrium model, NOO-RAD, have been incorporated into FCI2. In this approach, the plasma ionization state is in-line calculated by the atomic physics NOHEL package. In the soft x-ray bands, both simulations using RADIOM [M. Busquet, Phys. Fluids B 5, 4191 (1993)] and NOO-RAD clearly over-predict the powers and energies measured by a broad-band spectrometer. In one case (the iron foil), the discrepancy between the measured and simulated x-ray output is nevertheless significantly reduced when NOO-RAD is used in the simulations. In the multi-keV x-ray bands, the simulations display a strong sensitivity to the coupling between the electron thermal conductivity and the NLTE models, and for some particular combinations of these, provide a close match to the measured emission. The comparison between the measured and simulated H-like to He-like line-intensity ratios deduced from high-resolution spectra indicates higher experimental electron temperatures were achieved, compared to the simulated ones. Measurements of the plasma conditions have been achieved using the Thomson-scattering diagnostic. The electron temperatures are found to range from 3 to 5 keV at the end of the laser pulse and are greater than predicted by the simulations. The measured flow velocities are in reasonable agreement with the calculated ones. This last finding gives us confidence in our numerical predictions for the plasma parameters, which are over that time mainly determined by hydrodynamics, such as the mass densities and the 20. Measurements and non-local thermodynamic equilibrium modeling of mid-Z plasma emission Energy Technology Data Exchange (ETDEWEB) Jacquet, L., E-mail: laurent.jacquet@cea.fr; Primout, M.; Kaiser, P.; Clouët, J. F.; Girard, F.; Villette, B.; Reverdin, C.; Oudot, G. [CEA, DAM, DIF, F-91297 Arpajon (France) 2015-12-15 The x-ray yields from laser-irradiated thin foils of iron, copper, zinc, and germanium have been measured in the soft and multi-keV x-ray ranges at the OMEGA laser at the Laboratory for Laser Energetics. The incident laser power had a pre-pulse to enhance the x-ray emission of a 1 ns flat-top main pulse. The experimental results have been compared with post-shot simulations performed with the two-dimensional radiation-hydrodynamics code FCI2. A new non-local thermodynamic equilibrium model, NOO-RAD, have been incorporated into FCI2. In this approach, the plasma ionization state is in-line calculated by the atomic physics NOHEL package. In the soft x-ray bands, both simulations using RADIOM [M. Busquet, Phys. Fluids B 5, 4191 (1993)] and NOO-RAD clearly over-predict the powers and energies measured by a broad-band spectrometer. In one case (the iron foil), the discrepancy between the measured and simulated x-ray output is nevertheless significantly reduced when NOO-RAD is used in the simulations. In the multi-keV x-ray bands, the simulations display a strong sensitivity to the coupling between the electron thermal conductivity and the NLTE models, and for some particular combinations of these, provide a close match to the measured emission. The comparison between the measured and simulated H-like to He-like line-intensity ratios deduced from high-resolution spectra indicates higher experimental electron temperatures were achieved, compared to the simulated ones. Measurements of the plasma conditions have been achieved using the Thomson-scattering diagnostic. The electron temperatures are found to range from 3 to 5 keV at the end of the laser pulse and are greater than predicted by the simulations. The measured flow velocities are in reasonable agreement with the calculated ones. This last finding gives us confidence in our numerical predictions for the plasma parameters, which are over that time mainly determined by hydrodynamics, such as the mass densities and 1. The sheaf-theoretic structure of non-locality and contextuality International Nuclear Information System (INIS) Abramsky, Samson; Brandenburger, Adam 2011-01-01 We use the mathematical language of sheaf theory to give a unified treatment of non-locality and contextuality, in a setting that generalizes the familiar probability tables used in non-locality theory to arbitrary measurement covers; this includes Kochen-Specker configurations and more. We show that contextuality, and non-locality as a special case, correspond exactly to obstructions to the existence of global sections. We describe a linear algebraic approach to computing these obstructions, which allows a systematic treatment of arguments for non-locality and contextuality. We distinguish a proper hierarchy of strengths of no-go theorems, and show that three leading examples—due to Bell, Hardy and Greenberger, Horne and Zeilinger, respectively—occupy successively higher levels of this hierarchy. A general correspondence is shown between the existence of local hidden-variable realizations using negative probabilities, and no-signalling; this is based on a result showing that the linear subspaces generated by the non-contextual and no-signalling models, over an arbitrary measurement cover, coincide. Maximal non-locality is generalized to maximal contextuality, and characterized in purely qualitative terms, as the non-existence of global sections in the support. A general setting is developed for the Kochen-Specker-type results, as generic, model-independent proofs of maximal contextuality, and a new combinatorial condition is given, which generalizes the ‘parity proofs’ commonly found in the literature. We also show how our abstract setting can be represented in quantum mechanics. This leads to a strengthening of the usual no-signalling theorem, which shows that quantum mechanics obeys no-signalling for arbitrary families of commuting observables, not just those represented on different factors of a tensor product. (paper) 2. Room-temperature vertically-aligned copper oxide nanoblades synthesized by electrochemical restructuring of copper hydroxide nanorods: An electrode for high energy density hybrid device Science.gov (United States) Zhang, Xuetao; Zhou, Jinyuan; Dou, Wei; Wang, Junya; Mu, Xuemei; Zhang, Yue; Abas, Asim; Su, Qing; Lan, Wei; Xie, Erqing; Zhang, Chuanfang (John) 2018-04-01 The fast growing of portable electronics has greatly stimulated the development of energy storage materials, such as transition metal oxides (TMOs). However, TMOs usually involve harsh synthesis conditions, such as high temperature. Here we take advantage of the metastable nature of Cu(OH)2 and grow CuO nanoblades (NBs) on Cu foam under the electric field at room temperature. The electrochemical polarization accelerates the dissolution of Cu(OH)2 nanorods, guides the deposition of the as-dissolved Cu(OH)42- species and eventually leads to the phase transformation of CuO NBs. The unique materials architecture render the vertically-aligned CuO NBs with enhanced electronic and ionic diffusion kinetics, high charge storage (∼779 mC cm-2 at 1 mA cm-2), excellent rate capability and long-term cycling performances. Further matching with activated carbon electrode results in high-performance hybrid device, which displays a wide voltage window (1.7 V) in aqueous electrolyte, high energy density (0.17 mWh cm-2) and power density (34 mW cm-2) coupled with long lifetime, surpassing the best CuO based device known. The hybrid device can be randomly connected and power several light-emitting diodes. Importantly, such an electrochemical restructuring approach is cost-effective, environmentally green and universal, and can be extended to synthesize other metastable hydroxides to in-situ grow corresponding oxides. 3. General optimization procedure towards the design of a new family of minimal parameter spin-component-scaled double-hybrid density functional theory. Science.gov (United States) Roch, Loïc M; Baldridge, Kim K 2017-10-04 A general optimization procedure towards the development and implementation of a new family of minimal parameter spin-component-scaled double-hybrid (mSD) density functional theory (DFT) is presented. The nature of the proposed exchange-correlation functional establishes a methodology with minimal empiricism. This new family of double-hybrid (DH) density functionals is demonstrated using the PBEPBE functional, illustrating the optimization procedure to the mSD-PBEPBE method, and the performance characteristics shown for a set of non-covalent complexes covering a broad regime of weak interactions. With only two parameters, mSD-PBEPBE and its cost-effective counterpart, RI-mSD-PBEPBE, show a mean absolute error of ca. 0.4 kcal mol -1 averaged over 66 weak interacting systems. Following a successive 2D-grid refinement for a CBS extrapolation of the coefficients, the optimization procedure can be recommended for the design and implementation of a variety of additional DH methods using any of the plethora of currently available functionals. 4. An extended hybrid density functional (X3LYP) with improved descriptions of nonbond interactions and thermodynamic properties of molecular systems OpenAIRE Xu, Xin; Zhang, Qingsong; Muller, Richard P.; Goddard, William A., III 2005-01-01 We derive here the form for the exact exchange energy density for a density that decays with Gaussian-type behavior at long range. This functional is intermediate between the B88 and the PW91 exchange functionals. Using this modified functional to match the form expected for Gaussian densities, we propose the X3LYP extended functional. We find that X3LYP significantly outperforms Becke three parameter Lee–Yang–Parr (B3LYP) for describing van der Waals and hydrogen bond interactions, while per... 5. High Efficiency Hybrid Energy Storage Utilizing High Power Density Ultracapacitors For Long Duration Balloon Flights, Phase I Data.gov (United States) National Aeronautics and Space Administration — FastCAP proposes to develop an ultra-high power density and high frequency ultracapacitor capable of surviving over the wide temperature range of -60C to 130C and... 6. Structure factor of blends of solvent-free nanoparticle–organic hybrid materials: density-functional theory and small angle X-ray scattering KAUST Repository Yu, Hsiu-Yu 2014-09-15 © the Partner Organisations 2014. We investigate the static structure factor S(q) of solvent-free nanoparticle-organic hybrid materials consisting of silica nanocores and space-filling polyethylene glycol coronas using a density-functional theory and small angle X-ray scattering measurements. The theory considers a bidisperse suspension of hard spheres with different radii and tethered bead-spring oligomers with different grafting densities to approximate the polydispersity effects in experiments. The experimental systems studied include pure samples with different silica core volume fractions and the associated mean corona grafting densities, and blends with different mixing ratios of the pure samples, in order to introduce varying polydispersity of corona grafting density. Our scattering experiments and theory show that, compared to the hard-sphere suspension with the same core volume fraction, S(q) for pure samples exhibit both substantially smaller values at small q and stronger particle correlations corresponding to a larger effective hard core at large q, indicating that the tethered incompressible oligomers enforce a more uniform particle distribution, and the densely grafted brush gives rise to an additional exclusionary effect between the nanoparticles. According to the theory, polydispersity in the oligomer grafting density controls the deviation of S(q) from the monodisperse system at smaller q, and the interplay of the enhanced effective core size and the entropic attraction among the particles is responsible for complex variations in the particle correlations at larger q. The successful comparison between the predictions and the measurements for the blends further suggests that S(q) can be used to assess the uniformity of grafting density in polymer-grafted nanoparticle materials. This journal is 7. Structure factor of blends of solvent-free nanoparticle-organic hybrid materials: density-functional theory and small angle X-ray scattering. Science.gov (United States) Yu, Hsiu-Yu; Srivastava, Samanvaya; Archer, Lynden A; Koch, Donald L 2014-12-07 We investigate the static structure factor S(q) of solvent-free nanoparticle-organic hybrid materials consisting of silica nanocores and space-filling polyethylene glycol coronas using a density-functional theory and small angle X-ray scattering measurements. The theory considers a bidisperse suspension of hard spheres with different radii and tethered bead-spring oligomers with different grafting densities to approximate the polydispersity effects in experiments. The experimental systems studied include pure samples with different silica core volume fractions and the associated mean corona grafting densities, and blends with different mixing ratios of the pure samples, in order to introduce varying polydispersity of corona grafting density. Our scattering experiments and theory show that, compared to the hard-sphere suspension with the same core volume fraction, S(q) for pure samples exhibit both substantially smaller values at small q and stronger particle correlations corresponding to a larger effective hard core at large q, indicating that the tethered incompressible oligomers enforce a more uniform particle distribution, and the densely grafted brush gives rise to an additional exclusionary effect between the nanoparticles. According to the theory, polydispersity in the oligomer grafting density controls the deviation of S(q) from the monodisperse system at smaller q, and the interplay of the enhanced effective core size and the entropic attraction among the particles is responsible for complex variations in the particle correlations at larger q. The successful comparison between the predictions and the measurements for the blends further suggests that S(q) can be used to assess the uniformity of grafting density in polymer-grafted nanoparticle materials. 8. Structural, electronic, and optical properties of GaInO{sub 3}: A hybrid density functional study Energy Technology Data Exchange (ETDEWEB) Wang, V., E-mail: wangvei@icloud.com; Ma, D.-M.; Liu, R.-J.; Yang, C.-M. [Department of Applied Physics, Xi' an University of Technology, Xi' an 710054 (China); Xiao, W. [State Key Lab of Nonferrous Metals and Processes, General Research Institute for Nonferrous Metals, Beijing 100088 (China) 2014-01-28 The structural, electronic, and optical properties of GaInO{sub 3} have been studied by first-principles calculations based on Heyd-Scuseria-Ernzerhof hybrid functional theory. The optical properties, including the optical reflectivity, refractive index, extinction coefficient, absorption coefficient, and electron energy loss are discussed for radiation up to 60 eV together with the calculated electronic structure. Our results predicted that GaInO{sub 3} displays good transparency over the whole vision region, which is in good agreement with the experimental data available in the literature. 9. Inverse dualization and non-local dualities between Einstein gravity and supergravities International Nuclear Information System (INIS) Chen Chiangmei; Gal'tsov, Dmitri V; Sharakin, Sergei A 2002-01-01 We investigate non-local dualities between suitably compactified higher dimensional Einstein gravity and supergravities which can be revealed if one reinterprets the dualized Kaluza-Klein 2-forms in D>4 as antisymmetric forms belonging to supergravities. We find several examples of such a correspondence including one between the six-dimensional Einstein gravity and the four-dimensional Einstein-Maxwell-dilaton-axion theory (truncated N=4 supergravity), and others between the compactified eleven- and ten-dimensional supergravities and the eight- or ten-dimensional pure gravity. The Killing spinor equation of the D=11 supergravity is shown to be equivalent to the geometric Killing spinor equation in the dual gravity. We give several examples of using new dualities for solution generation and demonstrate how p-branes can be interpreted as non-local duals of pure gravity solutions. New supersymmetric solutions are presented including M2 subset of 5-brane with two rotation parameters 10. The non-local Fisher–KPP equation: travelling waves and steady states International Nuclear Information System (INIS) Berestycki, Henri; Nadin, Grégoire; Perthame, Benoit; Ryzhik, Lenya 2009-01-01 We consider the Fisher–KPP equation with a non-local saturation effect defined through an interaction kernel φ(x) and investigate the possible differences with the standard Fisher–KPP equation. Our first concern is the existence of steady states. We prove that if the Fourier transform φ-circumflex(ξ) is positive or if the length σ of the non-local interaction is short enough, then the only steady states are u ≡ 0 and u ≡ 1. Next, we study existence of the travelling waves. We prove that this equation admits travelling wave solutions that connect u = 0 to an unknown positive steady state u ∞ (x), for all speeds c ≥ c * . The travelling wave connects to the standard state u ∞ (x) ≡ 1 under the aforementioned conditions: φ-circumflex(ξ) > 0 or σ is sufficiently small. However, the wave is not monotonic for σ large 11. The non-local universe the new physics and matters of the mind CERN Document Server Nadeau, Robert 2002-01-01 Classical physics states that physical reality is local, or that a measurement at one point in space cannot cannot influence what occurs at another beyond a fairly short distance. Until recently this seemed like an immutable truth in nature. However, in 1997 experiments were conducted in which light particles (photons) originated under certain conditions and traveled in opposite directions to detectors located about seven miles apart. The amazing results indicated that the photons "interacted" or "communicated" with one another instantly or "in no time," leading to the revelation that physical reality is non-local--a discovery that Robert Nadeau and Menas Kafatos view as "the most momentous in the history of science.". In pursuing this groundbreaking argument, the authors provide a fascinating history of developments that led to the discovery of non-locality and the sometimes heated debate between the great scientists responsible for these discoveries. What this new knowledge reveals, the authors conclude, is... 12. Surface green function matching for a three-dimensional non-local continuum International Nuclear Information System (INIS) Idiodi, J.O.A. 1985-07-01 With a view toward helping to bridge the gap, from the continuum side, between discrete and continuum models of crystalline, elastic solids, explicit results are presented for non-local stress tensors that describe exactly some lattice dynamical models that have been widely used in the literature for cubic lattices. The Surface Green Function Matching (SGFM) method, which has been used successfully for a variety of surface problems, is then extended, within a continuum approach, to a non-local continuum that models a three-dimensional discrete lattice. The practical use of the method is demonstrated by performing a fairly complete analytical study of the vibrational surface modes of the SCC semi-infinite medium. Some results are presented for the [100] direction of the (001) surface of the SCC lattice. (author) 13. Longitudinally Vibrating Elastic Rods with Locally and Non-Locally Reacting Viscous Dampers Directory of Open Access Journals (Sweden) Şefaatdin Yüksel 2005-01-01 Full Text Available Eigencharacteristics of a longitudinally vibrating elastic rod with locally and non-locally reacting damping are analyzed. The rod is considered as a continuous system and complex eigenfrequencies are determined as solution of a characteristic equation. The variation of the damping ratios with respect to damper locations and damping coefficients for the first four eigenfrequencies are obtained. It is shown that at any mode of locally or non-locally damped elastic rod, the variation of damping ratio with damper location is linearly proportional to absolute value of the mode shape of undamped system. It is seen that the increasing damping coefficient does not always increase the damping ratio and there are optimal values for the damping ratio. Optimal values for external damping coefficients of viscous dampers and locations of the dampers are presented. 14. Stable bounce and inflation in non-local higher derivative cosmology International Nuclear Information System (INIS) Biswas, Tirthabir; Koshelev, Alexey S.; Mazumdar, Anupam; Vernov, Sergey Yu. 2012-01-01 One of the greatest problems of primordial inflation is that the inflationary space-time is past-incomplete. This is mainly because Einstein's GR suffers from a space-like Big Bang singularity. It has recently been shown that ghost-free, non-local higher-derivative ultra-violet modifications of Einstein's gravity may be able to resolve the cosmological Big Bang singularity via a non-singular bounce. Within the framework of such non-local cosmological models, we are going to study both sub- and super-Hubble perturbations around an inflationary trajectory which is preceded by the Big Bounce in the past, and demonstrate that the inflationary trajectory has an ultra-violet completion and that perturbations do not suffer from any pathologies 15. Spectroscopic and DFT Studies of Second Sphere Variants of the Type 1 Copper Site in Azurin: Covalent and Non-Local Electrostatic Contributions to Reduction Potentials Science.gov (United States) Hadt, Ryan G.; Sun, Ning; Marshall, Nicholas M.; Hodgson, Keith O.; Hedman, Britt; Lu, Yi; Solomon, Edward I. 2012-01-01 The reduction potentials (E0) of type 1 (T1) or blue copper (BC) sites in proteins and enzymes with identical first coordination spheres around the redox active copper ion can vary by ~400 mV. Here, we use a combination of low temperature electronic absorption and magnetic circular dichroism, electron paramagnetic resonance, resonance Raman, and S K-edge X-ray absorption spectroscopies to investigate a series of second sphere variants—F114P, N47S, and F114N in Pseudomonas aeruginosa azurin (Az)—which modulate hydrogen bonding to and protein derived dipoles nearby the Cu-S(Cys) bond. Density functional theory (DFT) calculations correlated to the experimental data allow for the fractionation of the contributions to tuning E0 into covalent and non-local electrostatic components. These are found to be significant, comparable in magnitude, and additive for active H-bonds, while passive H-bonds are mostly non-local electrostatic in nature. For dipoles, these terms can be additive to or oppose one another. This study provides a methodology for uncoupling covalency from non-local electrostatics, which, when coupled to X-ray crystallographic data, distinguishes specific local interactions from more long range protein/active interactions, while affording further insight into the second sphere mechanisms available to the protein to tune the E0 of electron transfer sites in biology. PMID:22985400 16. Convergence of solutions of a non-local phase-field system Czech Academy of Sciences Publication Activity Database Londen, S.-O.; Petzeltová, Hana 2011-01-01 Roč. 4, č. 3 (2011), s. 653-670 ISSN 1937-1632 R&D Projects: GA AV ČR(CZ) IAA100190606 Institutional research plan: CEZ:AV0Z10190503 Keywords : non-local phase-field systems * separation property * convergence to equilibria Subject RIV: BA - General Mathematics http://www.aimsciences.org/journals/displayArticles.jsp?paperID=5698 17. Construction of local and non-local conservation laws for non-linear field equations International Nuclear Information System (INIS) Vladimirov, V.S.; Volovich, I.V. 1984-08-01 A method of constructing conserved currents for non-linear field equations is presented. More explicitly for non-linear equations, which can be derived from compatibility conditions of some linear system with a parameter, a procedure of obtaining explicit expressions for local and non-local currents is developed. Some examples such as the classical Heisenberg spin chain and supersymmetric Yang-Mills theory are considered. (author) 18. Local vs. Non-local core potentials in electron scattering from sodium atoms International Nuclear Information System (INIS) Bartschat, K.; Bray, I. 1996-02-01 We have tested the use of a local potential instead of the non-local Hartree-Fock potential to represent exchange effects between the valence or the projectile electron and the core in electron scattering from sodium atoms For some of the most detailed observables in this collision system/ the results of the two approaches are nearly identical, even though the effect of the exchange part is shown to be particularly large. (authors). 16 refs., 4 figs 19. The algebra of non-local charges in non-linear sigma models International Nuclear Information System (INIS) Abdalla, E.; Abdalla, M.C.B.; Brunelli, J.C.; Zadra, A. 1994-01-01 It is derived the complete Dirac algebra satisfied by non-local charges conserved in non-linear sigma models. Some examples of calculation are given for the O(N) symmetry group. The resulting algebra corresponds to a saturated cubic deformation (with only maximum order terms) of the Kac-Moody algebra. The results are generalized for when a Wess-Zumino term be present. In that case the algebra contains a minor order correction (sub-saturation). (author). 1 ref 20. Local versus non-local core potentials in electron scattering from sodium atoms International Nuclear Information System (INIS) Bartschat, K.; Bray, I. 1996-01-01 We have tested the use of a local potential instead of the non-local Hartree-Fock potential to represent exchange effects between the valence or the projectile electron and the core in electron scattering from sodium atoms. For some of the most detailed observables in this collision system, the results of the two approaches are nearly identical, even though the effect of the exchange part is shown to be particularly large. (Author) 1. An anthology of non-local QFT and QFT on noncommutative spacetime International Nuclear Information System (INIS) Schroer, Bert; E-mail schroer@cbpf.br 2004-05-01 Ever since the appearance of renormalization theory there have been several differently motivated attempts at non-localized (in the sense of not generated by point-like fields) relativistic particle theories, the most recent one being at QFT on non-commutative Minkowski spacetime. The often conceptually uncritical and historically forgetful contemporary approach to these problems calls for a critical review of contemporary ideas in the light of previous results on this subject. (author) 2. An anthology of non-local QFT and QFT on non-commutative spacetime Science.gov (United States) Schroer, Bert 2005-09-01 Ever since the appearance of renormalization theory, there have been several differently motivated attempts at non-localized (in the sense of not generated by pointlike fields) relativistic particle theories, the most recent one being at QFT on non-commutative Minkowski spacetime. The often conceptually uncritical and historically forgetful contemporary approach to these problems calls for a critical review in the light of previous results on this subject. 3. An anthology of non-local QFT and QFT on non-commutative spacetime International Nuclear Information System (INIS) Schroer, Bert 2005-01-01 Ever since the appearance of renormalization theory, there have been several differently motivated attempts at non-localized (in the sense of not generated by pointlike fields) relativistic particle theories, the most recent one being at QFT on non-commutative Minkowski spacetime. The often conceptually uncritical and historically forgetful contemporary approach to these problems calls for a critical review in the light of previous results on this subject 4. A Non-Local, Energy-Optimized Kernel: Recovering Second-Order Exchange and Beyond in Extended Systems Science.gov (United States) Bates, Jefferson; Laricchia, Savio; Ruzsinszky, Adrienn The Random Phase Approximation (RPA) is quickly becoming a standard method beyond semi-local Density Functional Theory that naturally incorporates weak interactions and eliminates self-interaction error. RPA is not perfect, however, and suffers from self-correlation error as well as an incorrect description of short-ranged correlation typically leading to underbinding. To improve upon RPA we introduce a short-ranged, exchange-like kernel that is one-electron self-correlation free for one and two electron systems in the high-density limit. By tuning the one free parameter in our model to recover an exact limit of the homogeneous electron gas correlation energy we obtain a non-local, energy-optimized kernel that reduces the errors of RPA for both homogeneous and inhomogeneous solids. To reduce the computational cost of the standard kernel-corrected RPA, we also implement RPA renormalized perturbation theory for extended systems, and demonstrate its capability to describe the dominant correlation effects with a low-order expansion in both metallic and non-metallic systems. Furthermore we stress that for norm-conserving implementations the accuracy of RPA and beyond RPA structural properties compared to experiment is inherently limited by the choice of pseudopotential. Current affiliation: King's College London. 5. Study of homogeneous bubble nucleation in liquid carbon dioxide by a hybrid approach combining molecular dynamics simulation and density gradient theory. Science.gov (United States) Langenbach, K; Heilig, M; Horsch, M; Hasse, H 2018-03-28 A new method for predicting homogeneous bubble nucleation rates of pure compounds from vapor-liquid equilibrium (VLE) data is presented. It combines molecular dynamics simulation on the one side with density gradient theory using an equation of state (EOS) on the other. The new method is applied here to predict bubble nucleation rates in metastable liquid carbon dioxide (CO 2 ). The molecular model of CO 2 is taken from previous work of our group. PC-SAFT is used as an EOS. The consistency between the molecular model and the EOS is achieved by adjusting the PC-SAFT parameters to VLE data obtained from the molecular model. The influence parameter of density gradient theory is fitted to the surface tension of the molecular model. Massively parallel molecular dynamics simulations are performed close to the spinodal to compute bubble nucleation rates. From these simulations, the kinetic prefactor of the hybrid nucleation theory is estimated, whereas the nucleation barrier is calculated from density gradient theory. This enables the extrapolation of molecular simulation data to the whole metastable range including technically relevant densities. The results are tested against available experimental data and found to be in good agreement. The new method does not suffer from typical deficiencies of classical nucleation theory concerning the thermodynamic barrier at the spinodal and the bubble size dependence of surface tension, which is typically neglected in classical nucleation theory. In addition, the density in the center of critical bubbles and their surface tension is determined as a function of their radius. The usual linear Tolman correction to the capillarity approximation is found to be invalid. 6. Study of homogeneous bubble nucleation in liquid carbon dioxide by a hybrid approach combining molecular dynamics simulation and density gradient theory Science.gov (United States) Langenbach, K.; Heilig, M.; Horsch, M.; Hasse, H. 2018-03-01 A new method for predicting homogeneous bubble nucleation rates of pure compounds from vapor-liquid equilibrium (VLE) data is presented. It combines molecular dynamics simulation on the one side with density gradient theory using an equation of state (EOS) on the other. The new method is applied here to predict bubble nucleation rates in metastable liquid carbon dioxide (CO2). The molecular model of CO2 is taken from previous work of our group. PC-SAFT is used as an EOS. The consistency between the molecular model and the EOS is achieved by adjusting the PC-SAFT parameters to VLE data obtained from the molecular model. The influence parameter of density gradient theory is fitted to the surface tension of the molecular model. Massively parallel molecular dynamics simulations are performed close to the spinodal to compute bubble nucleation rates. From these simulations, the kinetic prefactor of the hybrid nucleation theory is estimated, whereas the nucleation barrier is calculated from density gradient theory. This enables the extrapolation of molecular simulation data to the whole metastable range including technically relevant densities. The results are tested against available experimental data and found to be in good agreement. The new method does not suffer from typical deficiencies of classical nucleation theory concerning the thermodynamic barrier at the spinodal and the bubble size dependence of surface tension, which is typically neglected in classical nucleation theory. In addition, the density in the center of critical bubbles and their surface tension is determined as a function of their radius. The usual linear Tolman correction to the capillarity approximation is found to be invalid. 7. The right inferior frontal gyrus processes nested non-local dependencies in music. Science.gov (United States) Cheung, Vincent K M; Meyer, Lars; Friederici, Angela D; Koelsch, Stefan 2018-02-28 Complex auditory sequences known as music have often been described as hierarchically structured. This permits the existence of non-local dependencies, which relate elements of a sequence beyond their temporal sequential order. Previous studies in music have reported differential activity in the inferior frontal gyrus (IFG) when comparing regular and irregular chord-transitions based on theories in Western tonal harmony. However, it is unclear if the observed activity reflects the interpretation of hierarchical structure as the effects are confounded by local irregularity. Using functional magnetic resonance imaging (fMRI), we found that violations to non-local dependencies in nested sequences of three-tone musical motifs in musicians elicited increased activity in the right IFG. This is in contrast to similar studies in language which typically report the left IFG in processing grammatical syntax. Effects of increasing auditory working demands are moreover reflected by distributed activity in frontal and parietal regions. Our study therefore demonstrates the role of the right IFG in processing non-local dependencies in music, and suggests that hierarchical processing in different cognitive domains relies on similar mechanisms that are subserved by domain-selective neuronal subpopulations. 8. Post-Newtonian parameter γ in generalized non-local gravity Science.gov (United States) Zhang, Xue; Wu, YaBo; Yang, WeiQiang; Zhang, ChengYuan; Chen, BoHai; Zhang, Nan 2017-10-01 We investigate the post-Newtonian parameter γ and derive its formalism in generalized non-local (GNL) gravity, which is the modified theory of general relativity (GR) obtained by adding a term m 2 n-2 R☐-n R to the Einstein-Hilbert action. Concretely, based on parametrizing the generalized non-local action in which gravity is described by a series of dynamical scalar fields ϕ i in addition to the metric tensor g μν, the post-Newtonian limit is computed, and the effective gravitational constant as well as the post-Newtonian parameters are directly obtained from the generalized non-local gravity. Moreover, by discussing the values of the parametrized post-Newtonian parameters γ, we can compare our expressions and results with those in Hohmann and Järv et al. (2016), as well as current observational constraints on the values of γ in Will (2006). Hence, we draw restrictions on the nonminimal coupling terms F̅ around their background values. 9. A non-local hidden-variable model that violates Leggett-type inequalities Energy Technology Data Exchange (ETDEWEB) Zela, F de [Departamento de Ciencias, Seccion Fisica, Pontificia Universidad Catolica del Peru, Apartado 1761, Lima (Peru) 2008-12-19 Recent experiments of Groeblacher et al proved the violation of a Leggett-type inequality that was claimed to be valid for a broad class of non-local hidden-variable theories. The impossibility of constructing a non-local and realistic theory, unless it entails highly counterintuitive features, seems thus to have been experimentally proved. This would bring us close to a definite refutation of realism. Indeed, realism was proved to be also incompatible with locality, according to a series of experiments testing Bell inequalities. The present paper addresses the said experiments of Groeblacher et al and presents an explicit, contextual and realistic, model that reproduces the predictions of quantum mechanics. It thus violates the Leggett-type inequality that was established with the aim of ruling out a supposedly broad class of non-local models. We can thus conclude that plausible contextual, realistic, models are still tenable. This restates the possibility of a future completion of quantum mechanics by a realistic and contextual theory which is not in a class containing only highly counterintuitive models. The class that was ruled out by the experiments of Groeblacher et al is thus proved to be a limited one, arbitrarily separating models that physically belong in the same class. 10. Non-local electron transport validation using 2D DRACO simulations Science.gov (United States) Cao, Duc; Chenhall, Jeff; Moll, Eli; Prochaska, Alex; Moses, Gregory; Delettrez, Jacques; Collins, Tim 2012-10-01 Comparison of 2D DRACO simulations, using a modified versionfootnotetextprivate communications with M. Marinak and G. Zimmerman, LLNL. of the Schurtz, Nicolai and Busquet (SNB) algorithmfootnotetextSchurtz, Nicolai and Busquet, A nonlocal electron conduction model for multidimensional radiation hydrodynamics codes,'' Phys. Plasmas 7, 4238(2000). for non-local electron transport, with direct drive shock timing experimentsfootnotetextT. Boehly, et. al., Multiple spherically converging shock waves in liquid deuterium,'' Phys. Plasmas 18, 092706(2011). and with the Goncharov non-local modelfootnotetextV. Goncharov, et. al., Early stage of implosion in inertial confinement fusion: Shock timing and perturbation evolution,'' Phys. Plasmas 13, 012702(2006). in 1D LILAC will be presented. Addition of an improved SNB non-local electron transport algorithm in DRACO allows direct drive simulations with no need for an electron conduction flux limiter. Validation with shock timing experiments that mimic the laser pulse profile of direct drive ignition targets gives a higher confidence level in the predictive capability of the DRACO code. This research was supported by the University of Rochester Laboratory for Laser Energetics. 11. Non-local electrical spin injection and detection in germanium at room temperature Science.gov (United States) Rortais, F.; Vergnaud, C.; Marty, A.; Vila, L.; Attané, J.-P.; Widiez, J.; Zucchetti, C.; Bottegoni, F.; Jaffrès, H.; George, J.-M.; Jamet, M. 2017-10-01 Non-local carrier injection/detection schemes lie at the very foundation of information manipulation in integrated systems. This paradigm consists in controlling with an external signal the channel where charge carriers flow between a "source" and a well separated "drain." The next generation electronics may operate on the spin of carriers in addition to their charge and germanium appears as the best hosting material to develop such a platform for its compatibility with mainstream silicon technology and the predicted long electron spin lifetime at room temperature. In this letter, we demonstrate injection of pure spin currents (i.e., with no associated transport of electric charges) in germanium, combined with non-local spin detection at 10 K and room temperature. For this purpose, we used a lateral spin valve with epitaxially grown magnetic tunnel junctions as spin injector and spin detector. The non-local magnetoresistance signal is clearly visible and reaches ≈15 mΩ at room temperature. The electron spin lifetime and diffusion length are 500 ps and 1 μm, respectively, the spin injection efficiency being as high as 27%. This result paves the way for the realization of full germanium spintronic devices at room temperature. 12. Quantum Noether identities for non-local transformations in higher-order derivatives theories International Nuclear Information System (INIS) Li, Z.P.; Long, Z.W. 2003-01-01 Based on the phase-space generating functional of the Green function for a system with a regular/singular higher-order Lagrangian, the quantum canonical Noether identities (NIs) under a local and non-local transformation in phase space have been deduced, respectively. For a singular higher-order Lagrangian, one must use an effective canonical action I eff P in quantum canonical NIs instead of the classical I P in classical canonical NIs. The quantum NIs under a local and non-local transformation in configuration space for a gauge-invariant system with a higher-order Lagrangian have also been derived. The above results hold true whether or not the Jacobian of the transformation is equal to unity or not. It has been pointed out that in certain cases the quantum NIs may be converted to conservation laws at the quantum level. This algorithm to derive the quantum conservation laws is significantly different from the quantum first Noether theorem. The applications of our formulation to the Yang-Mills fields and non-Abelian Chern-Simons (CS) theories with higher-order derivatives are given, and the conserved quantities at the quantum level for local and non-local transformations are found, respectively. (orig.) 13. A non-local hidden-variable model that violates Leggett-type inequalities International Nuclear Information System (INIS) Zela, F de 2008-01-01 Recent experiments of Groeblacher et al proved the violation of a Leggett-type inequality that was claimed to be valid for a broad class of non-local hidden-variable theories. The impossibility of constructing a non-local and realistic theory, unless it entails highly counterintuitive features, seems thus to have been experimentally proved. This would bring us close to a definite refutation of realism. Indeed, realism was proved to be also incompatible with locality, according to a series of experiments testing Bell inequalities. The present paper addresses the said experiments of Groeblacher et al and presents an explicit, contextual and realistic, model that reproduces the predictions of quantum mechanics. It thus violates the Leggett-type inequality that was established with the aim of ruling out a supposedly broad class of non-local models. We can thus conclude that plausible contextual, realistic, models are still tenable. This restates the possibility of a future completion of quantum mechanics by a realistic and contextual theory which is not in a class containing only highly counterintuitive models. The class that was ruled out by the experiments of Groeblacher et al is thus proved to be a limited one, arbitrarily separating models that physically belong in the same class 14. OCT despeckling via weighted nuclear norm constrained non-local low-rank representation Science.gov (United States) Tang, Chang; Zheng, Xiao; Cao, Lijuan 2017-10-01 As a non-invasive imaging modality, optical coherence tomography (OCT) plays an important role in medical sciences. However, OCT images are always corrupted by speckle noise, which can mask image features and pose significant challenges for medical analysis. In this work, we propose an OCT despeckling method by using non-local, low-rank representation with weighted nuclear norm constraint. Unlike previous non-local low-rank representation based OCT despeckling methods, we first generate a guidance image to improve the non-local group patches selection quality, then a low-rank optimization model with a weighted nuclear norm constraint is formulated to process the selected group patches. The corrupted probability of each pixel is also integrated into the model as a weight to regularize the representation error term. Note that each single patch might belong to several groups, hence different estimates of each patch are aggregated to obtain its final despeckled result. Both qualitative and quantitative experimental results on real OCT images show the superior performance of the proposed method compared with other state-of-the-art speckle removal techniques. 15. Hybrid density functional theory study of Cu(In1−xGaxSe2 band structure for solar cell application Directory of Open Access Journals (Sweden) Xu-Dong Chen 2014-08-01 Full Text Available Cu(In1−xGaxSe2 (CIGS alloy based thin film photovoltaic solar cells have attracted more and more attention due to its large optical absorption coefficient, long term stability, low cost and high efficiency. However, the previous theoretical investigation of this material with first principle calculation cannot fulfill the requirement of experimental development, especially the accurate description of band structure and density of states. In this work, we use first principle calculation based on hybrid density functional theory to investigate the feature of CIGS, with B3LYP applied in the CuIn1−xGaxSe2 stimulation of the band structure and density of states. We report the simulation of the lattice parameter, band gap and chemical composition. The band gaps of CuGaSe2, CuIn0.25Ga0.75Se2, CuIn0.5Ga0.5Se2, CuIn0.75Ga0.25Se2 and CuInSe2 are obtained as 1.568 eV, 1.445 eV, 1.416 eV, 1.275 eV and 1.205 eV according to our calculation, which agree well with the available experimental values. The band structure of CIGS is also in accordance with the current theory. 16. An extended hybrid density functional (X3LYP) with improved descriptions of nonbond interactions and thermodynamic properties of molecular systems Science.gov (United States) Xu, Xin; Zhang, Qingsong; Muller, Richard P.; Goddard, William A. 2005-01-01 We derive here the form for the exact exchange energy density for a density that decays with Gaussian-type behavior at long range. This functional is intermediate between the B88 and the PW91 exchange functionals. Using this modified functional to match the form expected for Gaussian densities, we propose the X3LYP extended functional. We find that X3LYP significantly outperforms Becke three parameter Lee-Yang-Parr (B3LYP) for describing van der Waals and hydrogen bond interactions, while performing slightly better than B3LYP for predicting heats of formation, ionization potentials, electron affinities, proton affinities, and total atomic energies as validated with the extended G2 set of atoms and molecules. Thus X3LYP greatly enlarges the field of applications for density functional theory. In particular the success of X3LYP in describing the water dimer (with Re and De within the error bars of the most accurate determinations) makes it an excellent candidate for predicting accurate ligand-protein and ligand-DNA interactions. 17. Benchmarking Density Functional Theory Based Methods To Model NiOOH Material Properties: Hubbard and van der Waals Corrections vs Hybrid Functionals. Science.gov (United States) Zaffran, Jeremie; Caspary Toroker, Maytal 2016-08-09 NiOOH has recently been used to catalyze water oxidation by way of electrochemical water splitting. Few experimental data are available to rationalize the successful catalytic capability of NiOOH. Thus, theory has a distinctive role for studying its properties. However, the unique layered structure of NiOOH is associated with the presence of essential dispersion forces within the lattice. Hence, the choice of an appropriate exchange-correlation functional within Density Functional Theory (DFT) is not straightforward. In this work, we will show that standard DFT is sufficient to evaluate the geometry, but DFT+U and hybrid functionals are required to calculate the oxidation states. Notably, the benefit of DFT with van der Waals correction is marginal. Furthermore, only hybrid functionals succeed in opening a bandgap, and such methods are necessary to study NiOOH electronic structure. In this work, we expect to give guidelines to theoreticians dealing with this material and to present a rational approach in the choice of the DFT method of calculation. 18. Multi-atlas labeling with population-specific template and non-local patch-based label fusion DEFF Research Database (Denmark) Fonov, Vladimir; Coupé, Pierrick; Eskildsen, Simon Fristed We propose a new method combining a population-specific nonlinear template atlas approach with non-local patch-based structure segmentation for whole brain segmentation into individual structures. This way, we benefit from the efficient intensity-driven segmentation of the non-local means framework...... and from the global shape constraints imposed by the nonlinear template matching.... 19. One-dimensional, non-local, first-order, stationary mean-field games with congestion: a Fourier approach KAUST Repository Nurbekyan, Levon 2017-03-11 Here, we study a one-dimensional, non-local mean-field game model with congestion. When the kernel in the non-local coupling is a trigonometric polynomial we reduce the problem to a finite dimensional system. Furthermore, we treat the general case by approximating the kernel with trigonometric polynomials. Our technique is based on Fourier expansion methods. 20. One-dimensional, non-local, first-order, stationary mean-field games with congestion: a Fourier approach KAUST Repository Nurbekyan, Levon 2017-01-01 Here, we study a one-dimensional, non-local mean-field game model with congestion. When the kernel in the non-local coupling is a trigonometric polynomial we reduce the problem to a finite dimensional system. Furthermore, we treat the general case by approximating the kernel with trigonometric polynomials. Our technique is based on Fourier expansion methods. 1. Comparison of global brain gene expression profiles between inbred long-sleep and inbred short-sleep mice by high-density gene array hybridization. Science.gov (United States) Xu, Y; Ehringer, M; Yang, F; Sikela, J M 2001-06-01 Inbred long-sleep (ILS) and short-sleep (ISS) mice show significant central nervous system-mediated differences in sleep time for sedative dose of ethanol and are frequently used as a rodent model for ethanol sensitivity. In this study, we have used complementary DNA (cDNA) array hybridization methodology to identify genes that are differentially expressed between the brains of ILS and ISS mice. To carry out this analysis, we used both the gene discovery array (GDA) and the Mouse GEM 1 Microarray. GDA consists of 18,378 nonredundant mouse cDNA clones on a single nylon filter. Complex probes were prepared from total brain mRNA of ILS or ISS mice by using reverse transcription and 33P labeling. The labeled probes were hybridized in parallel to the gene array filters. Data from GDA experiments were analyzed with SQL-Plus and Oracle 8. The GEM microarray includes 8,730 sequence-verified clones on a glass chip. Two fluorescently labeled probes were used to hybridize a microarray simultaneously. Data from GEM experiments were analyzed by using the GEMTools software package (Incyte). Differentially expressed genes identified from each method were confirmed by relative quantitative reverse transcription-polymerase chain reaction (RT-PCR). A total of 41 genes or expressed sequence tags (ESTs) display significant expression level differences between brains of ILS and ISS mice after GDA, GEM1 hybridization, and quantitative RT-PCR confirmation. Among them, 18 clones were expressed higher in ILS mice, and 23 clones were expressed higher in ISS mice. The individual gene or EST's function and mapping information have been analyzed. This study identified 41 genes that are differentially expressed between brains of ILS and ISS mice. Some of them may have biological relevance in mediation of phenotypic variation between ILS and ISS mice for ethanol sensitivity. This study also demonstrates that parallel gene expression comparison with high-density cDNA arrays is a rapid and 2. One-Photon Absorption Properties from a Hybrid Polarizable Density Embedding/Complex Polarization Propagator Approach for Polarizable Solutions DEFF Research Database (Denmark) Hršak, Dalibor; Nørby, Morten Steen; Coriani, Sonia 2018-01-01 We present a formulation of the polarizable density embedding (PDE) method in combination with the complex polarization propagator (CPP) method for the calculation of absorption spectra of molecules in solutions. The method is particularly useful for the calculation of near-edge X-ray absorption...... fine structure (NEXAFS) spectra. We compare the performance of PDE-CPP with the previously formulated polarizable embedding (PE)-CPP model for the calculation of the NEXAFS spectra of adenine, formamide, glycine, and adenosine triphosphate (ATP) in water at the carbon and nitrogen K-edges, as well... 3. Quantum objects. Non-local correlation, causality and objective indefiniteness in the quantum world International Nuclear Information System (INIS) Jaeger, Gregg 2014-01-01 Presents interpretation of quantum mechanics, advances in quantum foundations and philosophy of quantum mechanics. Explains non-locality and its relationship to causality and probability in quantum theory. Displays foundational characteristics of quantum physic to understand conceptual origins of the unusual nature of quantum phenomena. Describes relationship of subsystems and space-time. Gives a careful review of existing views. Confronts the old approaches with recent results and approaches from quantum information theory. Delivers a clear and thorough analysis of the quantum events in the context of relativistic space-time, which impacts the problem of creating a theory of quantum gravity. Supplies a detailed discussion of non-local correlation within and beyond the bounds set by standard quantum mechanics, which impacts the foundations of information theory. Gives a detailed discussion of probabilistic causation (central to contemporary accounts of causation) in quantum mechanics and relativity. Leads a thorough discussion of the nature of ''quantum potentiality,'' the novel form of existence arising for the first time in quantum mechanics. This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum subsystems. Careful attention is paid to the relationships among such property correlations, physical causation, probability, and symmetry in quantum theory. In this way, the text identifies and clarifies the conceptual grounds 4. Quantum objects. Non-local correlation, causality and objective indefiniteness in the quantum world Energy Technology Data Exchange (ETDEWEB) Jaeger, Gregg [Boston Univ., MA (United States). Natural Sciences and Mathematics 2014-07-01 Presents interpretation of quantum mechanics, advances in quantum foundations and philosophy of quantum mechanics. Explains non-locality and its relationship to causality and probability in quantum theory. Displays foundational characteristics of quantum physic to understand conceptual origins of the unusual nature of quantum phenomena. Describes relationship of subsystems and space-time. Gives a careful review of existing views. Confronts the old approaches with recent results and approaches from quantum information theory. Delivers a clear and thorough analysis of the quantum events in the context of relativistic space-time, which impacts the problem of creating a theory of quantum gravity. Supplies a detailed discussion of non-local correlation within and beyond the bounds set by standard quantum mechanics, which impacts the foundations of information theory. Gives a detailed discussion of probabilistic causation (central to contemporary accounts of causation) in quantum mechanics and relativity. Leads a thorough discussion of the nature of ''quantum potentiality,'' the novel form of existence arising for the first time in quantum mechanics. This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum subsystems. Careful attention is paid to the relationships among such property correlations, physical causation, probability, and symmetry in quantum theory. In this way, the text identifies and clarifies the 5. Non-Local Sparse Image Inpainting for Document Bleed-Through Removal Directory of Open Access Journals (Sweden) Muhammad Hanif 2018-05-01 Full Text Available Bleed-through is a frequent, pervasive degradation in ancient manuscripts, which is caused by ink seeped from the opposite side of the sheet. Bleed-through, appearing as an extra interfering text, hinders document readability and makes it difficult to decipher the information contents. Digital image restoration techniques have been successfully employed to remove or significantly reduce this distortion. This paper proposes a two-step restoration method for documents affected by bleed-through, exploiting information from the recto and verso images. First, the bleed-through pixels are identified, based on a non-stationary, linear model of the two texts overlapped in the recto-verso pair. In the second step, a dictionary learning-based sparse image inpainting technique, with non-local patch grouping, is used to reconstruct the bleed-through-contaminated image information. An overcomplete sparse dictionary is learned from the bleed-through-free image patches, which is then used to estimate a befitting fill-in for the identified bleed-through pixels. The non-local patch similarity is employed in the sparse reconstruction of each patch, to enforce the local similarity. Thanks to the intrinsic image sparsity and non-local patch similarity, the natural texture of the background is well reproduced in the bleed-through areas, and even a possible overestimation of the bleed through pixels is effectively corrected, so that the original appearance of the document is preserved. We evaluate the performance of the proposed method on the images of a popular database of ancient documents, and the results validate the performance of the proposed method compared to the state of the art. 6. Nonlinear electronic excitations in crystalline solids using meta-generalized gradient approximation and hybrid functional in time-dependent density functional theory Energy Technology Data Exchange (ETDEWEB) Sato, Shunsuke A. [Graduate School of Pure and Applied Sciences, University of Tsukuba, Tsukuba 305-8571 (Japan); Taniguchi, Yasutaka [Center for Computational Science, University of Tsukuba, Tsukuba 305-8571 (Japan); Department of Medical and General Sciences, Nihon Institute of Medical Science, 1276 Shimogawara, Moroyama-Machi, Iruma-Gun, Saitama 350-0435 (Japan); Shinohara, Yasushi [Max Planck Institute of Microstructure Physics, 06120 Halle (Germany); Yabana, Kazuhiro [Graduate School of Pure and Applied Sciences, University of Tsukuba, Tsukuba 305-8571 (Japan); Center for Computational Science, University of Tsukuba, Tsukuba 305-8571 (Japan) 2015-12-14 We develop methods to calculate electron dynamics in crystalline solids in real-time time-dependent density functional theory employing exchange-correlation potentials which reproduce band gap energies of dielectrics; a meta-generalized gradient approximation was proposed by Tran and Blaha [Phys. Rev. Lett. 102, 226401 (2009)] (TBm-BJ) and a hybrid functional was proposed by Heyd, Scuseria, and Ernzerhof [J. Chem. Phys. 118, 8207 (2003)] (HSE). In time evolution calculations employing the TB-mBJ potential, we have found it necessary to adopt the predictor-corrector step for a stable time evolution. We have developed a method to evaluate electronic excitation energy without referring to the energy functional which is unknown for the TB-mBJ potential. For the HSE functional, we have developed a method for the operation of the Fock-like term in Fourier space to facilitate efficient use of massive parallel computers equipped with graphic processing units. We compare electronic excitations in silicon and germanium induced by femtosecond laser pulses using the TB-mBJ, HSE, and a simple local density approximation (LDA). At low laser intensities, electronic excitations are found to be sensitive to the band gap energy: they are close to each other using TB-mBJ and HSE and are much smaller in LDA. At high laser intensities close to the damage threshold, electronic excitation energies do not differ much among the three cases. 7. Structural, magnetic, electronic and optical properties of PuC and PuC{sub 0.75}: A hybrid density functional study Energy Technology Data Exchange (ETDEWEB) Yang, Rong [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065 (China); College of Materials Science and Engineering, Chongqing Jiaotong University, Chongqing 400074 (China); Tang, Bin [School of Business Administration, Chongqing City Management College, Chongqing 401331 (China); Gao, Tao, E-mail: gaotao@scu.edu.cn [Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065 (China); Ao, BingYun, E-mail: aobingyun@caep.cn [Science and Technology on Surface Physics and Chemistry Laboratory, P.O. Box 718-35, Mianyang 621907 (China) 2016-05-15 We perform first principles calculations to investigate the structural, magnetic, electronic and optical properties of PuC and PuC{sub 0.75}. Furthermore, we examine the influence of carbon non-stoichiometry on plutonium monocarbide. For the treatment of strongly correlated electrons, the hybrid density functionals like PBE0, Fock-0.25 are used and we compare the results with the generalized gradient approximation (GGA), local density approximation (LDA), LDA + U and experimental ones. The optimized lattice constant a{sub 0} = 4.961 Å for PuC in the Fock-0.25 scheme is the most close to the experimental data. The ground states of PuC and PuC{sub 0.75} are found to be anti-ferromagnetic. Our results indicate that additional removal of a C atom make lattice contract and new DOS peak appear in the near-Fermi region. We also compute and compare the optical properties of PuC and PuC{sub 0.75}. The difference in optical properties between PuC and PuC{sub 0.75} should also be the influence of carbon vacancies. 8. Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models. Science.gov (United States) Curutchet, Carles; Cupellini, Lorenzo; Kongsted, Jacob; Corni, Stefano; Frediani, Luca; Steindal, Arnfinn Hykkerud; Guido, Ciro A; Scalmani, Giovanni; Mennucci, Benedetta 2018-03-13 Mixed multiscale quantum/molecular mechanics (QM/MM) models are widely used to explore the structure, reactivity, and electronic properties of complex chemical systems. Whereas such models typically include electrostatics and potentially polarization in so-called electrostatic and polarizable embedding approaches, respectively, nonelectrostatic dispersion and repulsion interactions are instead commonly described through classical potentials despite their quantum mechanical origin. Here we present an extension of the Tkatchenko-Scheffler semiempirical van der Waals (vdW TS ) scheme aimed at describing dispersion and repulsion interactions between quantum and classical regions within a QM/MM polarizable embedding framework. Starting from the vdW TS expression, we define a dispersion and a repulsion term, both of them density-dependent and consistently based on a Lennard-Jones-like potential. We explore transferable atom type-based parametrization strategies for the MM parameters, based on either vdW TS calculations performed on isolated fragments or on a direct estimation of the parameters from atomic polarizabilities taken from a polarizable force field. We investigate the performance of the implementation by computing self-consistent interaction energies for the S22 benchmark set, designed to represent typical noncovalent interactions in biological systems, in both equilibrium and out-of-equilibrium geometries. Overall, our results suggest that the present implementation is a promising strategy to include dispersion and repulsion in multiscale QM/MM models incorporating their explicit dependence on the electronic density. 9. Quantum objects non-local correlation, causality and objective indefiniteness in the quantum world CERN Document Server Jaeger, Gregg 2013-01-01 This monograph identifies the essential characteristics of the objects described by current quantum theory and considers their relationship to space-time. In the process, it explicates the senses in which quantum objects may be consistently considered to have parts of which they may be composed or into which they may be decomposed. The book also demonstrates the degree to which reduction is possible in quantum mechanics, showing it to be related to the objective indefiniteness of quantum properties and the strong non-local correlations that can occur between the physical quantities of quantum 10. Quantum non-locality in a two-slit interferometer for short-lived particles International Nuclear Information System (INIS) Klein, Spencer R.; Nystrand, Joakim 2001-01-01 We describe a new test of quantum nonlocality, using an interferometer for short-lived particles. The separation is large compared with the particle lifetimes. This interferometer is realized by vector meson production in distant heavy ion collisions. The mesons decay before waves from the two sources (ions) can overlap, so interference is only possible among the decay products. The post-decay wave function must retain amplitudes for all possible decays. The decay products are spatially separated, necessitating a non-local wave function. The interference is measurable by summing the product momenta. Alternately, the products positions could be observed, allowing new tests of the EPR paradox 11. Tests of non-local interferences in kaon physics at asymmetric φ-factories International Nuclear Information System (INIS) Eberhard, P.H. 1993-01-01 Tests of non-local interference effects in the two-kaon system are proposed. The first kind of tests consists of measuring the amount of destructive interference between K S → K L regeneration processes of two distant kaons. The second kind deals with constructive interference. These tests could be performed at an asymmetric φ-factory. Estimates are given of the number of events predicted by orthodox quantum mechanics and kaon regeneration theory in various suitable experimental conditions. The impact on local theories if the predictions of quantum mechanics hold is discussed 12. Quantum non-locality and relativity metaphysical intimations of modern physics CERN Document Server Maudlin, Tim 2011-01-01 The third edition of Quantum Non-Locality and Relativity has been carefully updated to reflect significant developments, including a new chapter covering important recent work in the foundations of physics. A new edition of the premier philosophical study of Bell's Theorem and its implication for the relativistic account of space and timeDiscusses Roderich Tumiulka's explicit, relativistic theory that can reproduce the quantum mechanical violation of Bell's inequality. Discusses the "Free Will Theorem" of John Conway and Simon KochenIntroduces philosophers to the relevant physics and demonstra 13. Algebraic Traveling Wave Solutions of a Non-local Hydrodynamic-type Model International Nuclear Information System (INIS) Chen, Aiyong; Zhu, Wenjing; Qiao, Zhijun; Huang, Wentao 2014-01-01 In this paper we consider the algebraic traveling wave solutions of a non-local hydrodynamic-type model. It is shown that algebraic traveling wave solutions exist if and only if an associated first order ordinary differential system has invariant algebraic curve. The dynamical behavior of the associated ordinary differential system is analyzed. Phase portraits of the associated ordinary differential system is provided under various parameter conditions. Moreover, we classify algebraic traveling wave solutions of the model. Some explicit formulas of smooth solitary wave and cuspon solutions are obtained 14. Density-Dependent Formulation of Dispersion-Repulsion Interactions in Hybrid Multiscale Quantum/Molecular Mechanics (QM/MM) Models DEFF Research Database (Denmark) Curutchet, Carles; Cupellini, Lorenzo; Kongsted, Jacob 2018-01-01 embedding approaches, respectively, nonelectrostatic dispersion and repulsion interactions are instead commonly described through classical potentials despite their quantum mechanical origin. Here we present an extension of the Tkatchenko-Scheffler semiempirical van der Waals (vdWTS) scheme aimed......Mixed multiscale quantum/molecular mechanics (QM/MM) models are widely used to explore the structure, reactivity, and electronic properties of complex chemical systems. Whereas such models typically include electrostatics and potentially polarization in so-called electrostatic and polarizable...... at describing dispersion and repulsion interactions between quantum and classical regions within a QM/MM polarizable embedding framework. Starting from the vdWTSexpression, we define a dispersion and a repulsion term, both of them density-dependent and consistently based on a Lennard-Jones-like potential. We... 15. Morphology-Property relationship of high density Polyethylene/Hevea Brasiliensis Leaves/Imperata cylindrica hybrid composite: Impact strength Science.gov (United States) Rashidi, A. R.; Muhammad, A.; Roslan, A. 2017-09-01 This research studies about the Hevea Brasiliensis Leaves and Imperata Cylindrica that was used as filler in High Density Polyethylene (HDPE). The fillers content were varied in the composite by 5 wt%, 15 wt% and 25 wt% respectively. This polymer composite are being studied by using Impact Test and Scanning Electron Microscopy (SEM). The analysis show that the impact strength value increased when the percent of bio filler used is low. The result between pure HDPE and the composites shows an outcome of significant changes in impact energy values, while the values between different composite change slightly. A composite that contained 5 wt% of fillers is the better energy absorber than 15 wt% and 25 wt% according to impact testing. In addition, the morphology studies on the composite sample show that the bio-filler was successfully embedded. Overall, these finding suggest that HBL and IC can be an alternative filler to be incorporated in polymer matrix. 16. Fracture density determination using a novel hybrid computational scheme: a case study on an Iranian Marun oil field reservoir International Nuclear Information System (INIS) Nouri-Taleghani, Morteza; Mahmoudifar, Mehrzad; Shokrollahi, Amin; Tatar, Afshin; Karimi-Khaledi, Mina 2015-01-01 Most oil production all over the world is from carbonated reservoirs. Carbonate reservoirs are abundant in the Middle East, the Gulf of Mexico and in other major petroleum fields that are regarded as the main oil producers. Due to the nature of such reservoirs that are associated with low matrix permeability, the fracture is the key parameter that governs the fluid flow in porous media and consequently oil production. Conventional methods to determine the fracture density include utilizing core data and the image log family, which are both time consuming and costly processes. In addition, the cores are limited to certain intervals and there is no image log for the well drilled before the introduction of this tool. These limitations motivate petroleum engineers to try to find appropriate alternatives. Recently, intelligent systems on the basis of machine learning have been applied to various branches of science and engineering. The objective of this study is to develop a mathematical model to predict the fracture density using full set log data as inputs based on a combination of three intelligent systems namely, the radial basis function neural network, the multilayer perceptron neural network and the least square supported vector machine. The developed committee machine intelligent system (CMIS) is the weighted average of the individual results of each expert. Proper corresponding weights are determined using a genetic algorithm (GA). The other important feature of the proposed model is its generalization capability. The ability of this model to predict data that have not been introduced during the training stage is very good. (paper) 17. Tailoring the electronic structure of β-Ga2O3 by non-metal doping from hybrid density functional theory calculations. Science.gov (United States) Guo, Weiyan; Guo, Yating; Dong, Hao; Zhou, Xin 2015-02-28 A systematic study using density functional theory has been performed for β-Ga2O3 doped with non-metal elements X (X = C, N, F, Si, P, S, Cl, Se, Br, and I) to evaluate the effect of doping on the band edges and photocatalytic activity of β-Ga2O3. The utilization of a more reliable hybrid density functional, as prescribed by Heyd, Scuseria and Ernzerhof, is found to be effective in predicting the band gap of β-Ga2O3 (4.5 eV), in agreement with the experimental result (4.59 eV). Based on the relaxed structures of X-doped systems, the defect formation energies and the plots of density of states have been calculated to analyze the band edges, the band gap states and the preferred doping sites. Our results show that the doping is energetically favored under Ga-rich growth conditions with respect to O-rich growth conditions. It is easier to replace the threefold coordinated O atom with non-metal elements compared to the fourfold coordinated O atom. X-doped systems (X = C, Si, P) show no change in the band gap, with the presence of discrete midgap states, which have adverse effect on the photocatalytic properties. The photocatalytic redox ability can be improved to a certain extent by doping with N, S, Cl, Se, Br, and I. The band alignments for Se-doped and I-doped β-Ga2O3 are well positioned for the feasibility of both photo-oxidation and photo-reduction of water, which are promising photocatalysts for water splitting in the visible region. 18. A non-local shell model of hydrodynamic and magnetohydrodynamic turbulence Energy Technology Data Exchange (ETDEWEB) Plunian, F [Laboratoire de Geophysique Interne et Tectonophysique, CNRS, Universite Joseph Fourier, Maison des Geosciences, BP 53, 38041 Grenoble Cedex 9 (France); Stepanov, R [Institute of Continuous Media Mechanics, Korolyov 1, 614013 Perm (Russian Federation) 2007-08-15 We derive a new shell model of magnetohydrodynamic (MHD) turbulence in which the energy transfers are not necessarily local. Like the original MHD equations, the model conserves the total energy, magnetic helicity, cross-helicity and volume in phase space (Liouville's theorem) apart from the effects of external forcing, viscous dissipation and magnetic diffusion. The model of hydrodynamic (HD) turbulence is derived from the MHD model setting the magnetic field to zero. In that case the conserved quantities are the kinetic energy and the kinetic helicity. In addition to a statistically stationary state with a Kolmogorov spectrum, the HD model exhibits multiscaling. The anomalous scaling exponents are found to depend on a free parameter {alpha} that measures the non-locality degree of the model. In freely decaying turbulence, the infra-red spectrum also depends on {alpha}. Comparison with theory suggests using {alpha} = -5/2. In MHD turbulence, we investigate the fully developed turbulent dynamo for a wide range of magnetic Prandtl numbers in both kinematic and dynamic cases. Both local and non-local energy transfers are clearly identified. 19. Finite-volume effects due to spatially non-local operators arXiv CERN Document Server Briceño, Raúl A.; Hansen, Maxwell T.; Monahan, Christopher J. Spatially non-local matrix elements are useful lattice-QCD observables in a variety of contexts, for example in determining hadron structure. To quote credible estimates of the systematic uncertainties in these calculations, one must understand, among other things, the size of the finite-volume effects when such matrix elements are extracted from numerical lattice calculations. In this work, we estimate finite-volume effects for matrix elements of non-local operators, composed of two currents displaced in a spatial direction by a distance\\xi$. We find that the finite-volume corrections depend on the details of the matrix element. If the external state is the lightest degree of freedom in the theory, e.g.~the pion in QCD, then the volume corrections scale as$ e^{-m_\\pi (L- \\xi)} $, where$m_\\pi$is the mass of the light state. For heavier external states the usual$e^{- m_\\pi L}$form is recovered, but with a polynomial prefactor of the form$L^m/|L - \\xi|^n\$ that can lead to enhanced volume effects. These ...

20. Discretization independence implies non-locality in 4D discrete quantum gravity

Science.gov (United States)

Dittrich, Bianca; Kamiński, Wojciech; Steinhaus, Sebastian

2014-12-01

The 4D Regge action is invariant under 5-1 and 4-2 Pachner moves, which define a subset of (local) changes of the triangulation. Given this fact, one might hope to find a local path integral measure that makes the quantum theory invariant under these moves and hence makes the theory partially triangulation invariant. We show that such a local invariant path integral measure does not exist for the 4D linearized Regge theory. To this end we uncover an interesting geometric interpretation for the Hessian of the 4D Regge action. This geometric interpretation will allow us to prove that the determinant of the Hessian of the 4D Regge action does not factorize over four-simplices or subsimplices. It furthermore allows us to determine configurations where this Hessian vanishes, which only appears to be the case in degenerate backgrounds or if one allows for different orientations of the simplices. We suggest a non-local measure factor that absorbs the non-local part of the determinant of the Hessian under 5-1 moves as well as a local measure factor that is preserved for very special configurations.

1. Discretization independence implies non-locality in 4D discrete quantum gravity

International Nuclear Information System (INIS)

Dittrich, Bianca; Kamiński, Wojciech; Steinhaus, Sebastian

2014-01-01

The 4D Regge action is invariant under 5–1 and 4–2 Pachner moves, which define a subset of (local) changes of the triangulation. Given this fact, one might hope to find a local path integral measure that makes the quantum theory invariant under these moves and hence makes the theory partially triangulation invariant. We show that such a local invariant path integral measure does not exist for the 4D linearized Regge theory. To this end we uncover an interesting geometric interpretation for the Hessian of the 4D Regge action. This geometric interpretation will allow us to prove that the determinant of the Hessian of the 4D Regge action does not factorize over four-simplices or subsimplices. It furthermore allows us to determine configurations where this Hessian vanishes, which only appears to be the case in degenerate backgrounds or if one allows for different orientations of the simplices. We suggest a non-local measure factor that absorbs the non-local part of the determinant of the Hessian under 5–1 moves as well as a local measure factor that is preserved for very special configurations. (paper)

2. Effect of phosphorus doping on electronic structure and photocatalytic performance of g-C{sub 3}N{sub 4}: Insights from hybrid density functional calculation

Energy Technology Data Exchange (ETDEWEB)

Liu, Jianjun, E-mail: jjliu@chnu.edu.cn [State Key Laboratory of Advanced Technology for Materials Synthesis and Processing, Wuhan University of Technology, Wuhan 430070 (China); School of Physics and Electronic Information, Huaibei Normal University, Huaibei, Anhui 235000 (China)

2016-07-05

Graphitic carbon nitride (g-C{sub 3}N{sub 4}), as a promising visible-light photocatalyst, has wide applications on water splitting, pollutants decomposition and CO{sub 2} reduction. Herein, we investigated the electronic and optical property of pure and P doped g-C{sub 3}N{sub 4} using Heyd-Scuseria-Ernzerhof (HSE06) hybrid functional method. The valuable features such as, the band structure, density of states, band decomposed charged density and optical absorption were computed to explore the role of phosphorus substitute N2 and C1 sites of g-C{sub 3}N{sub 4}.The results indicated that pure g-C{sub 3}N{sub 4} has an indirect band gap of about 2.73 eV, which is in good agreement with the experimental value. By doping P into N2 and C1 sites of g-C{sub 3}N{sub 4}, the band gap reduces to 2.03 and 2.22 eV, respectively. Optical absorption intensity of g-C{sub 3}N{sub 4} had a greatly enhancement in the visible region by doping P. Though narrowing the energy band of g-C{sub 3}N{sub 4} by doping P, conduction band and valance band edge of g-C{sub 3}N{sub 4} doping system still had enough potential to split water. Therefore, phosphorus doped g-C{sub 3}N{sub 4} is effective strategy to improve visible light response photocatalytic performance of g-C{sub 3}N{sub 4}. - Highlights: • For the first time, calculated band structure of P doped g-C{sub 3N}4 by Hybrid DFT method. • P doped g-C{sub 3N}4 narrowed band gap and enhanced optical absorption. • P doped g-C3{sub N4} enhanced the oxidation capacity of the valence band edge.

3. Stabilizing inverse problems by internal data. II: non-local internal data and generic linearized uniqueness

KAUST Repository

Kuchment, Peter; Steinhauer, Dustin

2015-01-01

coupled physics (hybrid) imaging modalities could turn extremely unstable techniques, such as optical tomography or electrical impedance tomography, into stable, good-resolution procedures. It was shown that in all cases of interest, the Fréchet derivative

4. Towards a resolution of the cosmological singularity in non-local higher derivative theories of gravity

International Nuclear Information System (INIS)

Biswas, Tirthabir; Koivisto, Tomi; Mazumdar, Anupam

2010-01-01

One of the greatest problems of standard cosmology is the Big Bang singularity. Previously it has been shown that non-local ghostfree higher-derivative modifications of Einstein gravity in the ultra-violet regime can admit non-singular bouncing solutions. In this paper we study in more details the dynamical properties of the equations of motion for these theories of gravity in presence of positive and negative cosmological constants and radiation. We find stable inflationary attractor solutions in the presence of a positive cosmological constant which renders inflation geodesically complete, while in the presence of a negative cosmological constant a cyclic universe emerges. We also provide an algorithm for tracking the super-Hubble perturbations during the bounce and show that the bouncing solutions are free from any perturbative instability

5. Energy method for multi-dimensional balance laws with non-local dissipation

KAUST Repository

Duan, Renjun

2010-06-01

In this paper, we are concerned with a class of multi-dimensional balance laws with a non-local dissipative source which arise as simplified models for the hydrodynamics of radiating gases. At first we introduce the energy method in the setting of smooth perturbations and study the stability of constants states. Precisely, we use Fourier space analysis to quantify the energy dissipation rate and recover the optimal time-decay estimates for perturbed solutions via an interpolation inequality in Fourier space. As application, the developed energy method is used to prove stability of smooth planar waves in all dimensions n2, and also to show existence and stability of time-periodic solutions in the presence of the time-periodic source. Optimal rates of convergence of solutions towards the planar waves or time-periodic states are also shown provided initially L1-perturbations. © 2009 Elsevier Masson SAS.

6. The algebra of non-local charges in non-linear sigma models

International Nuclear Information System (INIS)

Abdalla, E.; Abdalla, M.C.B.; Brunelli, J.C.; Zadra, A.

1993-07-01

We obtain the exact Dirac algebra obeyed by the conserved non-local charges in bosonic non-linear sigma models. Part of the computation is specialized for a symmetry group O(N). As it turns out the algebra corresponds to a cubic deformation of the Kac-Moody algebra. The non-linear terms are computed in closed form. In each Dirac bracket we only find highest order terms (as explained in the paper), defining a saturated algebra. We generalize the results for the presence of a Wess-Zumino term. The algebra is very similar to the previous one, containing now a calculable correction of order one unit lower. (author). 22 refs, 5 figs

7. Non--Local Approach to the Analysis of the Stress Distribution in Granular Systems.

Science.gov (United States)

Scott, J. E.; Kenkre, V. M.; Hurd, A. J.

1998-03-01

A continuum mechanical theory of the stress distribution in granular materials is presented, where the transformation of the vertical spatial coordinate into a formal time variable converts the study of the static stress distribution into a generally non--Markoffian, i.e., memory-possessing (non-local) propagation analysis. Previous treatments (J. -P). Bouchaud, M. E. Cates, and P. Claudin, J. Phys. I France 5, 639 (1995). (C. -h). Liu, S. R. Nagel, D. A. Schecter, S. N. Coppersmith, S. Majumdar, O. Narayan, and T. A. Witten, Science 269, 513 (1995). are shown to be particular cases of our theory corresponding to, respectively, wave-like and dif fusive limits of the general evolution. Calculations are presented for the example of ceramic or metal powder compaction in dies, with emphasis on the understanding of previously unexplained features as seen in experimental data found in the literature o ver the past 50 years. Specific proposals for new experimental investigations are presented.

8. Random noise suppression of seismic data using non-local Bayes algorithm

Science.gov (United States)

Chang, De-Kuan; Yang, Wu-Yang; Wang, Yi-Hui; Yang, Qing; Wei, Xin-Jian; Feng, Xiao-Ying

2018-02-01

For random noise suppression of seismic data, we present a non-local Bayes (NL-Bayes) filtering algorithm. The NL-Bayes algorithm uses the Gaussian model instead of the weighted average of all similar patches in the NL-means algorithm to reduce the fuzzy of structural details, thereby improving the denoising performance. In the denoising process of seismic data, the size and the number of patches in the Gaussian model are adaptively calculated according to the standard deviation of noise. The NL-Bayes algorithm requires two iterations to complete seismic data denoising, but the second iteration makes use of denoised seismic data from the first iteration to calculate the better mean and covariance of the patch Gaussian model for improving the similarity of patches and achieving the purpose of denoising. Tests with synthetic and real data sets demonstrate that the NL-Bayes algorithm can effectively improve the SNR and preserve the fidelity of seismic data.

9. Energy method for multi-dimensional balance laws with non-local dissipation

KAUST Repository

Duan, Renjun; Fellner, Klemens; Zhu, Changjiang

2010-01-01

In this paper, we are concerned with a class of multi-dimensional balance laws with a non-local dissipative source which arise as simplified models for the hydrodynamics of radiating gases. At first we introduce the energy method in the setting of smooth perturbations and study the stability of constants states. Precisely, we use Fourier space analysis to quantify the energy dissipation rate and recover the optimal time-decay estimates for perturbed solutions via an interpolation inequality in Fourier space. As application, the developed energy method is used to prove stability of smooth planar waves in all dimensions n2, and also to show existence and stability of time-periodic solutions in the presence of the time-periodic source. Optimal rates of convergence of solutions towards the planar waves or time-periodic states are also shown provided initially L1-perturbations. © 2009 Elsevier Masson SAS.

10. Non-local coexistence of multiple spiral waves with independent frequencies

International Nuclear Information System (INIS)

Zhan Meng; Luo Jinming

2009-01-01

The interactions of several spiral waves with different independent rotation frequencies are studied in a model of two-dimensional complex Ginzburg-Laudau equation. We find a general coexistence phenomenon, non-local non-phase-locking-invasion coexistence, that is, the non-slowest spiral wave can survive and not be killed by the fastest spiral wave as it is insulated from the fastest one with the sacrifice of the slowest one, which stays in the spatial position between the fastest spiral and the non-slowest one. Both the parameter non-monotonicity and the non-phase-locking invasion between the fastest and the slowest spiral waves play key roles in this phenomenon. Importantly, the results could give a general idea for extensively observed coexistence of spiral waves in various inhomogeneous circumstances.

11. Non-local setting and outcome information for violation of Bell's inequality

International Nuclear Information System (INIS)

Pawlowski, Marcin; Kofler, Johannes; Paterek, Tomasz; Brukner, Caslav; Seevinck, Michael

2010-01-01

Bell's theorem is a no-go theorem stating that quantum mechanics cannot be reproduced by a physical theory based on realism, freedom to choose experimental settings and two locality conditions: setting (SI) and outcome (OI) independence. We provide a novel analysis of what it takes to violate Bell's inequality within the framework in which both realism and freedom of choice are assumed, by showing that it is impossible to model a violation without having information in one laboratory about both the setting and the outcome at the distant one. While it is possible that outcome information can be revealed from shared hidden variables, the assumed experimenter's freedom to choose the settings ensures that the setting information must be non-locally transferred even when the SI condition is obeyed. The amount of transmitted information about the setting that is sufficient to violate the CHSH inequality up to its quantum mechanical maximum is 0.736 bits.

12. Anatase TiO{sub 2} nanowires functionalized by organic sensitizers for solar cells: A screened Coulomb hybrid density functional study

Energy Technology Data Exchange (ETDEWEB)

Ünal, Hatice; Mete, Ersen, E-mail: emete@balikesir.edu.tr [Deparment of Physics, Balikesir University, Balikesir 10145 (Turkey); Gunceler, Deniz [Deparment of Physics, Cornell University, Ithaca, New York 14853 (United States); Gülseren, Oğuz [Department of Physics, Bilkent University, Ankara 06800 (Turkey); Ellialtioğlu, Şinasi [Basic Sciences, TED University, Ankara 06420 (Turkey)

2015-11-21

The adsorption of two different organic molecules cyanidin glucoside (C{sub 21}O{sub 11}H{sub 20}) and TA-St-CA on anatase (101) and (001) nanowires has been investigated using the standard and the range separated hybrid density functional theory calculations. The electronic structures and optical spectra of resulting dye–nanowire combined systems show distinct features for these types of photochromophores. The lowest unoccupied molecular orbital of the natural dye cyanidin glucoside is located below the conduction band of the semiconductor while, in the case of TA-St-CA, it resonates with the states inside the conduction band. The wide-bandgap anatase nanowires can be functionalized for solar cells through electron-hole generation and subsequent charge injection by these dye sensitizers. The intermolecular charge transfer character of Donor-π-Acceptor type dye TA-St-CA is substantially modified by its adsorption on TiO{sub 2} surfaces. Cyanidin glucoside exhibits relatively stronger anchoring on the nanowires through its hydroxyl groups. The atomic structures of dye–nanowire systems re-optimized with the inclusion of nonlinear solvation effects showed that the binding strengths of both dyes remain moderate even in ionic solutions.

13. Segmentation of 3D microPET images of the rat brain via the hybrid gaussian mixture method with kernel density estimation.

Science.gov (United States)

Chen, Tai-Been; Chen, Jyh-Cheng; Lu, Henry Horng-Shing

2012-01-01

Segmentation of positron emission tomography (PET) is typically achieved using the K-Means method or other approaches. In preclinical and clinical applications, the K-Means method needs a prior estimation of parameters such as the number of clusters and appropriate initialized values. This work segments microPET images using a hybrid method combining the Gaussian mixture model (GMM) with kernel density estimation. Segmentation is crucial to registration of disordered 2-deoxy-2-fluoro-D-glucose (FDG) accumulation locations with functional diagnosis and to estimate standardized uptake values (SUVs) of region of interests (ROIs) in PET images. Therefore, simulation studies are conducted to apply spherical targets to evaluate segmentation accuracy based on Tanimoto's definition of similarity. The proposed method generates a higher degree of similarity than the K-Means method. The PET images of a rat brain are used to compare the segmented shape and area of the cerebral cortex by the K-Means method and the proposed method by volume rendering. The proposed method provides clearer and more detailed activity structures of an FDG accumulation location in the cerebral cortex than those by the K-Means method.

14. Non-local statistical label fusion for multi-atlas segmentation.

Science.gov (United States)

Asman, Andrew J; Landman, Bennett A

2013-02-01

Multi-atlas segmentation provides a general purpose, fully-automated approach for transferring spatial information from an existing dataset ("atlases") to a previously unseen context ("target") through image registration. The method to resolve voxelwise label conflicts between the registered atlases ("label fusion") has a substantial impact on segmentation quality. Ideally, statistical fusion algorithms (e.g., STAPLE) would result in accurate segmentations as they provide a framework to elegantly integrate models of rater performance. The accuracy of statistical fusion hinges upon accurately modeling the underlying process of how raters err. Despite success on human raters, current approaches inaccurately model multi-atlas behavior as they fail to seamlessly incorporate exogenous intensity information into the estimation process. As a result, locally weighted voting algorithms represent the de facto standard fusion approach in clinical applications. Moreover, regardless of the approach, fusion algorithms are generally dependent upon large atlas sets and highly accurate registration as they implicitly assume that the registered atlases form a collectively unbiased representation of the target. Herein, we propose a novel statistical fusion algorithm, Non-Local STAPLE (NLS). NLS reformulates the STAPLE framework from a non-local means perspective in order to learn what label an atlas would have observed, given perfect correspondence. Through this reformulation, NLS (1) seamlessly integrates intensity into the estimation process, (2) provides a theoretically consistent model of multi-atlas observation error, and (3) largely diminishes the need for large atlas sets and very high-quality registrations. We assess the sensitivity and optimality of the approach and demonstrate significant improvement in two empirical multi-atlas experiments. Copyright © 2012 Elsevier B.V. All rights reserved.

15. Magnetic field in laser plasmas: non-local electron transport and reconnection

International Nuclear Information System (INIS)

Riquier, Raphael

2016-01-01

In the framework of the inertial confinement fusion, a pellet filled with the deuterium-tritium fuel is imploded, either through laser irradiation (direct drive, laser - low atomic number target interaction) or by the black body radiation from a cavity converting the laser radiation (indirect drive, laser - high atomic number target interaction). In both cases, a correct modeling of the electron transport is of first importance in order to have predictive hydro-radiative simulations. Nonetheless, it has been shown early on that the hypothesis of the linear transport are not valid in the framework of a solid target irradiated by a high power laser (I≅10 14 W/cm 2 ). This is due in part to very steep temperature gradients (kinetic effects, so-called 'non-local') and because of a magnetic field self-generated through the thermo-electric effect. Finally, the heat flux and the magnetic field are strongly coupled through two mechanisms: the advection of the field with the heat flux (Nernst effect) and the rotation and inhibition of the heat flux by the plasma's magnetization (Righi-Leduc effect).In this manuscript, we will first present the various electron transport models, particularly the non-local with magnetic field model included in the hydro-radiative code FCI2. Following, in order to validate this model, we will compare it first against a kinetic code, and then with an experiment during which the magnetic field has been probed through proton radiography. Once the model validated, we will use FCI2 simulations to explain the source and transport of the field, as well as its effect on the interaction. Finally, the reconnection of the magnetic field, during the irradiation of a solid target by two laser beams, will be studied. (author) [fr

16. Occurrence of exact R{sup 2} inflation in non-local UV-complete gravity

Energy Technology Data Exchange (ETDEWEB)

Koshelev, Alexey S. [Departamento de Física and Centro de Matemática e Aplicações (CMA-UBI),Universidade da Beira Interior, 6200 Covilhã (Portugal); Theoretische Natuurkunde, Vrije Universiteit Brussel, and The International Solvay Institutes,Pleinlaan 2, B-1050 Brussels (Belgium); Modesto, Leonardo [Department of Physics, Southern University of Science and Technology, Shenzhen 518055 (China); Department of Physics & Center for Field Theory and Particle Physics, Fudan University,200433 Shanghai (China); Rachwał, Lesław [Department of Physics & Center for Field Theory and Particle Physics, Fudan University,200433 Shanghai (China); Starobinsky, Alexei A. [L.D. Landau Institute for Theoretical Physics RAS, Moscow 119334 (Russian Federation); Kazan Federal University, Kazan 420008, Republic of Tatarstan (Russian Federation)

2016-11-10

The R+R{sup 2}, shortly named “R{sup 2}” (“Starobinsky”) inflationary model, represents a fully consistent example of a one-parameter inflationary scenario. This model has a “graceful exit” from inflation and provides a mechanism for subsequent creation and final thermalization of the standard matter. Moreover, it produces a very good fit of the observed spectrum of primordial perturbations. In the present paper we show explicitly that the R{sup 2} inflationary spacetime is an exact solution of a range of weakly non-local (quasi-polynomial) gravitational theories, which provide an ultraviolet completion of the R{sup 2} theory. These theories are ghost-free, super-renormalizable or finite at quantum level, and perturbatively unitary. Their spectrum consists of the graviton and the scalaron that is responsible for driving the inflation. Notably, any further extension of the spectrum leads to propagating ghost degrees of freedom. We are aimed at presenting a detailed construction of such theories in the so called Weyl basis. Further, we give a special account to the cosmological implications of this theory by considering perturbations during inflation. The highlight of the non-local model is the prediction of a modified, in comparison to a local R{sup 2} model, value for the ratio of tensor and scalar power spectra r, depending on the parameters of the theory. The relevant parameters are under control to be successfully confronted with existing observational data. Furthermore, the modified r can surely meet future observational constraints.

17. Unilateral Rolling of the Foot did not Affect Non-Local Range of Motion or Balance

Directory of Open Access Journals (Sweden)

Lena Grabow, James D. Young, Jeannette M. Byrne, Urs Granacher, David G. Behm

2017-06-01

Full Text Available Non-local or crossover (contralateral and non-stretched muscles increases in range-of-motion (ROM and balance have been reported following rolling of quadriceps, hamstrings and plantar flexors. Since there is limited information regarding plantar sole (foot rolling effects, the objectives of this study were to determine if unilateral foot rolling would affect ipsilateral and contralateral measures of ROM and balance in young healthy adults. A randomized within-subject design was used to examine non-local effects of unilateral foot rolling on ipsilateral and contralateral limb ankle dorsiflexion ROM and a modified sit-and-reach-test (SRT. Static balance was also tested during a 30 s single leg stance test. Twelve participants performed three bouts of 60 s unilateral plantar sole rolling using a roller on the dominant foot with 60 s rest intervals between sets. ROM and balance measures were assessed in separate sessions at pre-intervention, immediately and 10 minutes post-intervention. To evaluate repeated measures effects, two SRT pre-tests were implemented. Results demonstrated that the second pre-test SRT was 6.6% higher than the first pre-test (p = 0.009, d = 1.91. There were no statistically significant effects of foot rolling on any measures immediately or 10 min post-test. To conclude, unilateral foot rolling did not produce statistically significant increases in ipsilateral or contralateral dorsiflexion or SRT ROM nor did it affect postural sway. Our statistically non-significant findings might be attributed to a lower degree of roller-induced afferent stimulation due to the smaller volume of myofascia and muscle compared to prior studies. Furthermore, ROM results from studies utilizing a single pre-test without a sufficient warm-up should be viewed critically.

18. Bipartite non-classical correlations for a lossy two connected qubit-cavity systems: trace distance discord and Bell's non-locality

Science.gov (United States)

Mohamed, Abdel-Baset A.

2018-04-01

In this paper, some non-classical correlations are investigated for bipartite partitions of two qubits trapped in two spatially separated cavities connected by an optical fiber. The results show that the trace distance discord and Bell's non-locality introduce other quantum correlations beyond the entanglement. Moreover, the correlation functions of the trace distance discord and the Bell's non-locality are very sensitive to the initial correlations, the coupling strengths, and the dissipation rates of the cavities. The fluctuations of the correlation functions between their initial values and gained (loss) values appear due to the unitary evolution of the system. These fluctuations depend on the chosen initial correlations between the two subsystems. The maximal violations of Bell's inequality occur when the logarithmic negativity and the trace distance discord reach certain values. It is shown that the robustness of the non-classical correlations, against the dissipation rates of the cavities, depends on the bipartite partitions reduced density matrices of the system, and is also greatly enhanced by choosing appropriate coupling strengths.

19. A comprehensive study of g-factors, elastic, structural and electronic properties of III-V semiconductors using hybrid-density functional theory

Science.gov (United States)

Bastos, Carlos M. O.; Sabino, Fernando P.; Sipahi, Guilherme M.; Da Silva, Juarez L. F.

2018-02-01

Despite the large number of theoretical III-V semiconductor studies reported every year, our atomistic understanding is still limited. The limitations of the theoretical approaches to yield accurate structural and electronic properties on an equal footing, is due to the unphysical self-interaction problem that mainly affects the band gap and spin-orbit splitting (SOC) in semiconductors and, in particular, III-V systems with similar magnitude of the band gap and SOC. In this work, we report a consistent study of the structural and electronic properties of the III-V semiconductors by using the screening hybrid-density functional theory framework, by fitting the α parameters for 12 different III-V compounds, namely, AlN, AlP, AlAs, AlSb, GaN, GaP, GaAs, GaSb, InN, InP, InAs, and InSb, to minimize the deviation between the theoretical and experimental values of the band gap and SOC. Structural relaxation effects were also included. Except for AlP, whose α = 0.127, we obtained α values that ranged from 0.209 to 0.343, which deviate by less than 0.1 from the universal value of 0.25. Our results for the lattice parameter and elastic constants indicate that the fitting of α does not affect those structural parameters when compared with the HSE06 functional, where α = 0.25. Our analysis of the band structure based on the k ṡ p method shows that the effective masses are in agreement with the experimental values, which can be attributed to the simultaneous fitting of the band gap and SOC. Also, we estimate the values of g-factors, extracted directly from the band structure, which are close to experimental results, which indicate that the obtained band structure produced a realistic set of k ṡ p parameters.

20. Testing the non-locality of quantum theory in two-kaon systems

Energy Technology Data Exchange (ETDEWEB)

Eberhard, P.H. (California Univ., Berkeley (United States). Lawrence Berkeley Lab.)

1993-06-07

An idea for testing the non-local character of quantum theory in systems made of two neutral kaons is suggested. Such tests require detecting two long-lived or two short-lived neutral kaons in coincidence, when copper slabs are either interposed on or removed from their paths. They may be performed at an asymmetric [Phi][sup 0]-factory. They could answer some questions raised by the EPR paradox and Bell's inequalities. If such tests are performed and if predictions of quantum mechanics and standard theory of kaon regeneration are verified experimentally, all descriptions of the relevant phenomena in terms of local interactions will be ruled out in principle with the exception of very peculiar ones, which imply the existence of hidden variables, of different kinds of kaons corresponding to different values of the hidden variables, and, for some of these kaons, of regeneration probabilities enhanced by a factor of the order of 400 or more over the average. Of course, the experiment may also reveal a break down of quantum theory. (orig.)

1. From Einstein's theorem to Bell's theorem: a history of quantum non-locality

Science.gov (United States)

Wiseman, H. M.

2006-04-01

In this Einstein Year of Physics it seems appropriate to look at an important aspect of Einstein's work that is often down-played: his contribution to the debate on the interpretation of quantum mechanics. Contrary to physics ‘folklore’, Bohr had no defence against Einstein's 1935 attack (the EPR paper) on the claimed completeness of orthodox quantum mechanics. I suggest that Einstein's argument, as stated most clearly in 1946, could justly be called Einstein's reality locality completeness theorem, since it proves that one of these three must be false. Einstein's instinct was that completeness of orthodox quantum mechanics was the falsehood, but he failed in his quest to find a more complete theory that respected reality and locality. Einstein's theorem, and possibly Einstein's failure, inspired John Bell in 1964 to prove his reality locality theorem. This strengthened Einstein's theorem (but showed the futility of his quest) by demonstrating that either reality or locality is a falsehood. This revealed the full non-locality of the quantum world for the first time.

2. Self-organized criticality revisited: non-local transport by turbulent amplification

DEFF Research Database (Denmark)

Milovanov, Alexander V.; Rasmussen, Jens Juul

2015-01-01

We revise the applications of self-organized criticality (SOC) as a paradigmatic model for tokamak plasma turbulence. The work, presented here, is built around the idea that some systems do not develop a pure critical state associable with SOC, since their dynamical evolution involves as a compet......We revise the applications of self-organized criticality (SOC) as a paradigmatic model for tokamak plasma turbulence. The work, presented here, is built around the idea that some systems do not develop a pure critical state associable with SOC, since their dynamical evolution involves...... as a competing key factor an inverse cascade of the energy in reciprocal space. Then relaxation of slowly increasing stresses will give rise to intermittent bursts of transport in real space and outstanding transport events beyond the range of applicability of the 'conventional' SOC. Also, we are concerned...... with the causes and origins of non-local transport in magnetized plasma, and show that this type of transport occurs naturally in self-consistent strong turbulence via a complexity coupling to the inverse cascade. We expect these coupling phenomena to occur in the parameter range of strong nonlinearity and time...

3. Spiking cortical model based non-local means method for despeckling multiframe optical coherence tomography data

Science.gov (United States)

Gu, Yameng; Zhang, Xuming

2017-05-01

Optical coherence tomography (OCT) images are severely degraded by speckle noise. Existing methods for despeckling multiframe OCT data cannot deliver sufficient speckle suppression while preserving image details well. To address this problem, the spiking cortical model (SCM) based non-local means (NLM) method has been proposed in this letter. In the proposed method, the considered frame and two neighboring frames are input into three SCMs to generate the temporal series of pulse outputs. The normalized moment of inertia (NMI) of the considered patches in the pulse outputs is extracted to represent the rotational and scaling invariant features of the corresponding patches in each frame. The pixel similarity is computed based on the Euclidean distance between the NMI features and used as the weight. Each pixel in the considered frame is restored by the weighted averaging of all pixels in the pre-defined search window in the three frames. Experiments on the real multiframe OCT data of the pig eye demonstrate the advantage of the proposed method over the frame averaging method, the multiscale sparsity based tomographic denoising method, the wavelet-based method and the traditional NLM method in terms of visual inspection and objective metrics such as signal-to-noise ratio (SNR), contrast-to-noise ratio (CNR), equivalent number of looks (ENL) and cross-correlation (XCOR).

4. Homotopic non-local regularized reconstruction from sparse positron emission tomography measurements

International Nuclear Information System (INIS)

Wong, Alexander; Liu, Chenyi; Wang, Xiao Yu; Fieguth, Paul; Bie, Hongxia

2015-01-01

Positron emission tomography scanners collect measurements of a patient’s in vivo radiotracer distribution. The system detects pairs of gamma rays emitted indirectly by a positron-emitting radionuclide (tracer), which is introduced into the body on a biologically active molecule, and the tomograms must be reconstructed from projections. The reconstruction of tomograms from the acquired PET data is an inverse problem that requires regularization. The use of tightly packed discrete detector rings, although improves signal-to-noise ratio, are often associated with high costs of positron emission tomography systems. Thus a sparse reconstruction, which would be capable of overcoming the noise effect while allowing for a reduced number of detectors, would have a great deal to offer. In this study, we introduce and investigate the potential of a homotopic non-local regularization reconstruction framework for effectively reconstructing positron emission tomograms from such sparse measurements. Results obtained using the proposed approach are compared with traditional filtered back-projection as well as expectation maximization reconstruction with total variation regularization. A new reconstruction method was developed for the purpose of improving the quality of positron emission tomography reconstruction from sparse measurements. We illustrate that promising reconstruction performance can be achieved for the proposed approach even at low sampling fractions, which allows for the use of significantly fewer detectors and have the potential to reduce scanner costs

5. Sex comparisons of non-local muscle fatigue in human elbow flexors and knee extensors

Science.gov (United States)

Ye, Xin; Beck, Travis W.; Wages, Nathan P.; Carr, Joshua C.

2018-01-01

Objectives: To examine non-local muscle fatigue (NLMF) in both contralateral homologous and non-related heterogonous muscles for both sexes. Methods: Ten men and nine women participated in this study. After the familiarization visit, subjects completed four separate randomly sequenced experimental visits, during which the fatiguing interventions (six sets of 30-second maximal isometric contractions) were performed on either their right elbow flexors or knee extensors. Before (Pre-) and after (Post-) the fatiguing interventions, the isometric strength and the corresponding surface electromyographic (EMG) amplitude were measured for the non-exercised left elbow flexors or knee extensors. Results: For the non-exercised elbow flexors, the isometric strength decreased for both sexes (sex combined mean±SE: Pre vs. Post=339.67±18.02 N vs. 314.41±16.37 N; pisometric knee extension strength for men (Pre vs. Post =845.02±66.26 N vs. 817.39±67.64 N; p=0.019), but not for women. Conclusions: The presence of NMLF can be affected by factors such as sex and muscle being tested. Women are less likely to demonstrate NLMF in lower body muscle groups. PMID:29504584

6. Non-local Fast Extraction from the CERN SPS at 100 and 440 GeV

CERN Document Server

Velotti, F M; Bartmann, W; Carlier, E; Cornelis, K; Efthymiopoulos, I; Goddard, B; Jensen, L K; Kain, V; Kowalska, M; Mertens, V; Steerenberg, R

2013-01-01

The Long Straight Section 2 (LSS2) of the CERN SPS is connected with the North Area (NA), to which the beam to date has always been extracted using a resonant extraction technique. For new proposed short- and long-baseline neutrino experiments, a fast single turn extraction to this experimental area is required. As there are no kickers in LSS2, and the integration of any new kickers with the existing electrostatic septum would be problematic, a solution has been developed to fast extract the beam using non-local extraction with other SPS kickers. Two different kicker systems have been used, the injection kicker in LSS1 and the stronger extraction kicker in LSS6 to extract 100 and 440 GeV beam, respectively. For both solutions a large emittance beam was extracted after 5 or 9 full betatron periods. The concept and simulation details are presented with the analysis of the aperture and beam loss considerations and experimental results collected during a series of beam tests.

7. Non-local transport in a tokamak plasma divertor with recycling

International Nuclear Information System (INIS)

Abou-Assaleh, Z.; Petravic, M.; Vesey, R.

1993-01-01

The plasma transport, particle and energy fluxes, near the diverter plate with high recycling has been modeled by using an electron kinetic code (Fokker-Planck International) in conjunction with a two-fluid ambipolar code. We include the effects of ionization and excitation of the hydrogen atoms. The electron energy distribution calculated from the kinetic code shows a large deviation from Maxwellian especially near the plate. This deviation from Maxwellian is due to the non-local transport of the suprathermal electrons from the SOL, and due also to the absorption of the fast electrons by the target plate. The heat flux near the plate is shown to be nonlocal, in that it is not determined uniquely by the local plasma parameters. Therefore the classical transport coefficients in the fluid model must be modified by including a nonlocal effect to produce the kinetic results. The kinetic calculation is compared with those of the fluid code with different values of the electron heat flux limiter factor (f). To reduce the computer load, the initial condition we used corresponds to the equilibrium solution already found with the fluid code with f=0.2. The fluid and Fokker-Planck codes are relaxed until all transients associated with electron dynamics have disappeared. In section 2, we present the kinetic code. The fluid code is presented in section 3. The boundary conditions used in these simulations are given in section 4. Finally the results and conclusion of these simulations are presented in section 5

8. Measure solutions for non-local interaction PDEs with two species

Energy Technology Data Exchange (ETDEWEB)

Francesco, Marco Di [Department of Mathematical and Statistical Sciences, University of Bath, Claverton Down, Bath, BA2 7AY (United Kingdom); Fagioli, Simone [DISIM—Department of Information Engineering, Computer Science and Mathematics, University of L' Aquila, Via Vetoio 1 (Coppito) 67100 L' Aquila (AQ) (Italy)

2013-10-01

This paper presents a systematic existence and uniqueness theory of weak measure solutions for systems of non-local interaction PDEs with two species, which are the PDE counterpart of systems of deterministic interacting particles with two species. The main motivations behind those models arise in cell biology, pedestrian movements, and opinion formation. In case of symmetrizable systems (i.e. with cross-interaction potentials one multiple of the other), we provide a complete existence and uniqueness theory within (a suitable generalization of) the Wasserstein gradient flow theory in Ambrosio et al (2008 Gradient Flows in Metric Spaces and in the Space of Probability Measures (Lectures in Mathematics ETH Zürich) 2nd edn (Basel: Birkhäuser)) and Carrillo et al (2011 Duke Math. J. 156 229–71), which allows the consideration of interaction potentials with a discontinuous gradient at the origin. In the general case of non-symmetrizable systems, we provide an existence result for measure solutions which uses a semi-implicit version of the Jordan–Kinderlehrer–Otto (JKO) scheme (Jordan et al 1998 SIAM J. Math. Anal. 29 1–17), which holds in a reasonable non-smooth setting for the interaction potentials. Uniqueness in the non-symmetrizable case is proven for C{sup 2} potentials using a variant of the method of characteristics. (paper)

9. Measure solutions for non-local interaction PDEs with two species

International Nuclear Information System (INIS)

Francesco, Marco Di; Fagioli, Simone

2013-01-01

This paper presents a systematic existence and uniqueness theory of weak measure solutions for systems of non-local interaction PDEs with two species, which are the PDE counterpart of systems of deterministic interacting particles with two species. The main motivations behind those models arise in cell biology, pedestrian movements, and opinion formation. In case of symmetrizable systems (i.e. with cross-interaction potentials one multiple of the other), we provide a complete existence and uniqueness theory within (a suitable generalization of) the Wasserstein gradient flow theory in Ambrosio et al (2008 Gradient Flows in Metric Spaces and in the Space of Probability Measures (Lectures in Mathematics ETH Zürich) 2nd edn (Basel: Birkhäuser)) and Carrillo et al (2011 Duke Math. J. 156 229–71), which allows the consideration of interaction potentials with a discontinuous gradient at the origin. In the general case of non-symmetrizable systems, we provide an existence result for measure solutions which uses a semi-implicit version of the Jordan–Kinderlehrer–Otto (JKO) scheme (Jordan et al 1998 SIAM J. Math. Anal. 29 1–17), which holds in a reasonable non-smooth setting for the interaction potentials. Uniqueness in the non-symmetrizable case is proven for C 2 potentials using a variant of the method of characteristics. (paper)

10. The morphing method as a flexible tool for adaptive local/non-local simulation of static fracture

KAUST Repository

Azdoud, Yan

2014-04-19

We introduce a framework that adapts local and non-local continuum models to simulate static fracture problems. Non-local models based on the peridynamic theory are promising for the simulation of fracture, as they allow discontinuities in the displacement field. However, they remain computationally expensive. As an alternative, we develop an adaptive coupling technique based on the morphing method to restrict the non-local model adaptively during the evolution of the fracture. The rest of the structure is described by local continuum mechanics. We conduct all simulations in three dimensions, using the relevant discretization scheme in each domain, i.e., the discontinuous Galerkin finite element method in the peridynamic domain and the continuous finite element method in the local continuum mechanics domain. © 2014 Springer-Verlag Berlin Heidelberg.

11. Self-assembly formation of Bi-functional Co3O4/MnO2-CNTs hybrid catalysts for achieving both high energy/power density and cyclic ability of rechargeable zinc-air battery.

Science.gov (United States)

Xu, Nengneng; Liu, Yuyu; Zhang, Xia; Li, Xuemei; Li, Aijun; Qiao, Jinli; Zhang, Jiujun

2016-09-20

α-MnO2 nanotubes-supported Co3O4 (Co3O4/MnO2) and its carbon nanotubes (CNTs)-hybrids (Co3O4/MnO2-CNTs) have been successfully developed through a facile two-pot precipitation reaction and hydrothermal process, which exhibit the superior bi-functional catalytic activity for both ORR and OER. The high performance is believed to be induced by the hybrid effect among MnO2 nanotubes, hollow Co3O4 and CNTs, which can produce a synergetic enhancement. When integrated into the practical primary and electrochemically rechargeable Zn-air batteries, such a hybrid catalyst can give a discharge peak power density as high as 450 mW cm(-2). At 1.0 V of cell voltage, a current density of 324 mA cm(-2) is achieved. This performance is superior to all reported non-precious metal catalysts in literature for zinc-air batteries and significantly outperforms the state-of-the-art platinum-based catalyst. Particularly, the rechargeable Zn-air battery can be fabricated into all-solid-state one through a simple solid-state approach, which exhibits an excellent peak power density of 62 mW cm(-2), and the charge and discharge potentials remain virtually unchanged during the overall cycles, which is comparable to the one with liquid electrolyte.

12. Probing the transition from non-localization to localization by K-shell photoemission from isotope-substituted N2

International Nuclear Information System (INIS)

Rolles, Daniel; Braune, Markus; Cvejanovic, Slobodan; Gessner, Oliver; Hentges, Rainer; Korica, Sanja; Langer, Burkhard; Lischke, Toralf; Pruemper, Georg; Reinkoester, Axel; Viefhaus, Jens; Zimmermann, Bjoern; McKoy, Vince; Becker, Uwe

2006-01-01

In homonuclear diatomic molecules such as N 2 , the inversion symmetry of the system causes non-local, coherent behavior of the otherwise localized core holes. The non-locality of the electron emission and the remaining core hole changes in a continuous way into partially localized behaviour if a gradual breakdown of the inversion symmetry is induced by isotope substitution. This is reflected by a loss of interference and a parity mixing of the outgoing photoelectron waves. Our results represent the first experimentally observed isotope effect on the electronic structure of a diatomic molecule

13. Global existence conditions for a non-local problem arising in statistical mechanics

NARCIS (Netherlands)

C.J. van Duijn (Hans); I.A. Guerra (Ignacio Antonio); M.A. Peletier (Mark)

2001-01-01

textabstractWe consider the evolution of the density and temperature of athree-dimensional cloud of self-interacting particles. This phenomenon ismodelled by a parabolic equation for the density distributioncombining temperature-dependent diffusion and convection drivenby the gradient of the

14. Hybrid-DFT  +  V w method for band structure calculation of semiconducting transition metal compounds: the case of cerium dioxide.

Science.gov (United States)

Ivády, Viktor; Gali, Adam; Abrikosov, Igor A

2017-11-15

Hybrid functionals' non-local exchange-correlation potential contains a derivative discontinuity that improves on standard semi-local density functional theory (DFT) band gaps. Moreover, by careful parameterization, hybrid functionals can provide self-interaction reduced description of selected states. On the other hand, the uniform description of all the electronic states of a given system is a known drawback of these functionals that causes varying accuracy in the description of states with different degrees of localization. This limitation can be remedied by the orbital dependent exact exchange extension of hybrid functionals; the hybrid-DFT  +  V w method (Ivády et al 2014 Phys. Rev. B 90 035146). Based on the analogy of quasi-particle equations and hybrid-DFT single particle equations, here we demonstrate that parameters of hybrid-DFT  +  V w functional can be determined from approximate theoretical quasi-particle spectra without any fitting to experiment. The proposed method is illustrated on the charge self-consistent electronic structure calculation for cerium dioxide where itinerant valence states interact with well-localized 4f atomic like states, making this system challenging for conventional methods, either hybrid-DFT or LDA  +  U, and therefore allowing for a demonstration of the advantages of the proposed scheme.

15. On monogamy of non-locality and macroscopic averages: examples and preliminary results

Directory of Open Access Journals (Sweden)

Rui Soares Barbosa

2014-12-01

Full Text Available We explore a connection between monogamy of non-locality and a weak macroscopic locality condition: the locality of the average behaviour. These are revealed by our analysis as being two sides of the same coin. Moreover, we exhibit a structural reason for both in the case of Bell-type multipartite scenarios, shedding light on but also generalising the results in the literature [Ramanathan et al., Phys. Rev. Lett. 107, 060405 (2001; Pawlowski & Brukner, Phys. Rev. Lett. 102, 030403 (2009]. More specifically, we show that, provided the number of particles in each site is large enough compared to the number of allowed measurement settings, and whatever the microscopic state of the system, the macroscopic average behaviour is local realistic, or equivalently, general multipartite monogamy relations hold. This result relies on a classical mathematical theorem by Vorob'ev [Theory Probab. Appl. 7(2, 147-163 (1962] about extending compatible families of probability distributions defined on the faces of a simplicial complex – in the language of the sheaf-theoretic framework of Abramsky & Brandenburger [New J. Phys. 13, 113036 (2011], such families correspond to no-signalling empirical models, and the existence of an extension corresponds to locality or non-contextuality. Since Vorob'ev's theorem depends solely on the structure of the simplicial complex, which encodes the compatibility of the measurements, and not on the specific probability distributions (i.e. the empirical models, our result about monogamy relations and locality of macroscopic averages holds not just for quantum theory, but for any empirical model satisfying the no-signalling condition. In this extended abstract, we illustrate our approach by working out a couple of examples, which convey the intuition behind our analysis while keeping the discussion at an elementary level.

16. Numerical study on non-locally reacting behavior of nacelle liners incorporating drainage slots

Science.gov (United States)

Chen, Chao; Li, Xiaodong; Thiele, Frank

2018-06-01

For acoustic liners used in current commercial nacelles, in order to prevent any liquid accumulating in the resonators, drainage slots are incorporated on the partition walls between closely packed cavities. Recently, an experimental study conducted by Busse-Gerstengarbe et al. shown that the cell interaction introduced by drainage slots causes an additional dissipation peak which increases with the size of the slot. However, the variation of damping process due to drainage slots is still not fully understood. Therefore, a numerical study based on computational aeroacoustic methods is carried out to investigate the mechanism of the changed attenuation characteristics due to drainage slots in presence of grazing incident sound waves with low or high intensities. Different slot configurations are designed based on the generic non-locally reacting liner model adopted in the experimental investigation. Both 2-D and 3-D numerical simulations of only slit resonators are carried out. Numerical results indicate that the extra peak is a result of a resonance excited in the second cavity at specific frequency. Under high sound pressure level incoming waves, the basic characteristics of the acoustic performance remain. However, vortex shedding transpires at the resonances around both the slits and the drainage slot. Vorticity contours show that the connection of two coupled cavities decreases the strength of vortex shedding around the basic Helmholtz resonance due to a higher energy reflection. Meanwhile, the cell interaction significantly increases the vorticity magnitude near the extra resonant frequency. Finally, a semi-empirical model is derived to predict the extra attenuation peak frequency.

17. Non-local energy deposition: A problem in regional RF hyperthermia

International Nuclear Information System (INIS)

Hagmann, M.J.; Levin, R.L.

1984-01-01

As the frequency is decreased below 1 GHz, RF applicators can cause deep heating of tissues. However, there is a concomitant problem in that significant energy deposition may occur well beyond the dimensions of the applicator. The BSD Medical Corporation has described to the authors tests with a phantom manequin in which SAR in the neck was significantly greater than that in the abdomen when an Annular Phased Array System (APAS) was positioned for abdominal heating. The authors have obtained numerical solutions for the SAR distribution in a 180-cell inhomogeneous block model of man subjected to r-f irradiation approximating that emanating from various applicators. The solutions agree with the reports of BSD that significant heating in the neck, inner thighs, and back will occur with an abdominally-placed APAS. They suggest that a similar problem will occur with a helical-coil or other applicator for which the electric field is predominantly parallel to the axis of the body. Typically, 70% or more of the total energy will be deposited outside the bounds of an axial applicator when it is placed around the chest or abdomen. The problem is most severe at frequencies for which body parts such as the arm or head may resonate. In such cases, over 90% of the energy may be deposited outside the bounds of applicator. The problem of non-local energy deposition appears to be substantially reduced for non-axial applicators. If the arm extends outward from the side of the body, an axial applicator around it will cause negligible energy deposition in the rest of the body

18. Local and non-local deficits in amblyopia: acuity and spatial interactions.

Science.gov (United States)

Bonneh, Yoram S; Sagi, Dov; Polat, Uri

2004-12-01

Amblyopic vision is thought to be limited by abnormal long-range spatial interactions, but their exact mode of action and relationship to the main amblyopic deficit in visual acuity is largely unknown. We studied this relationship in a group (N=59) of anisometropic (N=21) and strabismic (or combined, N=38) subjects, using (1) a single and multi-pattern (crowded) computerized static Tumbling-E test with scaled spacing of two pattern widths (TeVA), in addition to an optotype (ETDRS chart) acuity test (VA) and (2) contrast detection of Gabor patches with lateral flankers (lateral masking) along the horizontal and vertical axes as well as in collinear and parallel configurations. By correlating the different measures of visual acuity and contrast suppression, we found that (1) the VA of the strabismic subjects could be decomposed into two uncorrelated components measured in TeVA: acuity for isolated patterns and acuity reduction due to flanking patterns. The latter comprised over 60% of the VA magnitude, on the average and accounted for over 50% of its variance. In contrast, a slight reduction in acuity was found in the anisometropic subjects, and the acuity for a single pattern could account for 70% of the VA variance. (2) The lateral suppression (contrast threshold elevation) in a parallel configuration along the horizontal axis was correlated with the VA (R2=0.7), as well as with the crowding effect (TeVA elevation, R2=0.5) for the strabismic group. Some correlation with the VA was also found for the collinear configuration in the anisometropic group, but less suppression and no correlation were found for all the vertical configurations in all the groups. The results indicate the existence of a specific non-local component of the strabismic deficit, in addition to the local acuity deficit in all amblyopia types. This deficit might reflect long-range lateral inhibition, or alternatively, an inaccurate and scattered top-down attentional selection mechanism.

19. (Non-) homomorphic approaches to denoise intensity SAR images with non-local means and stochastic distances

Science.gov (United States)

Penna, Pedro A. A.; Mascarenhas, Nelson D. A.

2018-02-01

The development of new methods to denoise images still attract researchers, who seek to combat the noise with the minimal loss of resolution and details, like edges and fine structures. Many algorithms have the goal to remove additive white Gaussian noise (AWGN). However, it is not the only type of noise which interferes in the analysis and interpretation of images. Therefore, it is extremely important to expand the filters capacity to different noise models present in li-terature, for example the multiplicative noise called speckle that is present in synthetic aperture radar (SAR) images. The state-of-the-art algorithms in remote sensing area work with similarity between patches. This paper aims to develop two approaches using the non local means (NLM), developed for AWGN. In our research, we expanded its capacity for intensity SAR ima-ges speckle. The first approach is grounded on the use of stochastic distances based on the G0 distribution without transforming the data to the logarithm domain, like homomorphic transformation. It takes into account the speckle and backscatter to estimate the parameters necessary to compute the stochastic distances on NLM. The second method uses a priori NLM denoising with a homomorphic transformation and applies the inverse Gamma distribution to estimate the parameters that were used into NLM with stochastic distances. The latter method also presents a new alternative to compute the parameters for the G0 distribution. Finally, this work compares and analyzes the synthetic and real results of the proposed methods with some recent filters of the literature.

20. Hybrid functional pseudopotentials

Science.gov (United States)

Yang, Jing; Tan, Liang Z.; Rappe, Andrew M.

2018-02-01

The consistency between the exchange-correlation functional used in pseudopotential construction and in the actual density functional theory calculation is essential for the accurate prediction of fundamental properties of materials. However, routine hybrid density functional calculations at present still rely on generalized gradient approximation pseudopotentials due to the lack of hybrid functional pseudopotentials. Here, we present a scheme for generating hybrid functional pseudopotentials, and we analyze the importance of pseudopotential density functional consistency for hybrid functionals. For the PBE0 hybrid functional, we benchmark our pseudopotentials for structural parameters and fundamental electronic gaps of the Gaussian-2 (G2) molecular dataset and some simple solids. Our results show that using our PBE0 pseudopotentials in PBE0 calculations improves agreement with respect to all-electron calculations.

1. Effects of different stocking densities on performance and activity of cattle × yak hybrids along a transhumance route in the Eastern Himalaya.

Science.gov (United States)

Barsila, Shanker R; Devkota, Naba R; Kreuzer, Michael; Marquardt, Svenja

2015-01-01

Twelve lactating cattle × yak hybrids (B. taurus × B. grunniens) were investigated on five experimental pastures (Sites 1-5), following an up- and downward transhumance route (3,200, 4,000, 4,500, 4,000 and 2,600 m a.s.l.). Hybrids were kept in replicated groups of two (low SD) and four animals per paddock (high SD). As a control, yaks (with calves) were included at low SD at Sites 2-4. Performance was described by body weight, milk yield and composition. Herbage samples as selected by the animals were analyzed. Activity patterns of the hybrids were assessed at Sites 2-4. At similar body weight change and milk composition, the individual hybrids on average produced 26% less milk at high than at low SD. However, at high SD on average still 49% more milk/m(2) of pasture area was produced. Milk fat increased with time from 5.4 to 7.1%, milk protein decreased from 4.2 to 3.3%. At high SD, the hybrids spent less time standing and more time lying. The yaks gained weight at 4,500 m a.s.l. while the hybrids lost weight (+836 and -653 g/animal/day, respectively). In conclusion, high SD reduced individual milk yield and forced hybrids to spend more time for feeding. The yaks apparently had an advantage over the hybrids at very high altitude.

2. Density functional theory study of the conformation and optical properties of hybrid Au(n)-dithienylethene systems (n = 3, 19, 25).

Science.gov (United States)

Fihey, Arnaud; Kloss, Benedikt; Perrier, Aurélie; Maurel, François

2014-07-03

We present a theoretical study of Aun-dithienylethene hybrid systems (n = 3, 19, 25), where the organic molecule is covalently linked to a nanometer-scaled gold nanoparticle (NP). We aim at gaining insights on the optical properties of such photochromic devices and proposing a size-limited gold aggregate model able to recover the optical properties of the experimental system. We thus present a DFT-based calculation scheme to model the ground-state (conformation, energetic parameters) and excited-state properties (UV-visible absorption spectra) of this type of hybrid systems. Within this framework, the structural parameters (adsorption site, orientation, and internal structure of the photochrome) are found to be slightly dependent on the size/shape of the gold aggregate. The influence of the gold fragment on the optical properties of the resulting hybrid system is then discussed with the help of TD-DFT combined with an analysis of the virtual orbitals involved in the photochromic transitions. We show that, for the open hybrid isomer, the number of gold atoms is the key parameter to recover the photoactive properties that are experimentally observed. On the contrary, for hybrid closed systems, the three-dimensional structure of the metallic aggregate is of high impact. We thus conclude that Au25 corresponds to the most appropriate fragment to model nanometer-sized NP-DTE hybrid device.

3. Anomalous van der Waals-Casimir interactions on graphene: A concerted effect of temperature, retardation, and non-locality

Science.gov (United States)

Ambrosetti, Alberto; Silvestrelli, Pier Luigi

2018-04-01

Dispersion forces play a major role in graphene, largely influencing adhesion of adsorbate moieties and stabilization of functional multilayered structures. However, the reliable prediction of dispersion interactions on graphene up to the relevant ˜10 nm scale is an extremely challenging task: in fact, electromagnetic retardation effects and the highly non-local character of π electrons can imply sizeable qualitative variations of the interaction with respect to known pairwise approaches. Here we address both issues, determining the finite-temperature van der Waals (vdW)-Casimir interaction for point-like and extended adsorbates on graphene, explicitly accounting for the non-local dielectric permittivity. We find that temperature, retardation, and non-locality play a crucial role in determining the actual vdW scaling laws and the stability of both atomic and larger molecular adsorbates. Our results highlight the importance of these effects for a proper description of systems of current high interest, such as graphene interacting with biomolecules, and self-assembly of complex nanoscale structures. Due to the generality of our approach and the observed non-locality of other 2D materials, our results suggest non-trivial vdW interactions from hexagonal mono-layered materials from group 14 of the periodic table, to transition metal dichalcogenides.

4. Non-local model analysis of heat pulse propagation and simulation of experiments in W7-AS

International Nuclear Information System (INIS)

Iwasaki, Takuya; Itoh, Sanae-I.; Yagi, Masatoshi; Itoh, Kimitaka; Stroth, U.

1999-01-01

A new model equation which includes the non-local effect in the hear flux is introduced to study the transient transport phenomena. A non-local heat flux, which is expressed in terms of the integral equation, is superimposed on the conventional form of the heat flux. This model is applied to describe the experimental results from the power switching [U. Stroth et al.: Plasma Phys. Control. Fusion 38 (1996) 1087] and the power modulation experiments [L. Giannone et al.: Nucl. Fusion 32 (1992) 1985] in the W7-AS stellarator. A small fraction of non-local component in the heat flux is found to be very effective in modifying the response against an external modulation. The transient feature of the transport property, which are observed in the response of heat pulse propagation, are qualitatively reproduced by the transport simulations based on this model. A possibility is discussed to estimate the correlation length of the non-local effect experimentally by use of the results of transport simulations. (author)

5. Solvability conditions for non-local boundary value problems for two-dimensional half-linear differential systems

Czech Academy of Sciences Publication Activity Database

2011-01-01

Roč. 74, č. 17 (2011), s. 6537-6552 ISSN 0362-546X Institutional research plan: CEZ:AV0Z10190503 Keywords : half-linear differential system * non-local boundary value problem * solvability Subject RIV: BA - General Mathematics Impact factor: 1.536, year: 2011 http://www.sciencedirect.com/science/article/pii/S0362546X11004573

6. Once an Outsider, Always an Outsider? The Accessibility of the Dutch Rural Housing Market among Locals and Non-Locals

Science.gov (United States)

de Groot, Carola; Daalhuizen, Femke B. C.; van Dam, Frank; Mulder, Clara H.

2012-01-01

One of the most pressing questions in the rural gentrification literature is whether rural residents face difficulties in finding a home within their locality due to the influx of more wealthy newcomers. In this paper, we investigate the extent to which intended local movers and intended non-local movers have realised their rural residential…

7. A NON-LOCAL THERMODYNAMIC EQUILIBRIUM ANALYSIS OF BORON ABUNDANCES IN METAL-POOR STARS

International Nuclear Information System (INIS)

Tan Kefeng; Shi Jianrong; Zhao Gang

2010-01-01

The non-local thermodynamic equilibrium (NLTE) line formation of neutral boron in the atmospheres of cool stars are investigated. Our results confirm that NLTE effects for the B I resonance lines, which are due to a combination of overionization and optical pumping effects, are most important for hot, metal-poor, and low-gravity stars; however, the amplitude of departures from local thermodynamic equilibrium (LTE) found by this work is smaller than that of previous studies. In addition, our calculation shows that the line formation of B I will get closer to LTE if the strength of collisions with neutral hydrogen increases, which is contrary to the result of previous studies. The NLTE line formation results are applied to the determination of boron abundances for a sample of 16 metal-poor stars with the method of spectrum synthesis of the B I 2497 A resonance lines using the archived HST/GHRS spectra. Beryllium and oxygen abundances are also determined for these stars with the published equivalent widths of the Be II 3131 A resonance and O I 7774 A triplet lines, respectively. The abundances of the nine stars which are not depleted in Be or B show that, no matter what the strength of collisions with neutral hydrogen may be, both Be and B increase with O quasilinearly in the logarithmic plane, which confirms the conclusions that Be and B are mainly produced by the primary process in the early Galaxy. The most noteworthy result of this work is that B increases with Fe or O at a very similar speed as, or a bit faster than, Be does, which is in accord with the theoretical models. The B/Be ratios remain almost constant over the metallicity range investigated here. Our average B/Be ratio falls in the interval [13 ± 4, 17 ± 4], which is consistent with the predictions of the spallation process. The contribution of B from the ν-process may be required if the 11 B/ 10 B isotopic ratios in metal-poor stars are the same as the meteoric value. An accurate measurement of the

8. Non-localization and localization ROC analyses using clinically based scoring

Science.gov (United States)

Paquerault, Sophie; Samuelson, Frank W.; Myers, Kyle J.; Smith, Robert C.

2009-02-01

. The results on the variance analysis differed from those observed in the other study setting. This investigation furthers our understanding of the relationships between non-localization-specific and localization-specific ROC assessment methodologies and their relevance to clinical practice.

9. New insights on emergence from the perspective of weak values and dynamical non-locality

Science.gov (United States)

Tollaksen, Jeff

2014-04-01

In this article, we will examine new fundamental aspects of "emergence" and "information" using novel approaches to quantum mechanics which originated from the group around Aharonov. The two-state vector formalism provides a complete description of pre- and post-selected quantum systems and has uncovered a host of new quantum phenomena which were previously hidden. The most important feature is that any weak coupling to a pre- and post-selected system is effectively a coupling to a "weak value" which is given by a simple expression depending on the two-state vector. In particular, weak values, are the outcomes of so called "weak measurements" which have recently become a very powerful tool for ultra-sensitive measurements. Using weak values, we will show how to separate a particle from its properties, not unlike the Cheshire cat story: "Well! I've often seen a cat without a grin," thought Alice; "but a grin without a cat! It's the most curious thing I ever saw in all my life!" Next, we address the question whether the physics on different scales "emerges" from quantum mechanics or whether the laws of physics at those scales are fundamental. We show that the classical limit of quantum mechanics is a far more complicated issue; it is in fact dramatically more involved and it requires a complete revision of all our intuitions. The revised intuitions can then serve as a guide to finding novel quantum effects. Next we show that novel experimental aspects of contextuality can be demonstrated with weak measurements and these suggest new restrictions on hidden variable approaches. Next we emphasize that the most important implication of the Aharonov-Bohm effect is the existence of non-local interactions which do not violate causality. Finally, we review some generalizations of quantum mechanics and their implications for "emergence" and "information." First, we review an alternative approach to quantum evolution in which each moment of time is viewed as a new "universe

10. New insights on emergence from the perspective of weak values and dynamical non-locality

International Nuclear Information System (INIS)

Tollaksen, Jeff

2014-01-01

In this article, we will examine new fundamental aspects of 'emergence' and 'information' using novel approaches to quantum mechanics which originated from the group around Aharonov. The two-state vector formalism provides a complete description of pre- and post-selected quantum systems and has uncovered a host of new quantum phenomena which were previously hidden. The most important feature is that any weak coupling to a pre- and post-selected system is effectively a coupling to a 'weak value' which is given by a simple expression depending on the two-state vector. In particular, weak values, are the outcomes of so called 'weak measurements' which have recently become a very powerful tool for ultra-sensitive measurements. Using weak values, we will show how to separate a particle from its properties, not unlike the Cheshire cat story: 'Well! I've often seen a cat without a grin', thought Alice; 'but a grin without a cat! It's the most curious thing I ever saw in all my life!' Next, we address the question whether the physics on different scales 'emerges' from quantum mechanics or whether the laws of physics at those scales are fundamental. We show that the classical limit of quantum mechanics is a far more complicated issue; it is in fact dramatically more involved and it requires a complete revision of all our intuitions. The revised intuitions can then serve as a guide to finding novel quantum effects. Next we show that novel experimental aspects of contextuality can be demonstrated with weak measurements and these suggest new restrictions on hidden variable approaches. Next we emphasize that the most important implication of the Aharonov-Bohm effect is the existence of non-local interactions which do not violate causality. Finally, we review some generalizations of quantum mechanics and their implications for 'emergence' and 'information'. First, we review an

11. Robust non-local effects of ocean heat uptake on radiative feedback and subtropical cloud cover

Science.gov (United States)

Rose, B. E. J.

2016-02-01

moisture. Our results suggest that cloud feedback under transient climate change is partly modulated by ocean heat uptake through robust but non-local atmospheric processes, and has implications on a timescales ranging from inter-annual to multi-centennial.

12. Study on H-mode access at low density with lower hybrid current drive and lithium-wall coatings on the EAST superconducting tokamak

DEFF Research Database (Denmark)

Xu, G.S.; Wan, B.N.; Li, J.G.

2011-01-01

The first high-confinement mode (H-mode) with type-III edge localized modes at an H factor of HIPB98(y,2) ~ 1 has been obtained with about 1 MW lower hybrid wave power on the EAST superconducting tokamak. The first H-mode plasma appeared after wall conditioning by lithium (Li) evaporation before ...

13. One-loop effective action for non-local modified Gauss-Bonnet gravity in de Sitter space

Energy Technology Data Exchange (ETDEWEB)

Cognola, Guido; Zerbini, Sergio [Universita di Trento (Italy); Istituto Nazionale di Fisica Nucleare Gruppo Collegato di Trento, Dipartimento di Fisica, Trento (Italy); Elizalde, Emilio [Consejo Superior de Investigaciones Cientificas (ICE/CSIC) and Institut d' Estudis Espacials de Catalunya (IEEC), Facultat Ciencies, Bellaterra (Barcelona) (Spain); Nojiri, Shin' ichi [Nagoya University, Department of Physics, Nagoya (Japan); Odintsov, Sergei D. [Consejo Superior de Investigaciones Cientificas (ICE/CSIC) and Institut d' Estudis Espacials de Catalunya (IEEC), Facultat Ciencies, Bellaterra (Barcelona) (Spain); ICREA, Barcelona (Spain); TSPU, Center of Theor. Phys., Tomsk (Russian Federation)

2009-12-15

We discuss the classical and quantum properties of non-local modified Gauss-Bonnet gravity in de Sitter space, using its equivalent representation via string-inspired local scalar-Gauss-Bonnet gravity with a scalar potential. A classical, multiple de Sitter universe solution is found where one of the de Sitter phases corresponds to the primordial inflationary epoch, while the other de Sitter space solution - the one with the smallest Hubble rate - describes the late-time acceleration of our universe. A Chameleon scenario for the theory under investigation is developed, and it is successfully used to show that the theory complies with gravitational tests. An explicit expression for the one-loop effective action for this non-local modified Gauss-Bonnet gravity in the de Sitter space is obtained. It is argued that this effective action might be an important step towards the solution of the cosmological constant problem. (orig.)

14. Generalized non-Local Resistance Expression and its Application in F/N/F Spintronic Structure with Graphene Channel

Science.gov (United States)

Wei, Huazhou; Fu, Shiwei

We report our work on the spin transport properties in the F/N/F(ferromagnets/normal metal/ferromagnets) spintronic structure from a new theoretical perspective. A significant problem in the field is to explain the inferior measured order of magnitude for spin lifetime. Based on the known non-local resistance formula and the mechanism analysis of spin-flipping within the interfaces between F and N, we analytically derive a broadly applicable new non-local resistance expression and a generalized Hanle curve formula. After employing them in the F/N/F structure under different limits, especially in the case of graphene channel, we find that the fitting from experimental data would yield a longer spin lifetime, which approaches its theoretical predicted value in graphene. The authors acknowledge the financial support by China University of Petroleum-Beijing and the Key Laboratory of Optical Detection Technology for Oil and Gas in this institution.

15. Using non-local databases for the environmental assessment of industrial activities: The case of Latin America

International Nuclear Information System (INIS)

Osses de Eicker, Margarita; Hischier, Roland; Hurni, Hans; Zah, Rainer

2010-01-01

Nine non-local databases were evaluated with respect to their suitability for the environmental assessment of industrial activities in Latin America. Three assessment methods were considered, namely Life Cycle Assessment (LCA), Environmental Impact Assessment (EIA) and air emission inventories. The analysis focused on data availability in the databases and the applicability of their international data to Latin American industry. The study showed that the European EMEP/EEA Guidebook and the U.S. EPA AP-42 database are the most suitable ones for air emission inventories, whereas the LCI database Ecoinvent is the most suitable one for LCA and EIA. Due to the data coverage in the databases, air emission inventories are easier to develop than LCA or EIA, which require more comprehensive information. One strategy to overcome the limitations of non-local databases for Latin American industry is the combination of validated data from international databases with newly developed local datasets.

16. Computing wave functions in multichannel collisions with non-local potentials using the R-matrix method

Science.gov (United States)

Bonitati, Joey; Slimmer, Ben; Li, Weichuan; Potel, Gregory; Nunes, Filomena

2017-09-01

The calculable form of the R-matrix method has been previously shown to be a useful tool in approximately solving the Schrodinger equation in nuclear scattering problems. We use this technique combined with the Gauss quadrature for the Lagrange-mesh method to efficiently solve for the wave functions of projectile nuclei in low energy collisions (1-100 MeV) involving an arbitrary number of channels. We include the local Woods-Saxon potential, the non-local potential of Perey and Buck, a Coulomb potential, and a coupling potential to computationally solve for the wave function of two nuclei at short distances. Object oriented programming is used to increase modularity, and parallel programming techniques are introduced to reduce computation time. We conclude that the R-matrix method is an effective method to predict the wave functions of nuclei in scattering problems involving both multiple channels and non-local potentials. Michigan State University iCER ACRES REU.

17. Complete mechanical behavior analysis of FG Nano Beam under non-uniform loading using non-local theory

Science.gov (United States)

Ghaffari, I.; Parhizkar Yaghoobi, M.; Ghannad, M.

2018-01-01

The purpose of this study is to offer a complete solution to analyze the mechanical behavior (bending, buckling and vibration) of Nano-beam under non-uniform loading. Furthermore, the effects of size (nonlocal parameters), non-homogeneity constants, and different boundary conditions are investigated by using this method. The exact solution presented here reduces costs incurred by experiments. In this research, the displacement field obeys the kinematics of the Euler-Bernoulli beam theory and non-local elasticity theory has been used. The governing equations and general boundary conditions are derived for a beam by using energy method. The presented solution enables us to analyze any kind of loading profile and boundary conditions with no limitations. Furthermore, this solution, unlike previous studies, is not a series-solution; hence, there is no limitation prior to existing with the series-solution, nor does it need to check convergence. Based on the developed analytical solution, the influence of size, non-homogeneity and non-uniform loads on bending, buckling and vibration behaviors is discussed. Also, the obtained result is highly accurate and in good agreement with previous research. In theoretical method, the allowable range for non-local parameters can be determined so as to make a major contribution to the reduction of the cost of experiments determining the value of non-local parameters.

18. Delay-active damage versus non-local enhancement for anisotropic damage dynamics computations with alternated loading

International Nuclear Information System (INIS)

Desmorat, R.; Chambart, M.; Gatuingt, F.; Guilbaud, D.

2010-01-01

Anisotropic damage thermodynamics framework allows to model the concrete-like materials behavior and in particular their dissymmetric tension/compression response. To deal with dynamics applications such as impact, it is furthermore necessary to take into account the strain rate effect observed experimentally. This is done in the present work by means of anisotropic visco-damage, by introducing a material strain rate effect in the cases of positive hydrostatic stresses only. The proposed delay-damage law assumes no viscous effect in compression as the consideration of inertia effects proves sufficient to model the apparent material strength increase. High-rate dynamics applications imply to deal with wave propagation and reflection which can generate alternated loading in the impacted structure. In order to do so, the key concept of active damage is defined and introduced within both the damage criterion and the delay-damage evolution law. At the structural level, strain localization often leads to spurious mesh dependency. Three-dimensional Finite Element computations of dynamic tensile tests by spalling are presented, with visco-damage and either without or with non-local enhancement. Delay-damage, as introduced, regularizes the solution in fast dynamics. The location of the macro-crack initiated is found influenced by non-local regularization. The strain rate range in which each enhancement, delay-damage or non-local enhancement, has a regularizing effect is studied. (authors)

19. Stabilizing inverse problems by internal data. II: non-local internal data and generic linearized uniqueness

KAUST Repository

Kuchment, Peter

2015-05-10

© 2015, Springer Basel. In the previous paper (Kuchment and Steinhauer in Inverse Probl 28(8):084007, 2012), the authors introduced a simple procedure that allows one to detect whether and explain why internal information arising in several novel coupled physics (hybrid) imaging modalities could turn extremely unstable techniques, such as optical tomography or electrical impedance tomography, into stable, good-resolution procedures. It was shown that in all cases of interest, the Fréchet derivative of the forward mapping is a pseudo-differential operator with an explicitly computable principal symbol. If one can set up the imaging procedure in such a way that the symbol is elliptic, this would indicate that the problem was stabilized. In the cases when the symbol is not elliptic, the technique suggests how to change the procedure (e.g., by adding extra measurements) to achieve ellipticity. In this article, we consider the situation arising in acousto-optical tomography (also called ultrasound modulated optical tomography), where the internal data available involves the Green’s function, and thus depends globally on the unknown parameter(s) of the equation and its solution. It is shown that the technique of (Kuchment and Steinhauer in Inverse Probl 28(8):084007, 2012) can be successfully adopted to this situation as well. A significant part of the article is devoted to results on generic uniqueness for the linearized problem in a variety of situations, including those arising in acousto-electric and quantitative photoacoustic tomography.

20. Effects of different irrigation methods and plant densities on silage quality parameters of PR 31Y43 hybrid corn cultivar (Zea mays L. var. indentata [Sturtev.] L.H. Bailey

Directory of Open Access Journals (Sweden)

Muhammet Karasahin

2014-03-01

Full Text Available The yield and quality of corn silage is related to genotype as well as factors such as climate, soil conditions, altitude, planting time, plant density, irrigation, and harvesting time. This study was conducted to determine the effects of different irrigation methods (drip, subsoil drip, and subsoil capillary and different plant densities (102 040, 119 040, and 142 850 plant ha-1 on silage quality parameters of PR 31Y43 hybrid corn (Zea mays L. var. indentata [Sturtev.] L.H. Bailey in 2011 and 2012 under ecological conditions in Eskipazar-Karabuk, Turkey. Plant densities were significantly different on fresh ear ratio and plant crude protein (CP yield in both years under study. The highest fresh ear ratio values were obtained with 102 040 and 119 040 plant ha-1 densities and the highest plant CP yield with 142 850 plant ha-1. While the irrigation method x plant density interactions were significant for silage CP ratio in the first year, they were significant on fresh ear ratio in the second year. The highest fresh ear ratio values were obtained from subsoil capillary x 119 040 plant ha-1 and drip x 119 040 plant ha-1 interactions; the highest plant and silage CP ratio values were obtained from subsoil capillary x 142 850 plant ha-1 and subsoil drip x 102 040 plant ha-1 interactions. As a result of the research, high Flieg scores were obtained from each irrigation method and plant density. When plant CP yield is taken into consideration, the 142 850 plant ha-1 density is more important.

1. Frequency and zero-point vibrational energy scale factors for double-hybrid density functionals (and other selected methods): can anharmonic force fields be avoided?

Science.gov (United States)

Kesharwani, Manoj K; Brauer, Brina; Martin, Jan M L

2015-03-05

We have obtained uniform frequency scaling factors λ(harm) (for harmonic frequencies), λ(fund) (for fundamentals), and λ(ZPVE) (for zero-point vibrational energies (ZPVEs)) for the Weigend-Ahlrichs and other selected basis sets for MP2, SCS-MP2, and a variety of DFT functionals including double hybrids. For selected levels of theory, we have also obtained scaling factors for true anharmonic fundamentals and ZPVEs obtained from quartic force fields. For harmonic frequencies, the double hybrids B2PLYP, B2GP-PLYP, and DSD-PBEP86 clearly yield the best performance at RMSD = 10-12 cm(-1) for def2-TZVP and larger basis sets, compared to 5 cm(-1) at the CCSD(T) basis set limit. For ZPVEs, again, the double hybrids are the best performers, reaching root-mean-square deviations (RMSDs) as low as 0.05 kcal/mol, but even mainstream functionals like B3LYP can get down to 0.10 kcal/mol. Explicitly anharmonic ZPVEs only are marginally more accurate. For fundamentals, however, simple uniform scaling is clearly inadequate.

2. Resposta de híbridos de milho irrigado à densidade de plantas em três épocas de semeadura Response of irrigated corn hybrids to plant density in three sowing dates

Directory of Open Access Journals (Sweden)

Paulo Regis Ferreira da Silva

1999-04-01

3. Non local-thermodynamical-equilibrium effects in the simulation of laser-produced plasmas

Science.gov (United States)

Klapisch, M.; Bar-Shalom, A.; Oreg, J.; Colombant, D.

1998-05-01

Local thermodynamic equilibrium (LTE) breaks down in directly or indirectly driven laser plasmas because of sharp gradients, energy deposition, etc. For modeling non-LTE effects in hydrodynamical simulations, Busquet's model [Phys. Fluids B 5, 4191 (1993)] is very convenient and efficient. It uses off-line generated LTE opacities and equation of states via an effective, radiation-dependent ionization temperature Tz. An overview of the model is given. The results are compared with an elaborate collisional radiative model based on superconfigurations. The agreements for average charge Z* and opacities are surprisingly good, even more so when the plasma is immersed in a radiation field. Some remaining discrepancy at low density is attributed to dielectronic recombination. Improvement appears possible, especially for emissivities, because the concept of ionization temperature seems to be validated.

4. Non local-thermodynamical-equilibrium effects in the simulation of laser-produced plasmas

International Nuclear Information System (INIS)

Klapisch, M.; Bar-Shalom, A.; Oreg, J.; Colombant, D.

1998-01-01

Local thermodynamic equilibrium (LTE) breaks down in directly or indirectly driven laser plasmas because of sharp gradients, energy deposition, etc. For modeling non-LTE effects in hydrodynamical simulations, Busquet close-quote s model [Phys. Fluids B 5, 4191 (1993)] is very convenient and efficient. It uses off-line generated LTE opacities and equation of states via an effective, radiation-dependent ionization temperature T z . An overview of the model is given. The results are compared with an elaborate collisional radiative model based on superconfigurations. The agreements for average charge Z * and opacities are surprisingly good, even more so when the plasma is immersed in a radiation field. Some remaining discrepancy at low density is attributed to dielectronic recombination. Improvement appears possible, especially for emissivities, because the concept of ionization temperature seems to be validated. copyright 1998 American Institute of Physics

5. Structure factor of blends of solvent-free nanoparticle–organic hybrid materials: density-functional theory and small angle X-ray scattering

KAUST Repository

Yu, Hsiu-Yu; Srivastava, Samanvaya; Archer, Lynden A.; Koch, Donald L.

2014-01-01

. The experimental systems studied include pure samples with different silica core volume fractions and the associated mean corona grafting densities, and blends with different mixing ratios of the pure samples, in order to introduce varying polydispersity of corona

6. A Non-local Model for Transient Moisture Flow in Unsaturated Soils Based on the Peridynamic Theory

Science.gov (United States)

Jabakhanji, R.; Mohtar, R. H.

2012-12-01

A non-local, gradient free, formulation of the porous media flow problem in unsaturated soils was derived. It parallels the peridynamic theory, a non-local reformulation of solid mechanics presented by Silling. In the proposed model, the evolution of the state of a material point is driven by pairwise interactions with other points across finite distances. Flow and changes in moisture are the result of these interactions. Instead of featuring local gradients, the proposed model expresses the flow as a functional integral of the hydraulic potential field. The absence of spatial gradients, undefined at or on discontinuities, makes the model a good candidate for flow simulations in fractured soils. It also lends itself to coupling with peridynamic mechanical models for simulating crack formation triggered by shrinkage and swelling, and assessing their potential impact on a wide range of processes, such as infiltration, contaminant transport, slope stability and integrity of clay barriers. A description of the concept and an outline of the derivation and numerical implementation are presented. Simulation results of infiltration and drainage for 1D, single and two-layers soil columns, for three different soil types are also presented. The same simulations are repeated using HYDRUS-1D, a computer model using the classic local flow equation. We show that the proposed non-local formulation successfully reproduces the results from HYDRUS-1D. S.A. Silling, "Reformulation of Elasticity Theory for Discontinuities and Long-range Forces," Journal of the Mechanics and Physics of Solids 48, no. 1 (January 2000): 175-209. J. Simunek, M. Sejna, and M.T. Van Genuchten, "The HYDRUS-1D Software Package for Simulating the One-dimensional Movement of Water, Heat, and Multiple Solutes in Variably-saturated Media," University of California, Riverside, Research Reports 240 (2005).

7. Fusion-fission hybrid reactors

International Nuclear Information System (INIS)

Greenspan, E.

1984-01-01

This chapter discusses the range of characteristics attainable from hybrid reactor blankets; blanket design considerations; hybrid reactor designs; alternative fuel hybrid reactors; multi-purpose hybrid reactors; and hybrid reactors and the energy economy. Hybrid reactors are driven by a fusion neutron source and include fertile and/or fissile material. The fusion component provides a copious source of fusion neutrons which interact with a subcritical fission component located adjacent to the plasma or pellet chamber. Fissile fuel and/or energy are the main products of hybrid reactors. Topics include high F/M blankets, the fissile (and tritium) breeding ratio, effects of composition on blanket properties, geometrical considerations, power density and first wall loading, variations of blanket properties with irradiation, thermal-hydraulic and mechanical design considerations, safety considerations, tokamak hybrid reactors, tandem-mirror hybrid reactors, inertial confinement hybrid reactors, fusion neutron sources, fissile-fuel and energy production ability, simultaneous production of combustible and fissile fuels, fusion reactors for waste transmutation and fissile breeding, nuclear pumped laser hybrid reactors, Hybrid Fuel Factories (HFFs), and scenarios for hybrid contribution. The appendix offers hybrid reactor fundamentals. Numerous references are provided

8. Influence of large local and non-local bispectra on primordial black hole abundance

International Nuclear Information System (INIS)

Young, Sam; Regan, Donough; Byrnes, Christian T.

2016-01-01

Primordial black holes represent a unique probe to constrain the early universe on small scales—providing the only constraints on the primordial power spectrum on the majority of scales. However, these constraints are strongly dependent on even small amounts of non-Gaussianity, which is unconstrained on scales significantly smaller than those visible in the CMB. This paper goes beyond previous considerations to consider the effects of a bispectrum of the equilateral, orthogonal and local shapes with arbitrary magnitude upon the abundance of primordial black holes. Non-Gaussian density maps of the early universe are generated from a given bispectrum and used to place constraints on the small scale power spectrum. When small, we show that the skewness provides an accurate estimate for how the constraint depends on non-Gaussianity, independently of the shape of the bispectrum. We show that the orthogonal template of non-Gaussianity has an order of magnitude weaker effect on the constraints than the local and equilateral templates

9. Locality or non-locality in quantum mechanics: hidden variables without ''spooky action-at-a-distance''

International Nuclear Information System (INIS)

Aharonov, Y.; Scully, M.

2001-01-01

The folklore notion of the ''Non-Locality of Quantum Mechanics'' is examined from the point of view of hidden-variables theories according to Belinfante's classification in his Survey of Hidden Variables Theories. It is here shown that in the case of EPR, there exist hidden variables theories that successfully reproduce quantum-mechanical predictions, but which are explicitly local. Since such theories do not fall into Belinfante's classification, we propose an expanded classification which includes similar theories, which we term as theories of the ''third'' kind. Causal implications of such theories are explored. (orig.)

10. On the structure on non-local conservation laws in the two-dimensional non-linear sigma-model

International Nuclear Information System (INIS)

Zamolodchikov, Al.B.

1978-01-01

The non-local conserved charges are supposed to satisfy a special multiplicative law in the space of asymptotic states of the non-linear sigma-model. This supposition leads to factorization equations for two-particle scattering matrix elements and determines to some extent the action of these charges in the asymptotic space. Their conservation turns out to be consistent with the factorized S-matrix of the non-linear sigma-model. It is shown also that the factorized sine-Gordon S-matrix is consistent with a similar family of conservation laws

11. Do EPR-Bell correlations require a non-local interpretation of quantum mechanics? I: Wigner approach

International Nuclear Information System (INIS)

Scully, Marlan O.; Erez, Noam; Fry, Edward S.

2005-01-01

Bell inequality experiments teach us that, to explain the data, a hidden variable theory must be non-local. But, to also apply this conclusion to quantum mechanics is unjustified. The key assumptions required to obtain a Bell inequality are (1) locality and (2) the assignment of meaningful (non-negative) probabilities to seemingly physical correlations (Bell expresses these correlations via 'hidden variables'). Since the Bell inequality is violated by experiment, at least one of these assumptions is wrong. The widespread conclusion that locality must be relinquished is unwarranted; rather, the previously mentioned correlations are not physical observables-they are not elements of physical reality

12. The effects of relativistic and non-local non-linearities on modulational instabilities in non-uniform plasma

International Nuclear Information System (INIS)

Mohamed, B.F.; El-Shorbagy, Kh.H.

2000-01-01

A general detailed analysis for the nonlinear generation of localized fields due to the existence of a strong pump field inside the non-uniform plasma has been considered. We have taken into account the effects of relativistic and non-local nonlinearities on the structure of plasma resonance region. The nonlinear Schrodinger equation described the localized fields are investigated. Besides, the generalized dispersion relation is obtained to study the modulational instabilities in different cases. Keywords: Wave-plasma interaction, Nonlinear effects, Modulation instabilities

13. Four-cluster chimera state in non-locally coupled phase oscillator systems with an external potential

International Nuclear Information System (INIS)

Zhu Yun; Zheng Zhi-Gang; Yang Jun-Zhong

2013-01-01

Dynamics of a one-dimensional array of non-locally coupled Kuramoto phase oscillators with an external potential is studied. A four-cluster chimera state is observed for the moderate strength of the external potential. Different from the clustered chimera states studied before, the instantaneous frequencies of the oscillators in a synchronized cluster are different in the presence of the external potential. As the strength of the external potential increases, a bifurcation from the two-cluster chimera state to the four-cluster chimera states can be found. These phenomena are well predicted analytically with the help of the Ott—Antonsen ansatz. (general)

14. The imaginary part of the local potential equivalent to the non-local α-nucleus optical potential

International Nuclear Information System (INIS)

Lassaut, M.; Vinh Mau, N.

1982-01-01

A simple expression of the α-nucleus optical potential has been derived from the Feshbach formula by using a closure approximation for summing over the excited states of the target nucleus. It has been shown that the correction to the real folding model potential is small. The imaginary local potential equivalent to the non-local Feshbach potential has been studied in detail for Ca nuclei and shown to reproduce quite well the gross properties of empirical potentials above 100 MeV with, however, a lack of absorption in the surface region. The A-dependence of the imaginary potential volume integral has also been investigated. (orig.)

15. Non-Local Thermodynamic Equilibrium Spectrum Synthesis of Type IA Supernovae

Science.gov (United States)

Nugent, Peter Edward

1997-09-01

Type Ia supernovae (SNe Ia) are valuable distance indicators for cosmology and the elements they eject are are important for nucleosynthesis. They appear to be thermonuclear disruptions of carbon-oxygen white dwarfs that accrete from companion stars until they approach the Chandrasekbar mass, and there is a suspicion that the propagation of the nuclear burning front involves a transition from a deflagration to a detonation. Detailed modeling of the atmospheres and spectra of SNe Ia is needed to advance our understanding of SNe Ia. Comparison of synthetic and observed spectra provides information on the temperature, density, velocity, and composition of the ejected matter and thus constrain hydrodynamical models. In addition, the expanding photosphere method yields distances to individual events that are independent of distances based on the decay of 56Ni in SNe Ia and of Cepheid variable stars in the parent galaxies. This thesis is broken down into 4 major sections, each highlighting a different way with which to use spectrum synthesis to analyze SNe Ia. Chapters 2 and 3 look at normal SNe Ia and their potential use as distance indicators using SEAM. Chapter 4 examines spectral correlations with luminosity in SNe Ia and provides a plausible explanation for these correlations via spectrum synthesis. In Chapter 5 the spectra of various hydrodynamical models are calculated in an effort to answer the question of which current progenitor/explosion model is the most plausible for a SN Ia. Finally, we look at the importance of NLTE calculations and line identifications in Chapter 6. Also included are two appendices which contain more technical information concerning γ-ray deposition and the thermalization parameter.

16. On the dynamics of a non-local parabolic equation arising from the Gierer-Meinhardt system

Science.gov (United States)

Kavallaris, Nikos I.; Suzuki, Takashi

2017-05-01

The purpose of the current paper is to contribute to the comprehension of the dynamics of the shadow system of an activator-inhibitor system known as a Gierer-Meinhardt model. Shadow systems are intended to work as an intermediate step between single equations and reaction-diffusion systems. In the case where the inhibitor’s response to the activator’s growth is rather weak, then the shadow system of the Gierer-Meinhardt model is reduced to a single though non-local equation whose dynamics will be investigated. We mainly focus on the derivation of blow-up results for this non-local equation which can be seen as instability patterns of the shadow system. In particular, a diffusion driven instability (DDI), or Turing instability, in the neighbourhood of a constant stationary solution, which it is destabilised via diffusion-driven blow-up, is obtained. The latter actually indicates the formation of some unstable patterns, whilst some stability results of global-in-time solutions towards non-constant steady states guarantee the occurrence of some stable patterns.

17. Perspectives on the Direction of the Suncheon Bay National Garden from Local Residents and Non-Local Visitors

Directory of Open Access Journals (Sweden)

Moohan Kim

2017-10-01

Full Text Available As Korea’s first national garden, the Suncheon Bay National Garden is a major tourist attraction and a space of enjoyment for visitors. However, in 2016 its sudden establishment necessitates many discussions and measures, and requires that it seek direction based on current perceptions for its continued use in the future. This study begins a search for that direction by examining perspectives of local residents and non-local visitors on the relationships between visitors’ purposes, spatial needs, and required features. The research methodology included a survey administered to Suncheon residents and tourists on these factors. Results were analyzed by multiple correlation analysis and networking between the variables, and differences between Suncheon residents and non-local visitors were deduced; relationships among the factors were also verified. Both locals and visitors saw a need to emphasize garden experiences and education. The study also presents items that differ by respondent group. This study provides information that can be referred to when implementing management and plans for other national gardens.

18. Instantaneous equations for multiphase flow in porous media without length-scale restrictions using a non-local averaging volume

International Nuclear Information System (INIS)

Espinosa-Paredes, Gilberto

2010-01-01

The aim of this paper is to propose a framework to obtain a new formulation for multiphase flow conservation equations without length-scale restrictions, based on the non-local form of the averaged volume conservation equations. The simplification of the local averaging volume of the conservation equations to obtain practical equations is subject to the following length-scale restrictions: d << l << L, where d is the characteristic length of the dispersed phases, l is the characteristic length of the averaging volume, and L is the characteristic length of the physical system. If the foregoing inequality does not hold, or if the scale of the problem of interest is of the order of l, the averaging technique and therefore, the macroscopic theories of multiphase flow should be modified in order to include appropriate considerations and terms in the corresponding equations. In these cases the local form of the averaged volume conservation equations are not appropriate to describe the multiphase system. As an example of the conservation equations without length-scale restrictions, the natural circulation boiling water reactor was consider to study the non-local effects on the thermal-hydraulic core performance during steady-state and transient behaviors, and the results were compared with the classic local averaging volume conservation equations.

19. The Robin Hood method - A novel numerical method for electrostatic problems based on a non-local charge transfer

International Nuclear Information System (INIS)

Lazic, Predrag; Stefancic, Hrvoje; Abraham, Hrvoje

2006-01-01

We introduce a novel numerical method, named the Robin Hood method, of solving electrostatic problems. The approach of the method is closest to the boundary element methods, although significant conceptual differences exist with respect to this class of methods. The method achieves equipotentiality of conducting surfaces by iterative non-local charge transfer. For each of the conducting surfaces, non-local charge transfers are performed between surface elements, which differ the most from the targeted equipotentiality of the surface. The method is tested against analytical solutions and its wide range of application is demonstrated. The method has appealing technical characteristics. For the problem with N surface elements, the computational complexity of the method essentially scales with N α , where α < 2, the required computer memory scales with N, while the error of the potential decreases exponentially with the number of iterations for many orders of magnitude of the error, without the presence of the Critical Slowing Down. The Robin Hood method could prove useful in other classical or even quantum problems. Some future development ideas for possible applications outside electrostatics are addressed

20. Hybrid Bloch brane

Energy Technology Data Exchange (ETDEWEB)

Bazeia, D.; Lima, Elisama E.M.; Losano, L. [Universidade Federal da Paraiba, Departamento de Fisica, Joao Pessoa, PB (Brazil)

2017-02-15

This work reports on models described by two real scalar fields coupled with gravity in the five-dimensional spacetime, with a warped geometry involving one infinite extra dimension. Through a mechanism that smoothly changes a thick brane into a hybrid brane, one investigates the appearance of hybrid branes hosting internal structure, characterized by the splitting on the energy density and the volcano potential, induced by the parameter which controls interactions between the two scalar fields. In particular, we investigate distinct symmetric and asymmetric hybrid brane scenarios. (orig.)

1. An analysis of the gradient-induced electric fields and current densities in human models when situated in a hybrid MRI-LINAC system

International Nuclear Information System (INIS)

Liu, Limei; Trakic, Adnan; Sanchez-Lopez, Hector; Liu, Feng; Crozier, Stuart

2014-01-01

MRI-LINAC is a new image-guided radiotherapy treatment system that combines magnetic resonance imaging (MRI) with a linear accelerator (LINAC) in a single unit. One drawback is that the pulsing of the split gradient coils of the system induces an electric field and currents in the patient which need to be predicted and evaluated for patient safety. In this novel numerical study the in situ electric fields and associated current densities were evaluated inside tissue-accurate male and female human voxel models when a number of different split-geometry gradient coils were operated. The body models were located in the MRI-LINAC system along the axial and radial directions in three different body positions. Each model had a region of interest (ROI) suitable for image-guided radiotherapy. The simulation results show that the amplitudes and distributions of the field and current density induced by different split x-gradient coils were similar with one another in the ROI of the body model, but varied outside of the region. The fields and current densities induced by a split classic coil with the surface unconnected showed the largest deviation from those given by the conventional non-split coils. Another finding indicated that the distributions of the peak current densities varied when the body position, orientation or gender changed, while the peak electric fields mainly occurred in the skin and fat tissues. (paper)

2. A novel probe density controllable electrochemiluminescence biosensor for ultra-sensitive detection of Hg2+ based on DNA hybridization optimization with gold nanoparticles array patterned self-assembly platform.

Science.gov (United States)

Gao, Wenhua; Zhang, An; Chen, Yunsheng; Chen, Zixuan; Chen, Yaowen; Lu, Fushen; Chen, Zhanguang

2013-11-15

Biosensor based on DNA hybridization holds great potential to get higher sensitivity as the optimal DNA hybridization efficiency can be achieved by controlling the distribution and orientation of probe strands on the transducer surface. In this work, an innovative strategy is reported to tap the sensitivity potential of current electrochemiluminescence (ECL) biosensing system by dispersedly anchoring the DNA beacons on the gold nanoparticles (GNPs) array which was electrodeposited on the glassy carbon electrode surface, rather than simply sprawling the coil-like strands onto planar gold surface. The strategy was developed by designing a "signal-on" ECL biosensing switch fabricated on the GNPs nanopatterned electrode surface for enhanced ultra-sensitivity detection of Hg(2+). A 57-mer hairpin-DNA labeled with ferrocene as ECL quencher and a 13-mer DNA labeled with Ru(bpy)3(2+) as reporter were hybridized to construct the signal generator in off-state. A 31-mer thymine (T)-rich capture-DNA was introduced to form T-T mismatches with the loop sequence of the hairpin-DNA in the presence of Hg(2+) and induce the stem-loop open, meanwhile the ECL "signal-on" was triggered. The peak sensitivity with the lowest detection limit of 0.1 nM was achieved with the optimal GNPs number density while exorbitant GNPs deposition resulted in sensitivity deterioration for the biosensor. We expect the present strategy could lead the renovation of the existing probe-immobilized ECL genosensor design to get an even higher sensitivity in ultralow level of target detection such as the identification of genetic diseases and disorders in basic research and clinical application. Copyright © 2013 Elsevier B.V. All rights reserved.

3. Hybridization analysis of P2 phage and of a defective prophage of Escherichia Coli B by the density gradient centrifugation method; Analyse de l'hybridation du phage P2 et d'un prophage defectifs d'Escherichia Coli B, par la methode de centrifugation en gradient de densite

Energy Technology Data Exchange (ETDEWEB)

Cohen, Denise [Commissariat a l' energie atomique et aux energies alternatives - CEA, C. E. N. de Saclay, Service de Biologie (France)

1960-07-01

The P2 Hydis phage produced by P2 phage multiplication in E. coli B shows a higher density than its P2 parent. This density increase is the same for all P2 Hydis coming from a huge number of distinct hybridizations. It is closed to 0.002 g.cm{sup -3}. Reprint of a paper published in Comptes rendus des seances de l'Academie des Sciences, t. 250, p. 946-948, sitting of 1 February 1960 [French] Le phage P2 Hydis, produit lors de la multiplication du phage P2 dans E. Coli B, presente une densite superieure a celle de son parent P2. Cette augmentation de densite est la meme pour tous les P2 Hydis issus d'un grand nombre d'hybridations distinctes. Elle est voisine de 0,002 g.cm{sup -3}. Reproduction d'un article publie dans les Comptes rendus des seances de l'Academie des Sciences, t. 250, p. 946-948, seance du 1er fevrier 1960.

4. Probing the quantum correlation and Bell non-locality for Dirac particles with Hawking effect in the background of Schwarzschild black hole

International Nuclear Information System (INIS)

Xu, Shuai; Song, Xue-ke; Shi, Jia-dong; Ye, Liu

2014-01-01

In this Letter, we analytically explore the effect of the Hawking radiation on the quantum correlation and Bell non-locality for Dirac particles in the background of Schwarzschild black hole. It is shown that when the Hawking effect is almost nonexistent, corresponding to the case of an almost extreme black hole, the quantum properties of physically accessible state are the same for the initial situation. For finite Hawking temperature T, the accessible quantum correlation monotonously decreases along with increasing T owing to the thermal fields generated by the Hawking effect, and the accessible quantum non-locality will be disappeared when the Hawking temperature is more than a fixed value which increases with the parameter r of Werner state growing. Then we analyze the redistribution of quantum correlation, and find that for the case of the Hawking temperature being infinite, corresponding to the case of the black hole evaporating completely, the quantum correlation of physically accessible state is equal to the one of the inaccessible states. Moreover, due to the Pauli exclusion principle and the differences between Fermi–Dirac and Bose–Einstein statistics, for the Dirac fields the accessible classical correlation decreases with increase of the Hawking temperature, which is different for the scalar fields. For Bell non-locality, we also find that the quantum non-locality is always extinct for physically inaccessible states, and the strength of the non-locality decreases with enlarging intensity of Hawking effect when the non-locality is existent in physically accessible state.

5. PLANT DENSITY AND AGRONOMIC TRAITS OF MAIZE HYBRIDS IN NARROW ROW SPACING DENSIDADE DE PLANTAS E CARACTERÍSTICAS AGRONÔMICAS DE HÍBRIDOS DE MILHO SOB ESPAÇAMENTO REDUZIDO ENTRE LINHAS

Directory of Open Access Journals (Sweden)

Cleber Morais Guimarães

2007-09-01

Full Text Available

The objective of this study was to evaluate the behavior of maize hybrids cultivated under different population densities in narrow row spacing (0.45 m. Two field experiments were installed to evaluate six commercial hybrids (A 2555, A 2288, AG 9010, AG 6690, P 30F88 and Valent grown in five plant densities (40,000; 53,000; 71,000; 84,000; and 97,000 plants per hectare, in Goiânia and Jataí, Goiás State, during the growing season of 2002/2003. The experimental design was a randomized complete blocks, arranged in a 6x5 factorial design with four replicates. In the Goiânia experiment, the treatments were carried out using a split plot design. In the experiment of Goiânia, the treatments were carried out using a split plot design. The means of ear insertion, plant height, stalk lodging, ear length, ear diameter, corncob diameter, kernels per ear, weight of 100 kernels and grain yield was significantly influenced by plant density in both experiments. Grain yield was increased for plant densities higher than 70,000 plants per hectare, indicating that the use of narrow row spacing associated to the presence of shorter plant stature hybrids, favors enhancements in plant density. The grain yield was significantly affected by the interaction between hybrid and plant density in both fields. This indicates that, depending of the hybrid, the reduction of row spacing to 0.45 m is a managing practice that allows an increment in the sowing density.

KEY-WORDS: Zea mays; cultivar; plant arrangement; agronomic trait; grain yield.

O objetivo deste trabalho foi avaliar o comportamento de híbridos de milho (A 2555, A 2288, AG 9010, AG 6690, P 30F88 e Valent, cultivados em diferentes densidades populacionais (40 mil, 53 mil, 71 mil, 84 mil e 97 mil plantas por hectare e sob espaçamento reduzido

6. N = 2 local and N = 4 non-local reductions of supersymmetric KP hierarchy in N = 2 superspace

International Nuclear Information System (INIS)

Delduc, F.; Gallot, L.; Sorin, A.

1999-01-01

An N = 4 supersymmetric matrix KP hierarchy is proposed and a wide class of its reductions which are characterized by a finite number of fields are described. This class includes the one-dimensional reduction of the two-dimensional N = (2,2) superconformal Toda lattice hierarchy possessing the N = 4 supersymmetry -- the N = 4 Toda chain hierarchy - which may be relevant in the construction of supersymmetric matrix models. The Lax-pair representations of the bosonic and fermionic flows, corresponding local and non-local Hamiltonians, finite and infinite discrete symmetries, the first two Hamiltonian structures and the recursion operator connecting all evolution equations and the Hamiltonian structures of the N = 4 Toda chain hierarchy are constructed in explicit form. Is secondary reduction to the N 4 supersymmetric α = - 2 KdV hierarchy is

7. New numerical approximation of fractional derivative with non-local and non-singular kernel: Application to chaotic models

Science.gov (United States)

Toufik, Mekkaoui; Atangana, Abdon

2017-10-01

Recently a new concept of fractional differentiation with non-local and non-singular kernel was introduced in order to extend the limitations of the conventional Riemann-Liouville and Caputo fractional derivatives. A new numerical scheme has been developed, in this paper, for the newly established fractional differentiation. We present in general the error analysis. The new numerical scheme was applied to solve linear and non-linear fractional differential equations. We do not need a predictor-corrector to have an efficient algorithm, in this method. The comparison of approximate and exact solutions leaves no doubt believing that, the new numerical scheme is very efficient and converges toward exact solution very rapidly.

8. Disorder in materials with complex crystal structures: the Non-Local Coherent Potential Approximation for compounds with multiple sublattices

International Nuclear Information System (INIS)

Marmodoro, A; Staunton, J B

2011-01-01

Over the last few years the Non-Local Coherent Potential Approximation (NL-CPA) has been shown to provide an effective way to describe the electronic structure and related properties of disordered systems, where short-range order (SRO) and other local environment effects are important. Here we present its generalization to materials with multi-atom per unit cell lattices. The method is described using a Green function formalism and illustrated by an implementation for a simplified one-dimensional tight-binding model with substitutional disorder. This development paves the way for a natural reimplementation of the Korringa-Kohn-Rostoker (KKR) multiple scattering solution of Kohn-Sham equations for ab-initio calculations of real materials.

9. An assessment of pure, hybrid, meta, and hybrid-meta GGA density functional theory methods for open-shell systems: the case of the nonheme iron enzyme 8R-LOX.

Science.gov (United States)

Bushnell, Eric A C; Gauld, James W

2013-01-15

The performance of a range density functional theory functionals combined in a quantum mechanical (QM)/molecular mechanical (MM) approach was investigated in their ability to reliably provide geometries, electronic distributions, and relative energies of a multicentered open-shell mechanistic intermediate in the mechanism 8R-Lipoxygenase. With the use of large QM/MM active site chemical models, the smallest average differences in geometries between the catalytically relevant quartet and sextet complexes were obtained with the B3LYP(*) functional. Moreover, in the case of the relative energies between (4) II and (6) II, the use of the B3LYP(*) functional provided a difference of 0.0 kcal mol(-1). However, B3LYP(±) and B3LYP also predicted differences in energies of less than 1 kcal mol(-1). In the case of describing the electronic distribution (i.e., spin density), the B3LYP(*), B3LYP, or M06-L functionals appeared to be the most suitable. Overall, the results obtained suggest that for systems with multiple centers having unpaired electrons, the B3LYP(*) appears most well rounded to provide reliable geometries, electronic structures, and relative energies. Copyright © 2012 Wiley Periodicals, Inc.

10. Non-locality and memory effects in grain dynamics on a 2D dusty plasma quasi-crystal

International Nuclear Information System (INIS)

Ratynskaia, S.; Rypdal, K.; Milovanov, A.; Rasmussen, J. J.; Knapek, C.; Morfill, G.

2005-01-01

By tuning RF-power and neutral gas pressure as control parameters in a dust plasma crystal experiment it is possible to obtain a state exhibiting rather high mobility of the dust grains through development of defects, yet maintaining the global hexagonal structure. The state exhibits higher mobility and smaller vertical structures along the rim and larger and more slowly moving and rotating crystalline domains in the core. It is different from the critical transition between the crystalline and liquid state. Trajectories of all particles in a cluster consisting of about 700 dust grains are tracked through 30.000 frames (time-steps). During this time the length of a grain trajectory is typically considerably greater than the linear size of the cluster. Variogram and rescaled range (R/S) analysis of time series of particle positions reveal super-diffusive behavior which, from a stochastic process viewpoint, often is ascribed to either long memory effects or to the presence of non-locality manifested as Levy flights giving rise to heavy algebraic tails in the position increment probability distribution function (PDF). The experimental PDF is non-gaussian, but the tails are not algebraic. The core of the PDF, however, has the shape of a truncated Levy distribution, which is shown to be stretched exponential of width that expands in time in a super-diffusive manner. Thus, super-diffusion could in principle occur without long-range time dependence in the increment time series and without algebraic tails in the PDF. Analysis of the core PDF and PDFs on different level of coarse gaining of the time series, combined with variogram and R/S analysis techniques, are employed to disentangle memory and non-locality effects. The results are discussed and interpreted in the framework of a fractional kinetics approach. (Author)

11. Experimental benchmark of non-local-thermodynamic-equilibrium plasma atomic physics codes; Validation experimentale des codes de physique atomique des plasmas hors equilibre thermodynamique local

Energy Technology Data Exchange (ETDEWEB)

Nagels-Silvert, V

2004-09-15

The main purpose of this thesis is to get experimental data for the testing and validation of atomic physics codes dealing with non-local-thermodynamical-equilibrium plasmas. The first part is dedicated to the spectroscopic study of xenon and krypton plasmas that have been produced by a nanosecond laser pulse interacting with a gas jet. A Thomson scattering diagnostic has allowed us to measure independently plasma parameters such as electron temperature, electron density and the average ionisation state. We have obtained time integrated spectra in the range between 5 and 10 angstroms. We have identified about one hundred xenon rays between 8.6 and 9.6 angstroms via the use of the Relac code. We have discovered unknown rays for the krypton between 5.2 and 7.5 angstroms. In a second experiment we have extended the wavelength range to the X UV domain. The Averroes/Transpec code has been tested in the ranges from 9 to 15 angstroms and from 10 to 130 angstroms, the first range has been well reproduced while the second range requires a more complex data analysis. The second part is dedicated to the spectroscopic study of aluminium, selenium and samarium plasmas in femtosecond operating rate. We have designed an interferometry diagnostic in the frequency domain that has allowed us to measure the expanding speed of the target's backside. Via the use of an adequate isothermal model this parameter has led us to know the plasma electron temperature. Spectra and emission times of various rays from the aluminium and selenium plasmas have been computed satisfactorily with the Averroes/Transpec code coupled with Film and Multif hydrodynamical codes. (A.C.)

12. Experimental benchmark of non-local-thermodynamic-equilibrium plasma atomic physics codes; Validation experimentale des codes de physique atomique des plasmas hors equilibre thermodynamique local

Energy Technology Data Exchange (ETDEWEB)

Nagels-Silvert, V

2004-09-15

The main purpose of this thesis is to get experimental data for the testing and validation of atomic physics codes dealing with non-local-thermodynamical-equilibrium plasmas. The first part is dedicated to the spectroscopic study of xenon and krypton plasmas that have been produced by a nanosecond laser pulse interacting with a gas jet. A Thomson scattering diagnostic has allowed us to measure independently plasma parameters such as electron temperature, electron density and the average ionisation state. We have obtained time integrated spectra in the range between 5 and 10 angstroms. We have identified about one hundred xenon rays between 8.6 and 9.6 angstroms via the use of the Relac code. We have discovered unknown rays for the krypton between 5.2 and 7.5 angstroms. In a second experiment we have extended the wavelength range to the X UV domain. The Averroes/Transpec code has been tested in the ranges from 9 to 15 angstroms and from 10 to 130 angstroms, the first range has been well reproduced while the second range requires a more complex data analysis. The second part is dedicated to the spectroscopic study of aluminium, selenium and samarium plasmas in femtosecond operating rate. We have designed an interferometry diagnostic in the frequency domain that has allowed us to measure the expanding speed of the target's backside. Via the use of an adequate isothermal model this parameter has led us to know the plasma electron temperature. Spectra and emission times of various rays from the aluminium and selenium plasmas have been computed satisfactorily with the Averroes/Transpec code coupled with Film and Multif hydrodynamical codes. (A.C.)

13. Non-local exchange correlation functionals impact on the structural, electronic and optical properties of III-V arsenides

KAUST Repository

Anua, N. Najwa; Ahmed, Rashid; Shaari, Amiruddin; Saeed, Mohammad Alam; Ul Haq, Bakhtiar; Goumri-Said, Souraya

2013-01-01

our electronic bandstructure calculations at the level of mBJ-LDA potential show considerable improvements over the other XC functionals, even the sX-LDA hybrid functional. We report also the optical properties within mBJ potential, which show a nice

14. Improving Signal-to-Noise Ratio in Susceptibility Weighted Imaging: A Novel Multicomponent Non-Local Approach.

Directory of Open Access Journals (Sweden)

Pasquale Borrelli

Full Text Available In susceptibility-weighted imaging (SWI, the high resolution required to obtain a proper contrast generation leads to a reduced signal-to-noise ratio (SNR. The application of a denoising filter to produce images with higher SNR and still preserve small structures from excessive blurring is therefore extremely desirable. However, as the distributions of magnitude and phase noise may introduce biases during image restoration, the application of a denoising filter is non-trivial. Taking advantage of the potential multispectral nature of MR images, a multicomponent approach using a Non-Local Means (MNLM denoising filter may perform better than a component-by-component image restoration method. Here we present a new MNLM-based method (Multicomponent-Imaginary-Real-SWI, hereafter MIR-SWI to produce SWI images with high SNR and improved conspicuity. Both qualitative and quantitative comparisons of MIR-SWI with the original SWI scheme and previously proposed SWI restoring pipelines showed that MIR-SWI fared consistently better than the other approaches. Noise removal with MIR-SWI also provided improvement in contrast-to-noise ratio (CNR and vessel conspicuity at higher factors of phase mask multiplications than the one suggested in the literature for SWI vessel imaging. We conclude that a proper handling of noise in the complex MR dataset may lead to improved image quality for SWI data.

15. Atomic adsorption on pristine graphene along the Periodic Table of Elements - From PBE to non-local functionals

Science.gov (United States)

Pašti, Igor A.; Jovanović, Aleksandar; Dobrota, Ana S.; Mentus, Slavko V.; Johansson, Börje; Skorodumova, Natalia V.

2018-04-01

The understanding of atomic adsorption on graphene is of high importance for many advanced technologies. Here we present a complete database of the atomic adsorption energies for the elements of the Periodic Table up to the atomic number 86 (excluding lanthanides) on pristine graphene. The energies have been calculated using the projector augmented wave (PAW) method with PBE, long-range dispersion interaction corrected PBE (PBE+D2, PBE+D3) as well as non-local vdW-DF2 approach. The inclusion of dispersion interactions leads to an exothermic adsorption for all the investigated elements. Dispersion interactions are found to be of particular importance for the adsorption of low atomic weight earth alkaline metals, coinage and s-metals (11th and 12th groups), high atomic weight p-elements and noble gases. We discuss the observed adsorption trends along the groups and rows of the Periodic Table as well some computational aspects of modelling atomic adsorption on graphene.

16. XQ-NLM: Denoising Diffusion MRI Data via x-q Space Non-Local Patch Matching.

Science.gov (United States)

Chen, Geng; Wu, Yafeng; Shen, Dinggang; Yap, Pew-Thian

2016-10-01

Noise is a major issue influencing quantitative analysis in diffusion MRI. The effects of noise can be reduced by repeated acquisitions, but this leads to long acquisition times that can be unrealistic in clinical settings. For this reason, post-acquisition denoising methods have been widely used to improve SNR. Among existing methods, non-local means (NLM) has been shown to produce good image quality with edge preservation. However, currently the application of NLM to diffusion MRI has been mostly focused on the spatial space (i.e., the x -space), despite the fact that diffusion data live in a combined space consisting of the x -space and the q -space (i.e., the space of wavevectors). In this paper, we propose to extend NLM to both x -space and q -space. We show how patch-matching, as required in NLM, can be performed concurrently in x-q space with the help of azimuthal equidistant projection and rotation invariant features. Extensive experiments on both synthetic and real data confirm that the proposed x-q space NLM (XQ-NLM) outperforms the classic NLM.

17. Phase structure of the Born-Infeld-anti-de Sitter black holes probed by non-local observables

Energy Technology Data Exchange (ETDEWEB)

Zeng, Xiao-Xiong [Chongqing Jiaotong University, School of Material Science and Engineering, Chongqing (China); Chinese Academy of Sciences, Institute of Theoretical Physics, Beijing (China); Liu, Xian-Ming [Center for Theoretical Physics, Massachusetts Institute of Technology, Cambridge, MA (United States); Hubei University for Nationalities, Center for Theoretical Physics, School of Sciences, Enshi, Hubei (China); Li, Li-Fang [Chinese Academy of Sciences, State Key Laboratory of Space Weather, Center for Space Science and Applied Research, Beijing (China)

2016-11-15

With the non-local observables such as two point correlation function and holographic entanglement entropy, we probe the phase structure of the Born-Infeld-anti-de Sitter black holes. For the case bQ > 0.5, where b is the Born-Infeld parameter and Q is the charge of the black hole, the phase structure is found to be similar to that of the Van der Waals phase transition, namely the black hole undergoes a first order phase transition and a second order phase transition before it reaches a stable phase. While for the case bQ < 0.5, a new phase branch emerges besides the Van der Waals phase transition. For the first order phase transition, the equal area law is checked, and for the second order phase transition, the critical exponent of the heat capacity is obtained. All these results are found to be the same as that observed in the entropy-temperature plane. (orig.)

18. First ERO2.0 modeling of Be erosion and non-local transport in JET ITER-like wall

Science.gov (United States)

Romazanov, J.; Borodin, D.; Kirschner, A.; Brezinsek, S.; Silburn, S.; Huber, A.; Huber, V.; Bufferand, H.; Firdaouss, M.; Brömmel, D.; Steinbusch, B.; Gibbon, P.; Lasa, A.; Borodkina, I.; Eksaeva, A.; Linsmeier, Ch; Contributors, JET

2017-12-01

ERO is a Monte-Carlo code for modeling plasma-wall interaction and 3D plasma impurity transport for applications in fusion research. The code has undergone a significant upgrade (ERO2.0) which allows increasing the simulation volume in order to cover the entire plasma edge of a fusion device, allowing a more self-consistent treatment of impurity transport and comparison with a larger number and variety of experimental diagnostics. In this contribution, the physics-relevant technical innovations of the new code version are described and discussed. The new capabilities of the code are demonstrated by modeling of beryllium (Be) erosion of the main wall during JET limiter discharges. Results for erosion patterns along the limiter surfaces and global Be transport including incident particle distributions are presented. A novel synthetic diagnostic, which mimics experimental wide-angle 2D camera images, is presented and used for validating various aspects of the code, including erosion, magnetic shadowing, non-local impurity transport, and light emission simulation.

19. Image inpainting and super-resolution using non-local recursive deep convolutional network with skip connections

Science.gov (United States)

Liu, Miaofeng

2017-07-01

In recent years, deep convolutional neural networks come into use in image inpainting and super-resolution in many fields. Distinct to most of the former methods requiring to know beforehand the local information for corrupted pixels, we propose a 20-depth fully convolutional network to learn an end-to-end mapping a dataset of damaged/ground truth subimage pairs realizing non-local blind inpainting and super-resolution. As there often exist image with huge corruptions or inpainting on a low-resolution image that the existing approaches unable to perform well, we also share parameters in local area of layers to achieve spatial recursion and enlarge the receptive field. To avoid the difficulty of training this deep neural network, skip-connections between symmetric convolutional layers are designed. Experimental results shows that the proposed method outperforms state-of-the-art methods for diverse corrupting and low-resolution conditions, it works excellently when realizing super-resolution and image inpainting simultaneously

20. A quantum mechanical study of water adsorption on the (110) surfaces of rutile SnO₂ and TiO₂: investigating the effects of intermolecular interactions using hybrid-exchange density functional theory.

Science.gov (United States)

Patel, M; Sanches, F F; Mallia, G; Harrison, N M

2014-10-21

1. Large-N limit of the non-local 2D Yang-Mills and generalized Yang-Mills theories on a cylinder

Energy Technology Data Exchange (ETDEWEB)

Saaidi, K. [Department of Physics, Tehran University (Iran); Khorrami, M. [Institute for Advanced Studies in Basic Sciences, Zanjan (Iran)

2002-04-01

The large-group behavior of the non-local YM{sub 2}'s and gYM{sub 2}'s on a cylinder or a disk is investigated. It is shown that this behavior is similar to that of the corresponding local theory, but with the area of the cylinder replaced by an effective area depending on the dominant representation. The critical areas for non-local YM{sub 2}'s on a cylinder with some special boundary conditions are also obtained. (orig.)

2. Non-local coupled-channels optical calculation of electron scattering by atomic hydrogen at 54.42 eV

International Nuclear Information System (INIS)

Ratnavelu, K.; McCarthy, I.E.

1990-01-01

The present study incorporates the non-local optical potentials for the continuum within the coupled-channels optical framework to study electron scattering from atomic hydrogen at 54.42 eV. Nine-state coupled-channels calculations with non-local and local continuum optical potentials were performed. The results for differential, total and ionization cross sections as well as the 2p angular correlation parameters λ and R are comparable with other non-perturbative calculations. There are still discrepancies between theory and experiment, particularly for λ and R at larger angles. (author)

3. Analysis of Non-binary Hybrid LDPC Codes

OpenAIRE

Sassatelli, Lucile; Declercq, David

2008-01-01

In this paper, we analyse asymptotically a new class of LDPC codes called Non-binary Hybrid LDPC codes, which has been recently introduced. We use density evolution techniques to derive a stability condition for hybrid LDPC codes, and prove their threshold behavior. We study this stability condition to conclude on asymptotic advantages of hybrid LDPC codes compared to their non-hybrid counterparts.

4. Bases morfofisiológicas para maior tolerância dos híbridos modernos de milho a altas densidades de plantas Morpho-physiological bases for greater tolerance of modern maize hybrids to high plant densities

Directory of Open Access Journals (Sweden)

Luís Sangoi

2002-08-01

5. Phase-correcting non-local means filtering for diffusion-weighted imaging of the spinal cord.

Science.gov (United States)

Kafali, Sevgi Gokce; Çukur, Tolga; Saritas, Emine Ulku

2018-02-09

DWI suffers from low SNR when compared to anatomical MRI. To maintain reasonable SNR at relatively high spatial resolution, multiple acquisitions must be averaged. However, subject motion or involuntary physiological motion during diffusion-sensitizing gradients cause phase offsets among acquisitions. When the motion is localized to a small region, these phase offsets become particularly problematic. Complex averaging of acquisitions lead to cancellations from these phase offsets, whereas magnitude averaging results in noise amplification. Here, we propose an improved reconstruction for multi-acquisition DWI that effectively corrects for phase offsets while reducing noise. Each acquisition is processed with a refocusing reconstruction for global phase correction and a partial k-space reconstruction via projection-onto-convex-sets (POCS). The proposed reconstruction then embodies a new phase-correcting non-local means (PC-NLM) filter. PC-NLM is performed on the complex-valued outputs of the POCS algorithm aggregated across acquisitions. The PC-NLM filter leverages the shared structure among multiple acquisitions to simultaneously alleviate nuisance factors including phase offsets and noise. Extensive simulations and in vivo DWI experiments of the cervical spinal cord are presented. The results demonstrate that the proposed reconstruction improves image quality by mitigating signal loss because of phase offsets and reducing noise. Importantly, these improvements are achieved while preserving the accuracy of apparent diffusion coefficient maps. An improved reconstruction incorporating a PC-NLM filter for multi-acquisition DWI is presented. This reconstruction can be particularly beneficial for high-resolution or high-b-value DWI acquisitions that suffer from low SNR and phase offsets from local motion. © 2018 International Society for Magnetic Resonance in Medicine.

6. Tamanho amostral para a estimativa da densidade básica em um clone híbrido de Eucalyptus sp. Sample size for estimating basic density in a clone of Eucalyptus sp. hybrid.

Directory of Open Access Journals (Sweden)

2015-06-01

Eucalyptus grandis hybrid clone, considering different longitudinal sampling and diameter classes. For this, 50 trees were used to hybrid from clone with 5.6 years. The trees were divided into three diameter classes and sampled in the form of discs, three ways: traditional (0%, 25%, 50%, 75% and 100% of the commercial height Hc; alternative (2%, 10%, 30% and 70% Hc and every meter from DAP. There was no difference between the number of trees required to estimate the density of the clone regardless sampling form, assuming an error of 5% and a confidence interval of 95%. Alternative sampling was considered most effective, considering the sample size along the stem and the coefficient of variation. Classification by diameter resulted in a greater number of trees to estimate the average density due to greater property variation within diameter classes than within the sampling method

7. Quantum non-local charges and absence of particle production in the two-dimensional non-linear sigma-model

International Nuclear Information System (INIS)

Luescher, M.

1977-12-01

Conserved non-local charges are shown to exist in the quantum non-linear sigma-model by a non-perturbative method. They imply the absence of particle production and the 'factorization equations' for the two particle S-matrix, which can then be calculated explicitly. (Auth.)

8. Non-local thermodynamic equilibrium stellar spectroscopy with 1D and 3D models - II. Chemical properties of the Galactic metal-poor disk and the halo

DEFF Research Database (Denmark)

Bergemann, Maria; Collet, Remo; Schönrich, Ralph

2016-01-01

We have analysed high-resolution spectra of 328 stars and derived Mg abundances using non-local thermodynamic equilibrium (NLTE) spectral line formation calculations and plane-parallel model stellar atmospheres derived from the mean stratification of 3D hydrodynamical surface convection simulations...

9. The effect of non-local higher order stress to predict the nonlinear vibration behavior of carbon nanotube conveying viscous nanoflow

International Nuclear Information System (INIS)

2017-01-01

In this research, the effect of non-local higher order stress on the nonlinear vibration behavior of carbon nanotube conveying viscous nanoflow resting on elastic foundation is investigated. Physical intuition reveals that increasing nanoscale stress leads to decrease the stiffness of nanostructure which firstly established by Eringen's non-local elasticity theory (previous nonlocal method) while many of papers have concluded otherwise at microscale based on modified couple stress, modified strain gradient theories and surface stress effect. The non-local higher order stress model (new nonlocal method) is used in this article that has been studied by few researchers in other fields and the results from the present study show that the trend of the new nonlocal method and size dependent effect including modified couple stress theory is the same. In this regard, the nonlinear motion equations are derived using a variational principal approach considering essential higher-order non-local terms. The surrounded elastic medium is modeled by Pasternak foundation to increase the stability of system where the fluid flow may cause system instability. Effects of various parameters such as non-local parameter, elastic foundation coefficient, and fluid flow velocity on the stability and dimensionless natural frequency of nanotube are investigated. The results of this research show that the small scale parameter based on higher order stress help to increase the natural frequency which has been approved by other small scale theories such as strain gradient theory, modified couple stress theory and experiments, and vice versa for previous nonlocal method. This study may be useful to measure accurately the vibration characteristics of nanotubes conveying viscous nanoflow and to design nanofluidic devices for detecting blood Glucose.

10. The effect of non-local higher order stress to predict the nonlinear vibration behavior of carbon nanotube conveying viscous nanoflow

Energy Technology Data Exchange (ETDEWEB)

Mohammadimehr, M., E-mail: mmohammadimehr@kashanu.ac.ir [Department of Solid Mechanics, Faculty of Mechanical Engineering, University of Kashan, P.O. Box: 87317-53153, Kashan (Iran, Islamic Republic of); Mohammadi-Dehabadi, A.A. [Department of Solid Mechanics, Faculty of Mechanical Engineering, University of Kashan, P.O. Box: 87317-53153, Kashan (Iran, Islamic Republic of); Department of Mechanical Engineering, Iran University of Science and Technology, Narmak, Tehran (Iran, Islamic Republic of); Maraghi, Z. Khoddami [Department of Solid Mechanics, Faculty of Mechanical Engineering, University of Kashan, P.O. Box: 87317-53153, Kashan (Iran, Islamic Republic of)

2017-04-01

In this research, the effect of non-local higher order stress on the nonlinear vibration behavior of carbon nanotube conveying viscous nanoflow resting on elastic foundation is investigated. Physical intuition reveals that increasing nanoscale stress leads to decrease the stiffness of nanostructure which firstly established by Eringen's non-local elasticity theory (previous nonlocal method) while many of papers have concluded otherwise at microscale based on modified couple stress, modified strain gradient theories and surface stress effect. The non-local higher order stress model (new nonlocal method) is used in this article that has been studied by few researchers in other fields and the results from the present study show that the trend of the new nonlocal method and size dependent effect including modified couple stress theory is the same. In this regard, the nonlinear motion equations are derived using a variational principal approach considering essential higher-order non-local terms. The surrounded elastic medium is modeled by Pasternak foundation to increase the stability of system where the fluid flow may cause system instability. Effects of various parameters such as non-local parameter, elastic foundation coefficient, and fluid flow velocity on the stability and dimensionless natural frequency of nanotube are investigated. The results of this research show that the small scale parameter based on higher order stress help to increase the natural frequency which has been approved by other small scale theories such as strain gradient theory, modified couple stress theory and experiments, and vice versa for previous nonlocal method. This study may be useful to measure accurately the vibration characteristics of nanotubes conveying viscous nanoflow and to design nanofluidic devices for detecting blood Glucose.

11. MO-DE-207A-11: Sparse-View CT Reconstruction Via a Novel Non-Local Means Method

International Nuclear Information System (INIS)

Chen, Z; Qi, H; Wu, S; Xu, Y; Zhou, L

2016-01-01

Purpose: Sparse-view computed tomography (CT) reconstruction is an effective strategy to reduce the radiation dose delivered to patients. Due to its insufficiency of measurements, traditional non-local means (NLM) based reconstruction methods often lead to over-smoothness in image edges. To address this problem, an adaptive NLM reconstruction method based on rotational invariance (RIANLM) is proposed. Methods: The method consists of four steps: 1) Initializing parameters; 2) Algebraic reconstruction technique (ART) reconstruction using raw projection data; 3) Positivity constraint of the image reconstructed by ART; 4) Update reconstructed image by using RIANLM filtering. In RIANLM, a novel similarity metric that is rotational invariance is proposed and used to calculate the distance between two patches. In this way, any patch with similar structure but different orientation to the reference patch would win a relatively large weight to avoid over-smoothed image. Moreover, the parameter h in RIANLM which controls the decay of the weights is adaptive to avoid over-smoothness, while it in NLM is not adaptive during the whole reconstruction process. The proposed method is named as ART-RIANLM and validated on Shepp-Logan phantom and clinical projection data. Results: In our experiments, the searching neighborhood size is set to 15 by 15 and the similarity window is set to 3 by 3. For the simulated case with a resolution of 256 by 256 Shepp-Logan phantom, the ART-RIANLM produces higher SNR (35.38dB<24.00dB) and lower MAE (0.0006<0.0023) reconstructed image than ART-NLM. The visual inspection demonstrated that the proposed method could suppress artifacts or noises more effectively and preserve image edges better. Similar results were found for clinical data case. Conclusion: A novel ART-RIANLM method for sparse-view CT reconstruction is presented with superior image. Compared to the conventional ART-NLM method, the SNR and MAE from ART-RIANLM increases 47% and decreases 74

12. Factorization and non-local 1/mb corrections in the decay anti B → Xsγ

International Nuclear Information System (INIS)

Benzke, Michael

2011-01-01

In this thesis, a systematic analysis of the anti B → X s γ photon spectrum in the endpoint region is presented. The endpoint region refers to a kinematic configuration of the final state, in which the photon has a large energy m b -2E γ =O(Λ QCD ), while the jet has a large energy but small invariant mass. Using methods of soft-collinear effective theory and heavy-quark effective theory, it is shown that the spectrum can be factorized into hard, jet, and soft functions, each encoding the dynamics at a certain scale. The relevant scales in the endpoint region are the heavy-quark mass m b , the hadronic energy scale Λ QCD and an intermediate scale √(Λ QCD m b ) associated with the invariant mass of the jet. It is found that the factorization formula contains two different types of contributions, distinguishable by the space-time structure of the underlying diagrams. On the one hand, there are the direct photon contributions which correspond to diagrams with the photon emitted directly from the weak vertex. The resolved photon contributions on the other hand arise at O(1/m b ) whenever the photon couples to light partons. In this work, these contributions are explicitly defined in terms of convolutions of jet functions with subleading shape functions. While the direct photon contributions can be expressed in terms of a local operator product expansion, when the photon spectrum is integrated over a range larger than the endpoint region, the resolved photon contributions always remain non-local. Thus, they are responsible for a non-perturbative uncertainty on the partonic predictions. In this thesis, the effect of these uncertainties is estimated in two different phenomenological contexts. First, the hadronic uncertainties in the anti B → X s γ branching fraction, defined with a cut E γ > 1.6GeV are discussed. It is found, that the resolved photon contributions give rise to an irreducible theory uncertainty of approximately 5%. As a second application of

13. Adaptive non-local means on local principle neighborhood for noise/artifacts reduction in low-dose CT images.

Science.gov (United States)

Zhang, Yuanke; Lu, Hongbing; Rong, Junyan; Meng, Jing; Shang, Junliang; Ren, Pinghong; Zhang, Junying

2017-09-01

Low-dose CT (LDCT) technique can reduce the x-ray radiation exposure to patients at the cost of degraded images with severe noise and artifacts. Non-local means (NLM) filtering has shown its potential in improving LDCT image quality. However, currently most NLM-based approaches employ a weighted average operation directly on all neighbor pixels with a fixed filtering parameter throughout the NLM filtering process, ignoring the non-stationary noise nature of LDCT images. In this paper, an adaptive NLM filtering scheme on local principle neighborhoods (PC-NLM) is proposed for structure-preserving noise/artifacts reduction in LDCT images. Instead of using neighboring patches directly, in the PC-NLM scheme, the principle component analysis (PCA) is first applied on local neighboring patches of the target patch to decompose the local patches into uncorrelated principle components (PCs), then a NLM filtering is used to regularize each PC of the target patch and finally the regularized components is transformed to get the target patch in image domain. Especially, in the NLM scheme, the filtering parameter is estimated adaptively from local noise level of the neighborhood as well as the signal-to-noise ratio (SNR) of the corresponding PC, which guarantees a "weaker" NLM filtering on PCs with higher SNR and a "stronger" filtering on PCs with lower SNR. The PC-NLM procedure is iteratively performed several times for better removal of the noise and artifacts, and an adaptive iteration strategy is developed to reduce the computational load by determining whether a patch should be processed or not in next round of the PC-NLM filtering. The effectiveness of the presented PC-NLM algorithm is validated by experimental phantom studies and clinical studies. The results show that it can achieve promising gain over some state-of-the-art methods in terms of artifact suppression and structure preservation. With the use of PCA on local neighborhoods to extract principal structural

14. A High-Density SNP Genetic Linkage Map and QTL Analysis of Growth-Related Traits in a Hybrid Family of Oysters (Crassostrea gigas × Crassostrea angulata Using Genotyping-by-Sequencing

Directory of Open Access Journals (Sweden)

Jinpeng Wang

2016-05-01

Full Text Available Oysters are among the most important species in global aquaculture. Crassostrea gigas, and its subspecies C. angulata, are the major cultured species. To determine the genetic basis of growth-related traits in oysters, we constructed a second-generation linkage map from 3367 single-nucleotide polymorphisms (SNPs based on genotyping-by-sequencing, genotyped from a C. gigas × C. angulata hybrid family. These 3367 SNPs were distributed on 1695 markers, which were assigned to 10 linkage groups. The genetic linkage map had a total length of 1084.3 cM, with an average of 0.8 cM between markers; it thus represents the densest genetic map constructed for oysters to date. Twenty-seven quantitative trait loci (QTL for five growth-related traits were detected. These QTL could explain 4.2–7.7% (mean = 5.4% of the phenotypic variation. In total, 50.8% of phenotypic variance for shell width, 7.7% for mass weight, and 34.1% for soft tissue weight were explained. The detected QTL were distributed among eight linkage groups, and more than half (16 were concentrated within narrow regions in their respective linkage groups. Thirty-eight annotated genes were identified within the QTL regions, two of which are key genes for carbohydrate metabolism. Other genes were found to participate in assembly and regulation of the actin cytoskeleton, signal transduction, and regulation of cell differentiation and development. The newly developed high-density genetic map, and the QTL and candidate genes identified provide a valuable genetic resource and a basis for marker-assisted selection for C. gigas and C. angulata.

15. Laser driven fusion fission hybrids

International Nuclear Information System (INIS)

Hansen, L.F.; Maniscalco, J.A.

1977-11-01

The role of the fusion-fission hybrid reactor (FFHR) as a fissile fuel and/or power producer is discussed. As long range options to supply the world energy needs, hybrid-fueled thermal-burner reactors are compared to liquid metal fast breeder reactors (LMFBR). A discussion of different fuel cycles (thorium, depleted uranium, and spent fuel) is presented in order to compare the energy multiplication, the production of fissile fuel, the laser efficiency and pellet gain requirements of the hybrid reactor. Lawrence Livermore Laboratory (LLL) has collaborated with Bechtel Corporation and with Westinghouse in two engineering design studies of laser fusion driven hybrid power plants. The hybrid designs which have resulted from these two studies are briefly described and analyzed by considering operational parameters, such as energy multiplication, power density, burn-up and plutonium production as a function time

16. Density functional theory: Foundations reviewed

Energy Technology Data Exchange (ETDEWEB)

Kryachko, Eugene S., E-mail: eugene.kryachko@ulg.ac.be [Bogolyubov Institute for Theoretical Physics, Kiev, 03680 (Ukraine); Ludeña, Eduardo V., E-mail: popluabe@yahoo.es [Centro de Química, Instituto Venezolano de Investigaciones Científicas, IVIC, Apartado 21827, Caracas 1020-A (Venezuela, Bolivarian Republic of); Prometheus Program, Senescyt (Ecuador); Grupo Ecuatoriano para el Estudio Experimental y Teórico de Nanosistemas, GETNano, USFQ, N104-E, Quito (Ecuador); Escuela Politécnica Superior del Litoral, ESPOL, Guayaquil (Ecuador)

2014-11-10

Guided by the above motto (quotation), we review a broad range of issues lying at the foundations of Density Functional Theory, DFT, a theory which is currently omnipresent in our everyday computational study of atoms and molecules, solids and nano-materials, and which lies at the heart of modern many-body computational technologies. The key goal is to demonstrate that there are definitely the ways to improve DFT. We start by considering DFT in the larger context provided by reduced density matrix theory (RDMT) and natural orbital functional theory (NOFT), and examine the implications that N-representability conditions on the second-order reduced density matrix (2-RDM) have not only on RDMT and NOFT but, also, by extension, on the functionals of DFT. This examination is timely in view of the fact that necessary and sufficient N-representability conditions on the 2-RDM have recently been attained. In the second place, we review some problems appearing in the original formulation of the first Hohenberg–Kohn theorem which is still a subject of some controversy. In this vein we recall Lieb’s comment on this proof and the extension to this proof given by Pino et al. (2009), and in this context examine the conditions that must be met in order that the one-to-one correspondence between ground-state densities and external potentials remains valid for finite subspaces (namely, the subspaces where all Kohn–Sham solutions are obtained in practical applications). We also consider the issue of whether the Kohn–Sham equations can be derived from basic principles or whether they are postulated. We examine this problem in relation to ab initio DFT. The possibility of postulating arbitrary Kohn–Sham-type equations, where the effective potential is by definition some arbitrary mixture of local and non-local terms, is discussed. We also deal with the issue of whether there exists a universal functional, or whether one should advocate instead the construction of problem

17. Hybrid reactors

International Nuclear Information System (INIS)

Moir, R.W.

1980-01-01

The rationale for hybrid fusion-fission reactors is the production of fissile fuel for fission reactors. A new class of reactor, the fission-suppressed hybrid promises unusually good safety features as well as the ability to support 25 light-water reactors of the same nuclear power rating, or even more high-conversion-ratio reactors such as the heavy-water type. One 4000-MW nuclear hybrid can produce 7200 kg of 233 U per year. To obtain good economics, injector efficiency times plasma gain (eta/sub i/Q) should be greater than 2, the wall load should be greater than 1 MW.m -2 , and the hybrid should cost less than 6 times the cost of a light-water reactor. Introduction rates for the fission-suppressed hybrid are usually rapid

18. The shortcomings of semi-local and hybrid functionals: what we can learn from surface science studies

International Nuclear Information System (INIS)

Stroppa, A; Kresse, G

2008-01-01

A study of the adsorption of CO on late 4d and 5d transition metal (111) surfaces (Ru, Rh, Pd, Ag, Os, Ir and Pt) considering atop and hollow site adsorption is presented. The applied functionals include the gradient-corrected Perdew-Burke-Ernzerhof (PBE) and Becke-Lee-Yang-Parr (BLYP) functionals, and the corresponding hybrid Hartree-Fock density functionals HSE and B3LYP. We find that PBE-based hybrid functionals (specifically HSE) yield, with the exception of Pt, the correct site order on all considered metals, but they also considerably overestimate the adsorption energies compared to experiment. On the other hand, the semi-local BLYP functional and the corresponding hybrid functional B3LYP yield very satisfactory adsorption energies and the correct adsorption site for all surfaces. We are thus faced with a Procrustean problem: the B3LYP and BLYP functionals seem to be the overall best choice for describing adsorption on metal surfaces, but they simultaneously fail to account well for the properties of the metal, vastly overestimating the equilibrium volume and underestimating the atomization energies. Setting out from these observations, general conclusions are drawn on the relative merits and drawbacks of various semi-local and hybrid functionals. The discussion includes a revised version of the PBE functional specifically optimized for bulk properties and surface energies (PBEsol), a revised version of the PBE functional specifically optimized to predict accurate adsorption energies (rPBE), as well as the aforementioned BLYP functional. We conclude that no semi-local functional is capable of describing all aspects properly, and including non-local exchange also only improves some but worsens other properties

19. Challenges in Upscaling Geomorphic Transport Laws: Scale-dependence of Local vs. Non-local Formalisms and Derivation of Closures (Invited)

Science.gov (United States)

Foufoula-Georgiou, E.; Ganti, V. K.; Passalacqua, P.

2010-12-01

Nonlinear geomorphic transport laws are often derived from mechanistic considerations at a point, and yet they are implemented on 90m or 30 m DEMs, presenting a mismatch in the scales of derivation and application of the flux laws. Since estimates of local slopes and curvatures are known to depend on the scale of the DEM used in their computation, two questions arise: (1) how to meaningfully compensate for the scale dependence, if any, of local transport laws? and (2) how to formally derive, via upscaling, constitutive laws that are applicable at larger scales? Recently, non-local geomorphic transport laws for sediment transport on hillslopes have been introduced using the concept of an integral flux that depends on topographic attributes in the vicinity of a point of interest. In this paper, we demonstrate the scale dependence of local nonlinear hillslope sediment transport laws and derive a closure term via upscaling (Reynolds averaging). We also show that the non-local hillslope transport laws are inherently scale independent owing to their non-local, scale-free nature. These concepts are demonstrated via an application to a small subbasin of the Oregon Coast Range using 2m LiDAR topographic data.

20. Description of plasmon-like band in silver clusters: the importance of the long-range Hartree-Fock exchange in time-dependent density-functional theory simulations.

Science.gov (United States)

Rabilloud, Franck

2014-10-14

Absorption spectra of Ag20 and Ag55(q) (q = +1, -3) nanoclusters are investigated in the framework of the time-dependent density functional theory in order to analyse the role of the d electrons in plasmon-like band of silver clusters. The description of the plasmon-like band from calculations using density functionals containing an amount of Hartree-Fock exchange at long range, namely, hybrid and range-separated hybrid (RSH) density functionals, is in good agreement with the classical interpretation of the plasmon-like structure as a collective excitation of valence s-electrons. In contrast, using local or semi-local exchange functionals (generalized gradient approximations (GGAs) or meta-GGAs) leads to a strong overestimation of the role of d electrons in the plasmon-like band. The semi-local asymptotically corrected model potentials also describe the plasmon as mainly associated to d electrons, though calculated spectra are in fairly good agreement with those calculated using the RSH scheme. Our analysis shows that a portion of non-local exchange modifies the description of the plasmon-like band.

1. Cosmological dynamics of a hybrid chameleon scenario

OpenAIRE

Nozari, Kourosh; Rashidi, N.

2013-01-01

We consider a hybrid scalar field which is non-minimally coupled to the matter and models a chameleon cosmology. By introducing an effective potential, we study the dependence of the effective potential's minimum and hybrid chameleon field's masses to the local matter density. In a dynamical system technique, we analyze the phase space of this two-field chameleon model, find its fixed points and study their stability. We show that the hybrid chameleon domination solution is a stable attractor...

2. Hybrid intermediaries

OpenAIRE

Cetorelli, Nicola

2014-01-01

I introduce the concept of hybrid intermediaries: financial conglomerates that control a multiplicity of entity types active in the "assembly line" process of modern financial intermediation, a system that has become known as shadow banking. The complex bank holding companies of today are the best example of hybrid intermediaries, but I argue that financial firms from the "nonbank" space can just as easily evolve into conglomerates with similar organizational structure, thus acquiring the cap...

Data.gov (United States)

U.S. Environmental Protection Agency — Road density is generally highly correlated with amount of developed land cover. High road densities usually indicate high levels of ecological disturbance. More...

4. Li-Ion, Ultra-capacitor Based Hybrid Energy Module

National Research Council Canada - National Science Library

Daboussi, Zaher; Paryani, Anil; Khalil, Gus; Catherino, Henry; Gargies, Sonya

2007-01-01

.... To determine the optimum utilization of ultra-capacitors in applications where high power density and high energy density are required, an optimized Li-Ion/Ultra-capacitor Hybrid Energy Module (HEM...

5. Hybrid superconducting magnetic suspensions

International Nuclear Information System (INIS)

Tixador, P.; Hiebel, P.; Brunet, Y.; Chaud, X.; Gautier-Picard, P.

1996-01-01

Superconductors, especially high T c ones, are the most attractive materials to design stable and fully passive magnetic suspensions which have to control five degrees of freedom. The hybrid superconducting magnetic suspensions present high performances and a simple cooling mode. They consist of a permanent magnet bearing, stabilized by a suitable magnet-superconductor structure. Several designs are given and compared in terms of forces and stiffnesses. The design of the magnet bearing plays an important part. The superconducting magnetic bearing participates less in levitation but must provide a high stabilizing stiffness. This is achieved by the magnet configuration, a good material in term of critical current density and field cooling. A hybrid superconducting suspension for a flywheel is presented. This system consists of a magnet thrust bearing stabilized by superconductors interacting with an alternating polarity magnet structure. First tests and results are reported. Superconducting materials are magnetically melt-textured YBaCuO

6. Orbital-dependent exchange-correlation functionals in density-functional theory realized by the FLAPW method

Energy Technology Data Exchange (ETDEWEB)

Betzinger, Markus

2011-12-14

In this thesis, we extended the applicability of the full-potential linearized augmented-plane-wave (FLAPW) method, one of the most precise, versatile and generally applicable electronic structure methods for solids working within the framework of density-functional theory (DFT), to orbital-dependent functionals for the exchange-correlation (xc) energy. Two different schemes that deal with orbital-dependent functionals, the Kohn-Sham (KS) and the generalized Kohn-Sham (gKS) formalism, have been realized. Hybrid functionals, combining some amount of the orbital-dependent exact exchange energy with local or semi-local functionals of the density, are implemented within the gKS scheme. We work in particular with the PBE0 hybrid of Perdew, Burke, and Ernzerhof. Our implementation relies on a representation of the non-local exact exchange potential - its calculation constitutes the most time consuming step in a practical calculation - by an auxiliary mixed product basis (MPB). In this way, the matrix elements of the Hamiltonian corresponding to the non-local potential become a Brillouin-zone (BZ) sum over vector-matrix-vector products. Several techniques are developed and explored to further accelerate our numerical scheme. We show PBE0 results for a variety of semiconductors and insulators. In comparison with experiment, the PBE0 functional leads to improved band gaps and an improved description of localized states. Even for the ferromagnetic semiconductor EuO with localized 4f electrons, the electronic and magnetic properties are correctly described by the PBE0 functional. Subsequently, we discuss the construction of the local, multiplicative exact exchange (EXX) potential from the non-local, orbital-dependent exact exchange energy. For this purpose we employ the optimized effective potential (OEP) method. Central ingredients of the OEP equation are the KS wave-function response and the single-particle density response function. We show that a balance between the LAPW

7. Orbital-dependent exchange-correlation functionals in density-functional theory realized by the FLAPW method

International Nuclear Information System (INIS)

Betzinger, Markus

2011-01-01

In this thesis, we extended the applicability of the full-potential linearized augmented-plane-wave (FLAPW) method, one of the most precise, versatile and generally applicable electronic structure methods for solids working within the framework of density-functional theory (DFT), to orbital-dependent functionals for the exchange-correlation (xc) energy. Two different schemes that deal with orbital-dependent functionals, the Kohn-Sham (KS) and the generalized Kohn-Sham (gKS) formalism, have been realized. Hybrid functionals, combining some amount of the orbital-dependent exact exchange energy with local or semi-local functionals of the density, are implemented within the gKS scheme. We work in particular with the PBE0 hybrid of Perdew, Burke, and Ernzerhof. Our implementation relies on a representation of the non-local exact exchange potential - its calculation constitutes the most time consuming step in a practical calculation - by an auxiliary mixed product basis (MPB). In this way, the matrix elements of the Hamiltonian corresponding to the non-local potential become a Brillouin-zone (BZ) sum over vector-matrix-vector products. Several techniques are developed and explored to further accelerate our numerical scheme. We show PBE0 results for a variety of semiconductors and insulators. In comparison with experiment, the PBE0 functional leads to improved band gaps and an improved description of localized states. Even for the ferromagnetic semiconductor EuO with localized 4f electrons, the electronic and magnetic properties are correctly described by the PBE0 functional. Subsequently, we discuss the construction of the local, multiplicative exact exchange (EXX) potential from the non-local, orbital-dependent exact exchange energy. For this purpose we employ the optimized effective potential (OEP) method. Central ingredients of the OEP equation are the KS wave-function response and the single-particle density response function. We show that a balance between the LAPW

8. Electronic structure of bulk AnO{sub 2} (An = U, Np, Pu) and water adsorption on the (111) and (110) surfaces of UO{sub 2} and PuO{sub 2} from hybrid density functional theory within the periodic electrostatic embedded cluster method

Energy Technology Data Exchange (ETDEWEB)

Wellington, Joseph P.W. [Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ (United Kingdom); Kerridge, Andrew [Department of Chemistry, Lancaster University, Bailrigg, Lancaster LA1 4YP (United Kingdom); Austin, Jonathan [National Nuclear Laboratory, Chadwick House, Warrington Road, Birchwood Park, Warrington WA3 6AE (United Kingdom); Kaltsoyannis, Nikolas, E-mail: nikolas.kaltsoyannis@manchester.ac.uk [School of Chemistry, The University of Manchester, Oxford Road, Manchester M13 9PL (United Kingdom)

2016-12-15

Generalised gradient approximation (PBE) and hybrid (PBE0) density functional theory (DFT) within the periodic electrostatic embedded cluster method have been used to study AnO{sub 2} bulk and surfaces (An = U, Np, Pu). The electronic structure has been investigated by examining the projected density of states (PDOS). While PBE incorrectly predicts these systems to be metallic, PBE0 finds them to be insulators, with the composition of the valence and conduction levels agreeing well with experiment. Molecular and dissociative water adsorption on the (111) and (110) surfaces of UO{sub 2} and PuO{sub 2} has been investigated, with that on the (110) surface being stronger than on the (111). Similar energies are found for molecular and dissociative adsorption on the (111) surfaces, while on the (110) there is a clear preference for dissociative adsorption. Adsorption energies and geometries on the (111) surface of UO{sub 2} are in good agreement with recent periodic DFT studies using the GGA+U approach, and our data for dissociative adsorption on the (110) surface of PuO{sub 2} match experiment rather well, especially when dispersion corrections are included. - Graphical abstract: The electronic structures of AnO{sub 2} (An = U, Np, Pu) are studied computationally with hybrid density functional theory, and the geometries and energetics of water adsorption on the low index surfaces are presented.

9. Effects of non-local electron transport in one-dimensional and two-dimensional simulations of shock-ignited inertial confinement fusion targets

Energy Technology Data Exchange (ETDEWEB)

Marocchino, A.; Atzeni, S.; Schiavi, A. [Dipartimento SBAI, Università di Roma “La Sapienza” and CNISM, Roma 00161 (Italy)

2014-01-15

In some regions of a laser driven inertial fusion target, the electron mean-free path can become comparable to or even longer than the electron temperature gradient scale-length. This can be particularly important in shock-ignited (SI) targets, where the laser-spike heated corona reaches temperatures of several keV. In this case, thermal conduction cannot be described by a simple local conductivity model and a Fick's law. Fluid codes usually employ flux-limited conduction models, which preserve causality, but lose important features of the thermal flow. A more accurate thermal flow modeling requires convolution-like non-local operators. In order to improve the simulation of SI targets, the non-local electron transport operator proposed by Schurtz-Nicolaï-Busquet [G. P. Schurtz et al., Phys. Plasmas 7, 4238 (2000)] has been implemented in the DUED fluid code. Both one-dimensional (1D) and two-dimensional (2D) simulations of SI targets have been performed. 1D simulations of the ablation phase highlight that while the shock profile and timing might be mocked up with a flux-limiter; the electron temperature profiles exhibit a relatively different behavior with no major effects on the final gain. The spike, instead, can only roughly be reproduced with a fixed flux-limiter value. 1D target gain is however unaffected, provided some minor tuning of laser pulses. 2D simulations show that the use of a non-local thermal conduction model does not affect the robustness to mispositioning of targets driven by quasi-uniform laser irradiation. 2D simulations performed with only two final polar intense spikes yield encouraging results and support further studies.

10. Effects of non-local electron transport in one-dimensional and two-dimensional simulations of shock-ignited inertial confinement fusion targets

International Nuclear Information System (INIS)

Marocchino, A.; Atzeni, S.; Schiavi, A.

2014-01-01

In some regions of a laser driven inertial fusion target, the electron mean-free path can become comparable to or even longer than the electron temperature gradient scale-length. This can be particularly important in shock-ignited (SI) targets, where the laser-spike heated corona reaches temperatures of several keV. In this case, thermal conduction cannot be described by a simple local conductivity model and a Fick's law. Fluid codes usually employ flux-limited conduction models, which preserve causality, but lose important features of the thermal flow. A more accurate thermal flow modeling requires convolution-like non-local operators. In order to improve the simulation of SI targets, the non-local electron transport operator proposed by Schurtz-Nicolaï-Busquet [G. P. Schurtz et al., Phys. Plasmas 7, 4238 (2000)] has been implemented in the DUED fluid code. Both one-dimensional (1D) and two-dimensional (2D) simulations of SI targets have been performed. 1D simulations of the ablation phase highlight that while the shock profile and timing might be mocked up with a flux-limiter; the electron temperature profiles exhibit a relatively different behavior with no major effects on the final gain. The spike, instead, can only roughly be reproduced with a fixed flux-limiter value. 1D target gain is however unaffected, provided some minor tuning of laser pulses. 2D simulations show that the use of a non-local thermal conduction model does not affect the robustness to mispositioning of targets driven by quasi-uniform laser irradiation. 2D simulations performed with only two final polar intense spikes yield encouraging results and support further studies

11. Effects of non-local electron transport in one-dimensional and two-dimensional simulations of shock-ignited inertial confinement fusion targets

Science.gov (United States)

Marocchino, A.; Atzeni, S.; Schiavi, A.

2014-01-01

In some regions of a laser driven inertial fusion target, the electron mean-free path can become comparable to or even longer than the electron temperature gradient scale-length. This can be particularly important in shock-ignited (SI) targets, where the laser-spike heated corona reaches temperatures of several keV. In this case, thermal conduction cannot be described by a simple local conductivity model and a Fick's law. Fluid codes usually employ flux-limited conduction models, which preserve causality, but lose important features of the thermal flow. A more accurate thermal flow modeling requires convolution-like non-local operators. In order to improve the simulation of SI targets, the non-local electron transport operator proposed by Schurtz-Nicolaï-Busquet [G. P. Schurtz et al., Phys. Plasmas 7, 4238 (2000)] has been implemented in the DUED fluid code. Both one-dimensional (1D) and two-dimensional (2D) simulations of SI targets have been performed. 1D simulations of the ablation phase highlight that while the shock profile and timing might be mocked up with a flux-limiter; the electron temperature profiles exhibit a relatively different behavior with no major effects on the final gain. The spike, instead, can only roughly be reproduced with a fixed flux-limiter value. 1D target gain is however unaffected, provided some minor tuning of laser pulses. 2D simulations show that the use of a non-local thermal conduction model does not affect the robustness to mispositioning of targets driven by quasi-uniform laser irradiation. 2D simulations performed with only two final polar intense spikes yield encouraging results and support further studies.

12. A DGTD method for the numerical modeling of the interaction of light with nanometer scale metallic structures taking into account non-local dispersion effects

Energy Technology Data Exchange (ETDEWEB)

Schmitt, Nikolai [Inria, 2004 Route des Lucioles, BP 93, 06902 Sophia Antipolis Cedex (France); Technische Universitaet Darmstadt, Institut fuer Theorie Elektromagnetischer Felder (TEMF), Schlossgartenstr. 8, 64289 Darmstadt (Germany); Scheid, Claire [Inria, 2004 Route des Lucioles, BP 93, 06902 Sophia Antipolis Cedex (France); University of Nice – Sophia Antipolis, Mathematics laboratory, Parc Valrose, 06108 Nice, Cedex 02 (France); Lanteri, Stéphane, E-mail: Stephane.Lanteri@inria.fr [Inria, 2004 Route des Lucioles, BP 93, 06902 Sophia Antipolis Cedex (France); Moreau, Antoine [Institut Pascal, Université Blaise Pascal, 24, avenue des Landais, 63171 Aubière Cedex (France); Viquerat, Jonathan [Inria, 2004 Route des Lucioles, BP 93, 06902 Sophia Antipolis Cedex (France)

2016-07-01

The interaction of light with metallic nanostructures is increasingly attracting interest because of numerous potential applications. Sub-wavelength metallic structures, when illuminated with a frequency close to the plasma frequency of the metal, present resonances that cause extreme local field enhancements. Exploiting the latter in applications of interest requires a detailed knowledge about the occurring fields which can actually not be obtained analytically. For the latter mentioned reason, numerical tools are thus an absolute necessity. The insight they provide is very often the only way to get a deep enough understanding of the very rich physics at play. For the numerical modeling of light-structure interaction on the nanoscale, the choice of an appropriate material model is a crucial point. Approaches that are adopted in a first instance are based on local (i.e. with no interaction between electrons) dispersive models, e.g. Drude or Drude–Lorentz models. From the mathematical point of view, when a time-domain modeling is considered, these models lead to an additional system of ordinary differential equations coupled to Maxwell's equations. However, recent experiments have shown that the repulsive interaction between electrons inside the metal makes the response of metals intrinsically non-local and that this effect cannot generally be overlooked. Technological achievements have enabled the consideration of metallic structures in a regime where such non-localities have a significant influence on the structures' optical response. This leads to an additional, in general non-linear, system of partial differential equations which is, when coupled to Maxwell's equations, significantly more difficult to treat. Nevertheless, dealing with a linearized non-local dispersion model already opens the route to numerous practical applications of plasmonics. In this work, we present a Discontinuous Galerkin Time-Domain (DGTD) method able to solve the system

13. Unique solvability of a non-linear non-local boundary-value problem for systems of non-linear functional differential equations

Czech Academy of Sciences Publication Activity Database

Dilna, N.; Rontó, András

2010-01-01

Roč. 60, č. 3 (2010), s. 327-338 ISSN 0139-9918 R&D Projects: GA ČR(CZ) GA201/06/0254 Institutional research plan: CEZ:AV0Z10190503 Keywords : non-linear boundary value-problem * functional differential equation * non-local condition * unique solvability * differential inequality Subject RIV: BA - General Mathematics Impact factor: 0.316, year: 2010 http://link.springer.com/article/10.2478%2Fs12175-010-0015-9

14. Hybrid Reactor designs in the United States

International Nuclear Information System (INIS)

Wolkenhauer, W.C.

1978-01-01

This paper reviews the current, active, interrelated Hybrid Reactor development programs in the United States, and offers a probable future course of action for the technology. The Department of Energy (DOE) program primarily emphasizes development of Hybrid Reactors that are optimized for proliferation resistance. The Electric Power Research Institute (EPRI) program concentrates on avenues for Hybrid Reactor commercialization. The history of electrical generation technology has been one of steady movement toward higher power densities and higher quality fuels. An apparent advantage of the Hybrid Reactor option is that it follows this trend

15. Electrical potential-assisted DNA hybridization. How to mitigate electrostatics for surface DNA hybridization.

Science.gov (United States)

Tymoczko, Jakub; Schuhmann, Wolfgang; Gebala, Magdalena

2014-12-24

Surface-confined DNA hybridization reactions are sensitive to the number and identity of DNA capture probes and experimental conditions such as the nature and the ionic strength of the electrolyte solution. When the surface probe density is high or the concentration of bulk ions is much lower than the concentration of ions within the DNA layer, hybridization is significantly slowed down or does not proceed at all. However, high-density DNA monolayers are attractive for designing high-sensitivity DNA sensors. Thus, circumventing sluggish DNA hybridization on such interfaces allows a high surface concentration of target DNA and improved signal/noise ratio. We present potential-assisted hybridization as a strategy in which an external voltage is applied to the ssDNA-modified interface during the hybridization process. Results show that a significant enhancement of hybridization can be achieved using this approach.

16. Lung density

DEFF Research Database (Denmark)

Garnett, E S; Webber, C E; Coates, G

1977-01-01

The density of a defined volume of the human lung can be measured in vivo by a new noninvasive technique. A beam of gamma-rays is directed at the lung and, by measuring the scattered gamma-rays, lung density is calculated. The density in the lower lobe of the right lung in normal man during quiet...... breathing in the sitting position ranged from 0.25 to 0.37 g.cm-3. Subnormal values were found in patients with emphsema. In patients with pulmonary congestion and edema, lung density values ranged from 0.33 to 0.93 g.cm-3. The lung density measurement correlated well with the findings in chest radiographs...... but the lung density values were more sensitive indices. This was particularly evident in serial observations of individual patients....

17. Hybrid stars

Hybrid stars. AsHOK GOYAL. Department of Physics and Astrophysics, University of Delhi, Delhi 110 007, India. Abstract. Recently there have been important developments in the determination of neutron ... number and the electric charge. ... available to the system to rearrange concentration of charges for a given fraction of.

18. A novel segmentation method for uneven lighting image with noise injection based on non-local spatial information and intuitionistic fuzzy entropy

Science.gov (United States)

Yu, Haiyan; Fan, Jiulun

2017-12-01

Local thresholding methods for uneven lighting image segmentation always have the limitations that they are very sensitive to noise injection and that the performance relies largely upon the choice of the initial window size. This paper proposes a novel algorithm for segmenting uneven lighting images with strong noise injection based on non-local spatial information and intuitionistic fuzzy theory. We regard an image as a gray wave in three-dimensional space, which is composed of many peaks and troughs, and these peaks and troughs can divide the image into many local sub-regions in different directions. Our algorithm computes the relative characteristic of each pixel located in the corresponding sub-region based on fuzzy membership function and uses it to replace its absolute characteristic (its gray level) to reduce the influence of uneven light on image segmentation. At the same time, the non-local adaptive spatial constraints of pixels are introduced to avoid noise interference with the search of local sub-regions and the computation of local characteristics. Moreover, edge information is also taken into account to avoid false peak and trough labeling. Finally, a global method based on intuitionistic fuzzy entropy is employed on the wave transformation image to obtain the segmented result. Experiments on several test images show that the proposed method has excellent capability of decreasing the influence of uneven illumination on images and noise injection and behaves more robustly than several classical global and local thresholding methods.

19. Nonlinear static analysis of single layer annular/circular graphene sheets embedded in Winkler–Pasternak elastic matrix based on non-local theory of Eringen

Directory of Open Access Journals (Sweden)

Shahriar Dastjerdi

2016-06-01

Full Text Available Nonlinear bending analysis of orthotropic annular/circular graphene sheets has been studied based on the non-local elasticity theory. The first order shear deformation theory (FSDT is applied in combination with the nonlinear Von-Karman strain field. The obtained differential equations are solved by using two methods, first the differential quadrature method (DQM and a new semi-analytical polynomial method (SAPM which is innovated by the authors. Applying the DQM or SAPM, the differential equations are transformed to nonlinear algebraic equations system. Then the Newton–Raphson iterative scheme is used. First, the obtained results from DQM and SAPM are compared and it is concluded that although the SAPM’s formulation is considerably simpler than DQM, however, the SAPM’s results are so close to DQM. The results are validated with available papers. Finally, the effects of small scale parameter on the results, the comparison between local and non-local theories, and linear to nonlinear analyses are investigated.

20. Low Bone Density

Science.gov (United States)

... Density Exam/Testing › Low Bone Density Low Bone Density Low bone density is when your bone density ... people with normal bone density. Detecting Low Bone Density A bone density test will determine whether you ...

1. Conditional Density Approximations with Mixtures of Polynomials

DEFF Research Database (Denmark)

Varando, Gherardo; López-Cruz, Pedro L.; Nielsen, Thomas Dyhre

2015-01-01

Mixtures of polynomials (MoPs) are a non-parametric density estimation technique especially designed for hybrid Bayesian networks with continuous and discrete variables. Algorithms to learn one- and multi-dimensional (marginal) MoPs from data have recently been proposed. In this paper we introduce...... two methods for learning MoP approximations of conditional densities from data. Both approaches are based on learning MoP approximations of the joint density and the marginal density of the conditioning variables, but they differ as to how the MoP approximation of the quotient of the two densities...

2. Hybrid Qualifications

DEFF Research Database (Denmark)

Against the background of increasing qualification needs there is a growing awareness of the challenge to widen participation in processes of skill formation and competence development. At the same time, the issue of permeability between vocational education and training (VET) and general education...... has turned out as a major focus of European education and training policies and certainly is a crucial principle underlying the European Qualifications Framework (EQF). In this context, «hybrid qualifications» (HQ) may be seen as an interesting approach to tackle these challenges as they serve «two...

3. Hybrid Gear

Science.gov (United States)

Handschuh, Robert F. (Inventor); Roberts, Gary D. (Inventor)

2016-01-01

A hybrid gear consisting of metallic outer rim with gear teeth and metallic hub in combination with a composite lay up between the shaft interface (hub) and gear tooth rim is described. The composite lay-up lightens the gear member while having similar torque carrying capability and it attenuates the impact loading driven noise/vibration that is typical in gear systems. The gear has the same operational capability with respect to shaft speed, torque, and temperature as an all-metallic gear as used in aerospace gear design.

4. Level densities

International Nuclear Information System (INIS)

Ignatyuk, A.V.

1998-01-01

For any applications of the statistical theory of nuclear reactions it is very important to obtain the parameters of the level density description from the reliable experimental data. The cumulative numbers of low-lying levels and the average spacings between neutron resonances are usually used as such data. The level density parameters fitted to such data are compiled in the RIPL Starter File for the tree models most frequently used in practical calculations: i) For the Gilber-Cameron model the parameters of the Beijing group, based on a rather recent compilations of the neutron resonance and low-lying level densities and included into the beijing-gc.dat file, are chosen as recommended. As alternative versions the parameters provided by other groups are given into the files: jaeri-gc.dat, bombay-gc.dat, obninsk-gc.dat. Additionally the iljinov-gc.dat, and mengoni-gc.dat files include sets of the level density parameters that take into account the damping of shell effects at high energies. ii) For the backed-shifted Fermi gas model the beijing-bs.dat file is selected as the recommended one. Alternative parameters of the Obninsk group are given in the obninsk-bs.dat file and those of Bombay in bombay-bs.dat. iii) For the generalized superfluid model the Obninsk group parameters included into the obninsk-bcs.dat file are chosen as recommended ones and the beijing-bcs.dat file is included as an alternative set of parameters. iv) For the microscopic approach to the level densities the files are: obninsk-micro.for -FORTRAN 77 source for the microscopical statistical level density code developed in Obninsk by Ignatyuk and coworkers, moller-levels.gz - Moeller single-particle level and ground state deformation data base, moller-levels.for -retrieval code for Moeller single-particle level scheme. (author)

5. Intuitionistic hybrid logic

DEFF Research Database (Denmark)

Braüner, Torben

2011-01-01

Intuitionistic hybrid logic is hybrid modal logic over an intuitionistic logic basis instead of a classical logical basis. In this short paper we introduce intuitionistic hybrid logic and we give a survey of work in the area.......Intuitionistic hybrid logic is hybrid modal logic over an intuitionistic logic basis instead of a classical logical basis. In this short paper we introduce intuitionistic hybrid logic and we give a survey of work in the area....

6. A self-interaction-free local hybrid functional: Accurate binding energies vis-à-vis accurate ionization potentials from Kohn-Sham eigenvalues

International Nuclear Information System (INIS)

Schmidt, Tobias; Kümmel, Stephan; Kraisler, Eli; Makmal, Adi; Kronik, Leeor

2014-01-01

We present and test a new approximation for the exchange-correlation (xc) energy of Kohn-Sham density functional theory. It combines exact exchange with a compatible non-local correlation functional. The functional is by construction free of one-electron self-interaction, respects constraints derived from uniform coordinate scaling, and has the correct asymptotic behavior of the xc energy density. It contains one parameter that is not determined ab initio. We investigate whether it is possible to construct a functional that yields accurate binding energies and affords other advantages, specifically Kohn-Sham eigenvalues that reliably reflect ionization potentials. Tests for a set of atoms and small molecules show that within our local-hybrid form accurate binding energies can be achieved by proper optimization of the free parameter in our functional, along with an improvement in dissociation energy curves and in Kohn-Sham eigenvalues. However, the correspondence of the latter to experimental ionization potentials is not yet satisfactory, and if we choose to optimize their prediction, a rather different value of the functional's parameter is obtained. We put this finding in a larger context by discussing similar observations for other functionals and possible directions for further functional development that our findings suggest

7. Composição bromatológica de silagens de híbridos de sorgo cultivados em diferentes densidades de plantas Chemical composition of silage sorghum hybrids grown at different densities

Directory of Open Access Journals (Sweden)

Poliana Mendes Avelino

2011-03-01

Full Text Available Avaliou-se a composição bromatológica das silagens de dois híbridos de sorgo, AG-2005 (duplo propósito e VOLUMAX (forrageiro, cultivados nos espaçamentos de 0,50; 0,75 e 1,00 m, resultando nas densidades de 140.000; 186.666 e 280.000 plantas por ha, respectivamente. A silagem do híbrido AG-2005 apresentou matéria seca (MS superior no espaçamento de 1,00 m e foi mais elevada ao da silagem de VOLUMAX em todos os espaçamentos. A proteína bruta (PB elevou-se com a redução dos espaçamentos (6,6; 6,8 e 8%, respectivamente, com maior valor médio no AG-2005 (7,7 vs 6,5%. A fibra em detergente neutro (FDN foi menor no AG-2005 (59,25 vs 62,3% e no espaçamento 0,75 m. Para fibra em detergente ácido (FDA ocorreu diferença entre os dois híbridos no espaçamento 0,5 m, sendo de 33,5 e 39,3 %, respectivamente, para o AG-2005 e VOLUMAX. O EE apresentou diferença significativa (P The objective of the experiment was to evaluate the nutritive value of silages from two sorghum hybrids, AG-2005 (double purpose and VOLUMAX (forage cultivated with different row spacings (0.50 m; 0.75 m and 1.00 m, resulting in 140,000; 186,666 e 280,000 plants per ha, respectively. Dry matter content of AG-2005 silage was higher for 1 m row spacing, and was higher than for VOLUMAX silage in all row spacings. Crude protein increased as the row spacing was reduced (6.6; 6.8 and 8%, respectively, with higher average value for AG-2005 (7.7 vs 6.5%. Neutral detergent fiber was lower for AG-2005 (59.25 vs 62.3% and for .75 m spacing. Acid detergent fiber differed between hybrids in .5 m row spacing, being 33.5 and 39.3%, respectively, for AG-2005 and VOLUMAX. Ether extract was significantly different between hybrids in .5 m row spacing, being higher for AG-2005 (2.05 vs 1.61%. The use of AG-2005 is recommended for silage production due to its better qualitative characteristics than the VOLUMAX. The .5 m row spacing is recommended for both hybrids, since it improves the

8. A field operational test on valve-regulated lead-acid absorbent-glass-mat batteries in micro-hybrid electric vehicles. Part I. Results based on kernel density estimation

Science.gov (United States)

Schaeck, S.; Karspeck, T.; Ott, C.; Weckler, M.; Stoermer, A. O.

2011-03-01

In March 2007 the BMW Group has launched the micro-hybrid functions brake energy regeneration (BER) and automatic start and stop function (ASSF). Valve-regulated lead-acid (VRLA) batteries in absorbent glass mat (AGM) technology are applied in vehicles with micro-hybrid power system (MHPS). In both part I and part II of this publication vehicles with MHPS and AGM batteries are subject to a field operational test (FOT). Test vehicles with conventional power system (CPS) and flooded batteries were used as a reference. In the FOT sample batteries were mounted several times and electrically tested in the laboratory intermediately. Vehicle- and battery-related diagnosis data were read out for each test run and were matched with laboratory data in a data base. The FOT data were analyzed by the use of two-dimensional, nonparametric kernel estimation for clear data presentation. The data show that capacity loss in the MHPS is comparable to the CPS. However, the influence of mileage performance, which cannot be separated, suggests that battery stress is enhanced in the MHPS although a battery refresh function is applied. Anyway, the FOT demonstrates the unsuitability of flooded batteries for the MHPS because of high early capacity loss due to acid stratification and because of vanishing cranking performance due to increasing internal resistance. Furthermore, the lack of dynamic charge acceptance for high energy regeneration efficiency is illustrated. Under the presented FOT conditions charge acceptance of lead-acid (LA) batteries decreases to less than one third for about half of the sample batteries compared to new battery condition. In part II of this publication FOT data are presented by multiple regression analysis (Schaeck et al., submitted for publication [1]).

9. Hybridized Tetraquarks

CERN Document Server

Esposito, A.; Polosa, A.D.

2016-01-01

We propose a new interpretation of the neutral and charged X, Z exotic hadron resonances. Hybridized-tetraquarks are neither purely compact tetraquark states nor bound or loosely bound molecules. The latter would require a negative or zero binding energy whose counterpart in h-tetraquarks is a positive quantity. The formation mechanism of this new class of hadrons is inspired by that of Feshbach metastable states in atomic physics. The recent claim of an exotic resonance in the Bs pi+- channel by the D0 collaboration and the negative result presented subsequently by the LHCb collaboration are understood in this scheme, together with a considerable portion of available data on X, Z particles. Considerations on a state with the same quantum numbers as the X(5568) are also made.

10. Push-Broom-Type Very High-Resolution Satellite Sensor Data Correction Using Combined Wavelet-Fourier and Multiscale Non-Local Means Filtering

Science.gov (United States)

Kang, Wonseok; Yu, Soohwan; Seo, Doochun; Jeong, Jaeheon; Paik, Joonki

2015-01-01

In very high-resolution (VHR) push-broom-type satellite sensor data, both destriping and denoising methods have become chronic problems and attracted major research advances in the remote sensing fields. Since the estimation of the original image from a noisy input is an ill-posed problem, a simple noise removal algorithm cannot preserve the radiometric integrity of satellite data. To solve these problems, we present a novel method to correct VHR data acquired by a push-broom-type sensor by combining wavelet-Fourier and multiscale non-local means (NLM) filters. After the wavelet-Fourier filter separates the stripe noise from the mixed noise in the wavelet low- and selected high-frequency sub-bands, random noise is removed using the multiscale NLM filter in both low- and high-frequency sub-bands without loss of image detail. The performance of the proposed method is compared to various existing methods on a set of push-broom-type sensor data acquired by Korean Multi-Purpose Satellite 3 (KOMPSAT-3) with severe stripe and random noise, and the results of the proposed method show significantly improved enhancement results over existing state-of-the-art methods in terms of both qualitative and quantitative assessments. PMID:26378532

11. Impact of local and non-local sources of pollution on background US Ozone: synergy of a low-earth orbiting and geostationary sounder constellation

Science.gov (United States)

Bowman, K. W.; Lee, M.

2015-12-01

Dramatic changes in the global distribution of emissions over the last decade have fundamentally altered source-receptor pollution impacts. A new generation of low-earth orbiting (LEO) sounders complimented by geostationary sounders over North America, Europe, and Asia providing a unique opportunity to quantify the current and future trajectory of emissions and their impact on global pollution. We examine the potential of this constellation of air quality sounders to quantify the role of local and non-local sources of pollution on background ozone in the US. Based upon an adjoint sensitivity method, we quantify the role synoptic scale transport of non-US pollution on US background ozone over months representative of different source-receptor relationships. This analysis allows us distinguish emission trajectories from megacities, e.g. Beijing, or regions, e.g., western China, from natural trends on downwind ozone. We subsequently explore how a combination of LEO and GEO observations could help quantify the balance of local emissions against changes in distant sources . These results show how this unprecedented new international ozone observing system can monitor the changing structure of emissions and their impact on global pollution.

12. Non-local correlations via Wigner-Yanase skew information in two SC-qubit having mutual interaction under phase decoherence

Science.gov (United States)

Mohamed, Abdel-Baset A.

2017-10-01

An analytical solution of the master equation that describes a superconducting cavity containing two coupled superconducting charge qubits is obtained. Quantum-mechanical correlations based on Wigner-Yanase skew information, as local quantum uncertainty and uncertainty-induced quantum non-locality, are compared to the concurrence under the effects of the phase decoherence. Local quantum uncertainty exhibits sudden changes during its time evolution and revival process. Sudden death and sudden birth occur only for entanglement, depending on the initial state of the two coupled charge qubits, while the correlations of skew information does not vanish. The quantum correlations of skew information are found to be sensitive to the dephasing rate, the photons number in the cavity, the interaction strength between the two qubits, and the qubit distribution angle of the initial state. With a proper initial state, the stationary correlation of the skew information has a non-zero stationary value for a long time interval under the phase decoherence, that it may be useful in quantum information and computation processes.

13. Retrieval of Kinetic Temperature and Carbon Dioxide Abundance from Non-Local Thermodynamic Equilibrium Limb Emission Measurements made by the SABER Experiment on the TIMED Satellite

Science.gov (United States)

Mertens, Christopher J.; Mlynczak, Martin G.; Lopez-Puertas, Manuel; Wintersteiner, Peter P.; Picard, Richard H.; Winick, Jeremy R.; Gordley, Larry L.; Russell, James M., III

2002-01-01

The Sounding of the Atmosphere using Broadband Emission Radiometry (SABER) experiment was launched onboard the TIMED satellite in December, 2001. SABER is designed to provide measurements of the key radiative and chemical sources and sinks of energy in the mesosphere and lower thermosphere (MLT). SABER measures Earth limb emission in 10 broadband radiometer channels ranging from 1.27 micrometers to 17 micrometers. Measurements are made both day and night over the latitude range from 54 deg. S to 87 deg. N with alternating hemisphere coverage every 60 days. In this paper we concentrate on retrieved profiles of kinetic temperature (T(sub k)) and CO2 volume mixing ratio (vmr), inferred from SABER-observed 15 micrometer and 4.3 micrometer limb emissions, respectively. SABER-measured limb radiances are in non-local thermodynamic equilibrium (non-LTE) in the MLT region. The complexity of non-LTE radiation transfer combined with the large volume of data measured by SABER requires new retrieval approaches and radiative transfer techniques to accurately and efficiently retrieve the data products. In this paper we present the salient features of the coupled non-LTE T(sub k)/CO2 retrieval algorithm, along with preliminary results.

14. Electromagnetic Properties Analysis on Hybrid-driven System of Electromagnetic Motor

Science.gov (United States)

Zhao, Jingbo; Han, Bingyuan; Bei, Shaoyi

2018-01-01

The hybrid-driven system made of permanent-and electromagnets applied in the electromagnetic motor was analyzed, equivalent magnetic circuit was used to establish the mathematical models of hybrid-driven system, based on the models of hybrid-driven system, the air gap flux, air-gap magnetic flux density, electromagnetic force was proposed. Taking the air-gap magnetic flux density and electromagnetic force as main research object, the hybrid-driven system was researched. Electromagnetic properties of hybrid-driven system with different working current modes is studied preliminary. The results shown that analysis based on hybrid-driven system can improve the air-gap magnetic flux density and electromagnetic force more effectively and can also guarantee the output stability, the effectiveness and feasibility of the hybrid-driven system are verified, which proved theoretical basis for the design of hybrid-driven system.

15. Continuity controlled Hybrid Automata

NARCIS (Netherlands)

Bergstra, J.A.; Middelburg, C.A.

We investigate the connections between the process algebra for hybrid systems of Bergstra and Middelburg and the formalism of hybrid automata of Henzinger et al. We give interpretations of hybrid automata in the process algebra for hybrid systems and compare them with the standard interpretation

16. Continuity Controlled Hybrid Automata

NARCIS (Netherlands)

Bergstra, J.A.; Middelburg, C.A.

2004-01-01

We investigate the connections between the process algebra for hybrid systems of Bergstra and Middelburg and the formalism of hybrid automata of Henzinger et al. We give interpretations of hybrid automata in the process algebra for hybrid systems and compare them with the standard interpretation of

17. Continuity controlled hybrid automata

NARCIS (Netherlands)

Bergstra, J.A.; Middelburg, C.A.

2004-01-01

We investigate the connections between the process algebra for hybrid systems of Bergstra and Middelburg and the formalism of hybrid automata of Henzinger et al. We give interpretations of hybrid automata in the process algebra for hybrid systems and compare them with the standard interpretation of

18. Continuity controlled hybrid automata

NARCIS (Netherlands)

Bergstra, J.A.; Middelburg, C.A.

2006-01-01

We investigate the connections between the process algebra for hybrid systems of Bergstra and Middelburg and the formalism of hybrid automata of Henzinger et al. We give interpretations of hybrid automata in the process algebra for hybrid systems and compare them with the standard interpretation of

19. High density harp for SSCL linac

International Nuclear Information System (INIS)

Fritsche, C.T.; Krogh, M.L.; Crist, C.E.

1993-01-01

AlliedSignal Inc., Kansas City Division, and the Superconducting Super Collider Laboratory (SSCL) are collaboratively developing a high density harp for the SSCL linac. This harp is designed using hybrid microcircuit (HMC) technology to obtain a higher wire density than previously available. The developed harp contains one hundred twenty-eight 33-micron-diameter carbon wires on 0.38-mm centers. The harp features an onboard broken wire detection circuit. Carbon wire preparation and attachment processes were developed. High density surface mount connectors were located. The status of high density harp development will be presented along with planned future activities

20. High density harp for SSCL linac

International Nuclear Information System (INIS)

Fritsche, C.T.; Krogh, M.L.

1993-05-01

AlliedSignal Inc., Kansas City Division, and the Superconducting Super Collider Laboratory (SSCL) are collaboratively developing a high density harp for the SSCL linac. This harp is designed using hybrid microcircuit (HMC) technology to obtain a higher wire density than previously available. The developed harp contains one hundred twenty-eight 33-micron-diameter carbon wires on 0.38-mm centers. The harp features an onboard broken wire detection circuit. Carbon wire preparation and attachment processes were developed. High density surface mount connectors were located. The status of high density harp development will be presented along with planned future activities

1. Corporate Hybrid Bonds

OpenAIRE

Ahlberg, Johan; Jansson, Anton

2016-01-01

Hybrid securities do not constitute a new phenomenon in the Swedish capital markets. Most commonly, hybrids issued by Swedish real estate companies in recent years are preference shares. Corporate hybrid bonds on the other hand may be considered as somewhat of a new-born child in the family of hybrid instruments. These do, as all other hybrid securities, share some equity-like and some debt-like characteristics. Nevertheless, since 2013 the interest for the instrument has grown rapidly and ha...

2. Hybrid XRF

International Nuclear Information System (INIS)

Heckel, J.

2002-01-01

Full text: In the last 10 years significant innovations of EDXRF, e.g. total reflection XRF or polarized beam XRF, were utilized in different industrial applications. The decrease of background within the spectra was the goal of these developments. Excellent detection limits and sensitivities demonstrate the success of these new techniques. Nevertheless, further improvements are possible by using Si drift detectors. These detectors allow the processing of input count rates up to 10 6 cps in comparison to 10 5 of Si(Li) detectors. New excitation optics are necessary to produce such count rates. One possibility is the use of doubly curved crystals between tube and sample. These crystals enable the reflection of the primary beam within the given solid angle (0.4π) of an end window tube to the sample. Using such brightness optics excellent sensitivities mainly for light elements are achievable. The combination of a BRAGG crystal as a wavelength dispersive component and a solid state detector as an energy dispersive component creates a new technique: hybrid XRF. Copyright (2002) Australian X-ray Analytical Association Inc. Copyright (2002) Australian X-ray Analytical Association Inc

3. Higher-Order Hybrid Gaussian Kernel in Meshsize Boosting Algorithm

African Journals Online (AJOL)

In this paper, we shall use higher-order hybrid Gaussian kernel in a meshsize boosting algorithm in kernel density estimation. Bias reduction is guaranteed in this scheme like other existing schemes but uses the higher-order hybrid Gaussian kernel instead of the regular fixed kernels. A numerical verification of this scheme ...

4. Stomatal characteristics of Eucalyptus grandis clonal hybrids in ...

African Journals Online (AJOL)

This study describes the stomatal response occurring during water stress and subsequent recovery of three Eucalyptus grandis clonal hybrids. The aim was to investigate the degree to which stomatal conductance (gs) and stomatal density differ between the clonal hybrids across seasons and in response to water stress.

5. Preparation and properties of recycled HDPE/clay hybrids

Science.gov (United States)

Yong Lei; Qinglin Wu; Craig M. Clemons

2007-01-01

Hybrids based on recycled high density polyethylene (RHDPE) and organic clay were made by melt compounding. The influence of blending method, compatibilizers, and clay content on clay intercalation and exfoliation, RHDPE crystallization behavior, and the mechanical properties of RHDPE/clay hybrids were investigated. Both maleated polyethylene (MAPE) and titanate could...

6. Fast Ion Redistribution and Implications for the Hybrid Regime

International Nuclear Information System (INIS)

Nazikian, R.; Austin, M.E.; Budny, R.V.; Chu, M.S.; Heidbrink, W.W.; Makowski, M.A.; Petty, C.C.; Politzer, P.A.; Solomon, W.M.; Van Zeeland, M.A.

2007-01-01

Time dependent TRANSP analysis indicates that radial redistribution of fast ions is unlikely to affect the central current density in hybrid plasmas sufficient to raise q(0) above unity. The results suggest that some other mechanism other than fast ion transport must be involved in raising q(0) and preventing sawteeth in hybrid plasmas.

7. Hybrid mimics and hybrid vigor in Arabidopsis

Science.gov (United States)

Wang, Li; Greaves, Ian K.; Groszmann, Michael; Wu, Li Min; Dennis, Elizabeth S.; Peacock, W. James

2015-01-01

F1 hybrids can outperform their parents in yield and vegetative biomass, features of hybrid vigor that form the basis of the hybrid seed industry. The yield advantage of the F1 is lost in the F2 and subsequent generations. In Arabidopsis, from F2 plants that have a F1-like phenotype, we have by recurrent selection produced pure breeding F5/F6 lines, hybrid mimics, in which the characteristics of the F1 hybrid are stabilized. These hybrid mimic lines, like the F1 hybrid, have larger leaves than the parent plant, and the leaves have increased photosynthetic cell numbers, and in some lines, increased size of cells, suggesting an increased supply of photosynthate. A comparison of the differentially expressed genes in the F1 hybrid with those of eight hybrid mimic lines identified metabolic pathways altered in both; these pathways include down-regulation of defense response pathways and altered abiotic response pathways. F6 hybrid mimic lines are mostly homozygous at each locus in the genome and yet retain the large F1-like phenotype. Many alleles in the F6 plants, when they are homozygous, have expression levels different to the level in the parent. We consider this altered expression to be a consequence of transregulation of genes from one parent by genes from the other parent. Transregulation could also arise from epigenetic modifications in the F1. The pure breeding hybrid mimics have been valuable in probing the mechanisms of hybrid vigor and may also prove to be useful hybrid vigor equivalents in agriculture. PMID:26283378

8. SU-D-16A-03: A Radiation Pneumonitis Dose-Response Model Incorporating Non- Local Radiation-Induced Bystander Effect

International Nuclear Information System (INIS)

Gordon, J; Snyder, K; Zhong, H; Chetty, I

2014-01-01

Purpose: Dose-response models that can reliably predict radiation pneumonitis (RP) to guide radiation therapy (RT) for lung cancer presently do not exist. A model is proposed that incorporates non-local radiationinduced bystander effect (RIBE). Methods: A single sigmoid response function, derived from published data for whole lung irradiation, relates RP probability to cumulative lung damage, regardless of fractionation scheme. Lung damage is assumed to be caused by direct local radiation damage, quantified via the linear-quadratic (LQ) model, and RIBE. Based on published data, RIBE is assumed to be activated when per-fraction dose rises above ∼0.6 Gy, but is constant with dose above that threshold. Integral RIBE damage is assumed proportional to lung volume irradiated above ∼0.6 Gy per fraction. Key model parameters include LQ α and β, and two RIBE parameters: the single-fraction probability δ of damage, and a proportionality parameter κ that relates the potential for RIBE damage to irradiated lung volume. All parameters are tentatively fitted from published data, the RIBE parameters from published RP rates for conventionally fractionated RT (CFRT) and stereotactic body RT (SBRT). Results: The model predicts dose-response curves that are consistent with clinical experience. It provides a tentative explanation for why V20 (33 fractions), V13 (20 fractions) and V5 (<10 fractions) are observed to be correlated with RP. It also provides a plausible explanation for the success of SBRT — RIBE damage increases with the number of fractions, so penalizes CFRT relative to SBRT. Conclusion: The proposed model is relatively simple, extrapolates from published data, plausibly explains several clinical observations, and produces dose-response curves that are consistent with clinical experience. While capable of elaboration, its ability to explain doseresponse experience with different fractionation schemes using a small number of assumptions and parameters is an

9. SU-D-16A-03: A Radiation Pneumonitis Dose-Response Model Incorporating Non- Local Radiation-Induced Bystander Effect

Energy Technology Data Exchange (ETDEWEB)

Gordon, J; Snyder, K; Zhong, H; Chetty, I [Henry Ford Health System, Dept. Radiation Oncology, Detroit, MI (United States)

2014-06-01

Purpose: Dose-response models that can reliably predict radiation pneumonitis (RP) to guide radiation therapy (RT) for lung cancer presently do not exist. A model is proposed that incorporates non-local radiationinduced bystander effect (RIBE). Methods: A single sigmoid response function, derived from published data for whole lung irradiation, relates RP probability to cumulative lung damage, regardless of fractionation scheme. Lung damage is assumed to be caused by direct local radiation damage, quantified via the linear-quadratic (LQ) model, and RIBE. Based on published data, RIBE is assumed to be activated when per-fraction dose rises above ∼0.6 Gy, but is constant with dose above that threshold. Integral RIBE damage is assumed proportional to lung volume irradiated above ∼0.6 Gy per fraction. Key model parameters include LQ α and β, and two RIBE parameters: the single-fraction probability δ of damage, and a proportionality parameter κ that relates the potential for RIBE damage to irradiated lung volume. All parameters are tentatively fitted from published data, the RIBE parameters from published RP rates for conventionally fractionated RT (CFRT) and stereotactic body RT (SBRT). Results: The model predicts dose-response curves that are consistent with clinical experience. It provides a tentative explanation for why V20 (33 fractions), V13 (20 fractions) and V5 (<10 fractions) are observed to be correlated with RP. It also provides a plausible explanation for the success of SBRT — RIBE damage increases with the number of fractions, so penalizes CFRT relative to SBRT. Conclusion: The proposed model is relatively simple, extrapolates from published data, plausibly explains several clinical observations, and produces dose-response curves that are consistent with clinical experience. While capable of elaboration, its ability to explain doseresponse experience with different fractionation schemes using a small number of assumptions and parameters is an

10. A non-local thermodynamical equilibrium line formation for neutral and singly ionized titanium in model atmospheres of reference A-K stars

Science.gov (United States)

Sitnova, T. M.; Mashonkina, L. I.; Ryabchikova, T. A.

2016-09-01

We construct a model atom for Ti I-II using more than 3600 measured and predicted energy levels of Ti I and 1800 energy levels of Ti II, and quantum mechanical photoionization cross-sections. Non-local thermodynamical equilibrium (NLTE) line formation for Ti I and Ti II is treated through a wide range of spectral types from A to K, including metal-poor stars with [Fe/H] down to -2.6 dex. NLTE leads to weakened Ti I lines and positive abundance corrections. The magnitude of NLTE corrections is smaller compared to the literature data for FGK atmospheres. NLTE leads to strengthened Ti II lines and negative NLTE abundance corrections. For the first time, we have performed NLTE calculations for Ti I-II in the 6500 ≤ Teff ≤ 13 000 K range. For four A-type stars, we derived in LTE an abundance discrepancy of up to 0.22 dex between Ti I and Ti II, which vanishes in NLTE. For four other A-B stars, with only Ti II lines observed, NLTE leads to a decrease of line-to-line scatter. An efficiency of inelastic Ti I + H I collisions was estimated from an analysis of Ti I and Ti II lines in 17 cool stars with -2.6 ≤ [Fe/H] ≤ 0.0. Consistent NLTE abundances from Ti I and Ti II were obtained by applying classical Drawinian rates for the stars with log g ≥ 4.1, and neglecting inelastic collisions with H I for the very metal-poor (VMP) giant HD 122563. For the VMP turn-off stars ([Fe/H] ≤ -2 and log g ≤ 4.1), we obtained the positive abundance difference Ti I-II already in LTE, which increases in NLTE. Accurate collisional data for Ti I and Ti II are necessary to help solve this problem.

11. Self-consistent density functional calculation of the image potential at a metal surface

International Nuclear Information System (INIS)

Jung, J; Alvarellos, J E; Chacon, E; GarcIa-Gonzalez, P

2007-01-01

It is well known that the exchange-correlation (XC) potential at a metal surface has an image-like asymptotic behaviour given by -1/4(z-z 0 ), where z is the coordinate perpendicular to the surface. Using a suitable fully non-local functional prescription, we evaluate self-consistently the XC potential with the correct image behaviour for simple jellium surfaces in the range of metallic densities. This allows a proper comparison between the corresponding image-plane position, z 0 , and other related quantities such as the centroid of an induced charge by an external perturbation. As a by-product, we assess the routinely used local density approximation when evaluating electron density profiles, work functions, and surface energies by focusing on the XC effects included in the fully non-local description

12. Self-consistent density functional calculation of the image potential at a metal surface

Energy Technology Data Exchange (ETDEWEB)

2007-07-04

It is well known that the exchange-correlation (XC) potential at a metal surface has an image-like asymptotic behaviour given by -1/4(z-z{sub 0}), where z is the coordinate perpendicular to the surface. Using a suitable fully non-local functional prescription, we evaluate self-consistently the XC potential with the correct image behaviour for simple jellium surfaces in the range of metallic densities. This allows a proper comparison between the corresponding image-plane position, z{sub 0}, and other related quantities such as the centroid of an induced charge by an external perturbation. As a by-product, we assess the routinely used local density approximation when evaluating electron density profiles, work functions, and surface energies by focusing on the XC effects included in the fully non-local description.

13. Hybrid power source

Science.gov (United States)

Singh, Harmohan N.

2012-06-05

A hybrid power system is comprised of a high energy density element such as a fuel-cell and high power density elements such as a supercapacitor banks. A DC/DC converter electrically connected to the fuel cell and converting the energy level of the energy supplied by the fuel cell. A first switch is electrically connected to the DC/DC converter. First and second supercapacitors are electrically connected to the first switch and a second switch. A controller is connected to the first switch and the second switch, monitoring charge levels of the supercapacitors and controls the switching in response to the charge levels. A load is electrically connected to the second switch. The first switch connects the DC/DC converter to the first supercapacitor when the second switch connects the second supercapacitor to the load. The first switch connects the DC/DC converter to the second supercapacitor when the second switch connects the first supercapacitor to the load.

14. Identifying the distinct features of geometric structures for hole trapping to generate radicals on rutile TiO₂(110) in photooxidation using density functional theory calculations with hybrid functional.

Science.gov (United States)

Wang, Dong; Wang, Haifeng; Hu, P

2015-01-21

Using density functional theory calculations with HSE 06 functional, we obtained the structures of spin-polarized radicals on rutile TiO2(110), which is crucial to understand the photooxidation at the atomic level, and further calculate the thermodynamic stabilities of these radicals. By analyzing the results, we identify the structural features for hole trapping in the system, and reveal the mutual effects among the geometric structures, the energy levels of trapped hole states and their hole trapping capacities. Furthermore, the results from HSE 06 functional are compared to those from DFT + U and the stability trend of radicals against the number of slabs is tested. The effect of trapped holes on two important steps of the oxygen evolution reaction, i.e. water dissociation and the oxygen removal, is investigated and discussed.

15. Boron/aluminum graphite/resin advanced fiber composite hybrids

Science.gov (United States)

Chamis, C. C.; Lark, R. F.; Sullivan, T. L.

1975-01-01

Fabrication feasibility and potential of an adhesively bonded metal and resin matrix fiber-composite hybrid are determined as an advanced material for aerospace and other structural applications. The results show that using this hybrid concept makes possible a composite design which, when compared with nonhybrid composites, has greater transverse strength, transverse stiffness, and impact resistance with only a small penalty on density and longitudinal properties. The results also show that laminate theory is suitable for predicting the structural response of such hybrids. The sequence of fracture modes indicates that these types of hybrids can be readily designed to meet fail-safe requirements.

16. Factorization and non-local 1/m{sub b} corrections in the decay anti B {yields} X{sub s}{gamma}

Energy Technology Data Exchange (ETDEWEB)

Benzke, Michael

2011-06-10

In this thesis, a systematic analysis of the anti B {yields} X{sub s}{gamma} photon spectrum in the endpoint region is presented. The endpoint region refers to a kinematic configuration of the final state, in which the photon has a large energy m{sub b}-2E{sub {gamma}}=O({lambda}{sub QCD}), while the jet has a large energy but small invariant mass. Using methods of soft-collinear effective theory and heavy-quark effective theory, it is shown that the spectrum can be factorized into hard, jet, and soft functions, each encoding the dynamics at a certain scale. The relevant scales in the endpoint region are the heavy-quark mass m{sub b}, the hadronic energy scale {lambda}{sub QCD} and an intermediate scale {radical}({lambda}{sub QCD}m{sub b}) associated with the invariant mass of the jet. It is found that the factorization formula contains two different types of contributions, distinguishable by the space-time structure of the underlying diagrams. On the one hand, there are the direct photon contributions which correspond to diagrams with the photon emitted directly from the weak vertex. The resolved photon contributions on the other hand arise at O(1/m{sub b}) whenever the photon couples to light partons. In this work, these contributions are explicitly defined in terms of convolutions of jet functions with subleading shape functions. While the direct photon contributions can be expressed in terms of a local operator product expansion, when the photon spectrum is integrated over a range larger than the endpoint region, the resolved photon contributions always remain non-local. Thus, they are responsible for a non-perturbative uncertainty on the partonic predictions. In this thesis, the effect of these uncertainties is estimated in two different phenomenological contexts. First, the hadronic uncertainties in the anti B {yields} X{sub s}{gamma} branching fraction, defined with a cut E{sub {gamma}} > 1.6GeV are discussed. It is found, that the resolved photon

17. Hybrid Management in Hospitals

DEFF Research Database (Denmark)

Byrkjeflot, Haldor; Jespersen, Peter Kragh

2010-01-01

Artiklen indeholder et litteraturbaseret studium af ledelsesformer i sygehuse, hvor sundhedsfaglig ledelse og generel ledelse mikses til hybride ledelsesformer......Artiklen indeholder et litteraturbaseret studium af ledelsesformer i sygehuse, hvor sundhedsfaglig ledelse og generel ledelse mikses til hybride ledelsesformer...

18. Hydraulic Hybrid Vehicles

Science.gov (United States)

EPA and the United Parcel Service (UPS) have developed a hydraulic hybrid delivery vehicle to explore and demonstrate the environmental benefits of the hydraulic hybrid for urban pick-up and delivery fleets.

19. Mesoscale hybrid calibration artifact

Science.gov (United States)

Tran, Hy D.; Claudet, Andre A.; Oliver, Andrew D.

2010-09-07

A mesoscale calibration artifact, also called a hybrid artifact, suitable for hybrid dimensional measurement and the method for make the artifact. The hybrid artifact has structural characteristics that make it suitable for dimensional measurement in both vision-based systems and touch-probe-based systems. The hybrid artifact employs the intersection of bulk-micromachined planes to fabricate edges that are sharp to the nanometer level and intersecting planes with crystal-lattice-defined angles.

20. Exchange-correlation energies of atoms from efficient density functionals: influence of the electron density

Science.gov (United States)

Tao, Jianmin; Ye, Lin-Hui; Duan, Yuhua

2017-12-01

The primary goal of Kohn-Sham density functional theory is to evaluate the exchange-correlation contribution to electronic properties. However, the accuracy of a density functional can be affected by the electron density. Here we apply the nonempirical Tao-Mo (TM) semilocal functional to study the influence of the electron density on the exchange and correlation energies of atoms and ions, and compare the results with the commonly used nonempirical semilocal functionals local spin-density approximation (LSDA), Perdew-Burke-Ernzerhof (PBE), Tao-Perdew-Staroverov-Scuseria (TPSS), and hybrid functional PBE0. We find that the spin-restricted Hartree-Fock density yields the exchange and correlation energies in good agreement with the Optimized Effective Potential method, particularly for spherical atoms and ions. However, the errors of these semilocal and hybrid functionals become larger for self-consistent densities. We further find that the quality of the electron density have greater effect on the exchange-correlation energies of kinetic energy density-dependent meta-GGA functionals TPSS and TM than on those of the LSDA and GGA, and therefore, should have greater influence on the performance of meta-GGA functionals. Finally, we show that the influence of the density quality on PBE0 is slightly reduced, compared to that of PBE, due to the exact mixing.

1. Graphene hybridization for energy storage applications.

Science.gov (United States)

Li, Xianglong; Zhi, Linjie

2018-05-08

Graphene has attracted considerable attention due to its unique two-dimensional structure, high electronic mobility, exceptional thermal conductivity, excellent optical transmittance, good mechanical strength, and ultrahigh surface area. To meet the ever increasing demand for portable electronic products, electric vehicles, smart grids, and renewable energy integrations, hybridizing graphene with various functions and components has been demonstrated to be a versatile and powerful strategy to significantly enhance the performance of various energy storage systems such as lithium-ion batteries, supercapacitors and beyond, because such hybridization can result in synergistic effects that combine the best merits of involved components and confer new functions and properties, thereby improving the charge/discharge efficiencies and capabilities, energy/power densities, and cycle life of these energy storage systems. This review will focus on diverse graphene hybridization principles and strategies for energy storage applications, and the proposed outline is as follows. First, graphene and its fundamental properties, followed by graphene hybrids and related hybridization motivation, are introduced. Second, the developed hybridization formulas of using graphene for lithium-ion batteries are systematically categorized from the viewpoint of material structure design, bulk electrode construction, and material/electrode collaborative engineering; the latest representative progress on anodes and cathodes of lithium-ion batteries will be reviewed following such classifications. Third, similar hybridization formulas for graphene-based supercapacitor electrodes will be summarized and discussed as well. Fourth, the recently emerging hybridization formulas for other graphene-based energy storage devices will be briefed in combination with typical examples. Finally, future prospects and directions on the exploration of graphene hybridization toward the design and construction of

2. Hybrid quantum information processing

Energy Technology Data Exchange (ETDEWEB)

Furusawa, Akira [Department of Applied Physics, School of Engineering, The University of Tokyo (Japan)

2014-12-04

I will briefly explain the definition and advantage of hybrid quantum information processing, which is hybridization of qubit and continuous-variable technologies. The final goal would be realization of universal gate sets both for qubit and continuous-variable quantum information processing with the hybrid technologies. For that purpose, qubit teleportation with a continuousvariable teleporter is one of the most important ingredients.

3. Hybrid Model of Content Extraction

DEFF Research Database (Denmark)

Qureshi, Pir Abdul Rasool; Memon, Nasrullah

2012-01-01

We present a hybrid model for content extraction from HTML documents. The model operates on Document Object Model (DOM) tree of the corresponding HTML document. It evaluates each tree node and associated statistical features like link density and text distribution across the node to predict...... significance of the node towards overall content provided by the document. Once significance of the nodes is determined, the formatting characteristics like fonts, styles and the position of the nodes are evaluated to identify the nodes with similar formatting as compared to the significant nodes. The proposed...

4. Generation of auroral kilometric radiation in upper hybrid wave-lower hybrid soliton interaction

International Nuclear Information System (INIS)

Pottelette, R.; Dubouloz, N.; Treumann, R.A.

1992-01-01

Sporadic bursts of auroral kilometric radiation (AKR) associated with strong bursty electrostatic turbulence in the vicinity of the lower hybrid frequency have been frequently recorded in the AKR source region by the Viking satellite. The variation time scale of these emissions is typically 1 s, long enough for lower hybrid waves to grow to amplitudes of several hundred millivolts per meter and to evolve nonlinearly into solitons. On the basis on these observations it is suggested that formation of lower hybrid solitons may play a role in the generation of AKR. A theoretical model is proposed which is based on the direct acceleration of electrons in the combined lower hybrid soliton and upper hybrid wave fields. The solitons act as sporadic, localized antennas allowing for efficient conversions of the electrostatic energy stored in upper hybrid waves into electromagnetic radiation at a frequency above the X mode cutoff. Excitation of lower hybrid waves is due to the presence of energetic electron beams in the auroral zone found to be associated with steep plasma density gradients. Upper hybrid waves can be excited by a population of energetic electrons with loss cone distributions. The power of the electromagnetic radiation obtained is only noticeable in regions where the plasma frequency is less than the electron gyrofrequency. The theory predicts spectral power densities of the order of 10 -11 to 10 -9 W m -2 Hz -1 in the source region, in good agreement with the Viking observations. The sporadic nature of the radiation derives from lower hybrid soliton collapses which occur on ∼1-s time scales

5. Learning Mixtures of Polynomials of Conditional Densities from Data

DEFF Research Database (Denmark)

L. López-Cruz, Pedro; Nielsen, Thomas Dyhre; Bielza, Concha

2013-01-01

Mixtures of polynomials (MoPs) are a non-parametric density estimation technique for hybrid Bayesian networks with continuous and discrete variables. We propose two methods for learning MoP ap- proximations of conditional densities from data. Both approaches are based on learning MoP approximatio...

6. Gravity localization on hybrid branes

Directory of Open Access Journals (Sweden)

D.F.S. Veras

2016-03-01

Full Text Available This work deals with gravity localization on codimension-1 brane worlds engendered by compacton-like kinks, the so-called hybrid branes. In such scenarios, the thin brane behavior is manifested when the extra dimension is outside the compact domain, where the energy density is non-trivial, instead of asymptotically as in the usual thick brane models. The zero mode is trapped in the brane, as required. The massive modes, although not localized in the brane, have important phenomenological implications such as corrections to the Newton's law. We study such corrections in the usual thick domain wall and in the hybrid brane scenarios. By means of suitable numerical methods, we attain the mass spectrum for the graviton and the corresponding wavefunctions. The spectra possess the usual linearly increasing behavior from the Kaluza–Klein theories. Further, we show that the 4D gravitational force is slightly increased at short distances. The first eigenstate contributes highly for the correction to the Newton's law. The subsequent normalized solutions have diminishing contributions. Moreover, we find out that the phenomenology of the hybrid brane is not different from the usual thick domain wall. The use of numerical techniques for solving the equations of the massive modes is useful for matching possible phenomenological measurements in the gravitational law as a probe to warped extra dimensions.

7. Vibration Isolation for Parallel Hydraulic Hybrid Vehicles

Directory of Open Access Journals (Sweden)

The M. Nguyen

2008-01-01

Full Text Available In recent decades, several types of hybrid vehicles have been developed in order to improve the fuel economy and to reduce the pollution. Hybrid electric vehicles (HEV have shown a significant improvement in fuel efficiency for small and medium-sized passenger vehicles and SUVs. HEV has several limitations when applied to heavy vehicles; one is that larger vehicles demand more power, which requires significantly larger battery capacities. As an alternative solution, hydraulic hybrid technology has been found effective for heavy duty vehicle because of its high power density. The mechanical batteries used in hydraulic hybrid vehicles (HHV can be charged and discharged remarkably faster than chemical batteries. This feature is essential for heavy vehicle hybridization. One of the main problems that should be solved for the successful commercialization of HHV is the excessive noise and vibration involving with the hydraulic systems. This study focuses on using magnetorheological (MR technology to reduce the noise and vibration transmissibility from the hydraulic system to the vehicle body. In order to study the noise and vibration of HHV, a hydraulic hybrid subsystem in parallel design is analyzed. This research shows that the MR elements play an important role in reducing the transmitted noise and vibration to the vehicle body. Additionally, locations and orientations of the isolation system also affect the efficiency of the noise and vibration mitigation. In simulations, a skyhook control algorithm is used to achieve the highest possible effectiveness of the MR isolation system.

8. Marine Fish Hybridization

KAUST Repository

He, Song

2017-04-01

Natural hybridization is reproduction (without artificial influence) between two or more species/populations which are distinguishable from each other by heritable characters. Natural hybridizations among marine fishes were highly underappreciated due to limited research effort; it seems that this phenomenon occurs more often than is commonly recognized. As hybridization plays an important role in biodiversity processes in the marine environment, detecting hybridization events and investigating hybridization is important to understand and protect biodiversity. The first chapter sets the framework for this disseration study. The Cohesion Species Concept was selected as the working definition of a species for this study as it can handle marine fish hybridization events. The concept does not require restrictive species boundaries. A general history and background of natural hybridization in marine fishes is reviewed during in chapter as well. Four marine fish hybridization cases were examed and documented in Chapters 2 to 5. In each case study, at least one diagnostic nuclear marker, screened from among ~14 candidate markers, was found to discriminate the putative hybridizing parent species. To further investigate genetic evidence to support the hybrid status for each hybrid offspring in each case, haploweb analysis on diagnostic markers (nuclear and/or mitochondrial) and the DAPC/PCA analysis on microsatellite data were used. By combining the genetic evidences, morphological traits, and ecological observations together, the potential reasons that triggered each hybridization events and the potential genetic/ecology effects could be discussed. In the last chapter, sequences from 82 pairs of hybridizing parents species (for which COI barcoding sequences were available either on GenBank or in our lab) were collected. By comparing the COI fragment p-distance between each hybridizing parent species, some general questions about marine fish hybridization were discussed: Is

9. Seed yield and protein content in sunflower depending on stand density

Directory of Open Access Journals (Sweden)

Balalić Igor M.

2016-01-01

Full Text Available The aim of this research was to investigate the effect of stand density on seed yield and protein content in sunflower hybrids. The field experiment was carried out at Rimski Šančevi location. Six NS sunflower hybrids were examined. Five hybrids are confectionery (NS Goliat, NS Slatki, NS Gricko, Vranac and Cepko, and one is used for bird food (NS-H-6485. The trial was arranged as randomized complete block design (RCBD with four replications. Sowing was done with six different densities (from 20,000 to 70,000 plants per hectare, with an increment of 10,000 plants per hectare. Analysis of variance (ANOVA showed that the effect of hybrid, stand density and hybrid × stand density interation were highly significant for seed yield and protein content. The highest seed yield, on the basis of average for all densities, was found in NS-H-6485 (4.77 t ha-1 and in NS Gricko (4.43 t ha-1. Average seed yield of hybrids significantly increased up to 50,000 plants per ha-1, when it reached the value of 4.50 t ha-1, and then decreased. Significantly higher protein content, taking into account all stand densities, showed hybrid Cepko (16.94%. Protein content, above the overall average value, was achieved in hybrid Vranac (16.11%. The high­est protein content in the average for all six hybrids was at the lowest stand density (20,000 plants per ha-1, and then decreased up to higher densities. The results showed that stand density had significant effect on seed yield and protein content in sunflower hybrids. [Projekat Ministarstva nauke Republike Srbije, br. TR31025: The development of new cultivars and improving the technology of producing oil plant species for different purposes

10. Henkin and Hybrid Logic

DEFF Research Database (Denmark)

Blackburn, Patrick Rowan; Huertas, Antonia; Manzano, Maria

2014-01-01

Leon Henkin was not a modal logician, but there is a branch of modal logic that has been deeply influenced by his work. That branch is hybrid logic, a family of logics that extend orthodox modal logic with special proposition symbols (called nominals) that name worlds. This paper explains why...... Henkin’s techniques are so important in hybrid logic. We do so by proving a completeness result for a hybrid type theory called HTT, probably the strongest hybrid logic that has yet been explored. Our completeness result builds on earlier work with a system called BHTT, or basic hybrid type theory...... is due to the first-order perspective, which lies at the heart of Henin’s best known work and hybrid logic....

11. Hybrid Action Systems

DEFF Research Database (Denmark)

Ronkko, Mauno; Ravn, Anders P.

1997-01-01

a differential action, which allows differential equations as primitive actions. The extension allows us to model hybrid systems with both continuous and discrete behaviour. The main result of this paper is an extension of such a hybrid action system with parallel composition. The extension does not change...... the original meaning of the parallel composition, and therefore also the ordinary action systems can be composed in parallel with the hybrid action systems....

12. Nanoscale Organic Hybrid Electrolytes

KAUST Repository

Nugent, Jennifer L.

2010-08-20

Nanoscale organic hybrid electrolytes are composed of organic-inorganic hybrid nanostructures, each with a metal oxide or metallic nanoparticle core densely grafted with an ion-conducting polyethylene glycol corona - doped with lithium salt. These materials form novel solvent-free hybrid electrolytes that are particle-rich, soft glasses at room temperature; yet manifest high ionic conductivity and good electrochemical stability above 5V. © 2010 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

13. Nanoscale Organic Hybrid Electrolytes

KAUST Repository

Nugent, Jennifer L.; Moganty, Surya S.; Archer, Lynden A.

2010-01-01

Nanoscale organic hybrid electrolytes are composed of organic-inorganic hybrid nanostructures, each with a metal oxide or metallic nanoparticle core densely grafted with an ion-conducting polyethylene glycol corona - doped with lithium salt. These materials form novel solvent-free hybrid electrolytes that are particle-rich, soft glasses at room temperature; yet manifest high ionic conductivity and good electrochemical stability above 5V. © 2010 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

14. HYBRID VEHICLE CONTROL SYSTEM

Directory of Open Access Journals (Sweden)

2016-06-01

Full Text Available The hybrid vehicle control system includes a start–stop system for an internal combustion engine. The system works in a hybrid mode and normal vehicle operation. To simplify the start–stop system, there were user new possibilities of a hybrid car, which appeared after the conversion. Results of the circuit design of the proposed system of basic blocks are analyzed.

Science.gov (United States)

France, David M.; Smith, David S.; Yu, Wenhua; Routbort, Jules L.

2016-03-15

A method and hybrid radiator-cooling apparatus for implementing enhanced radiator-cooling are provided. The hybrid radiator-cooling apparatus includes an air-side finned surface for air cooling; an elongated vertically extending surface extending outwardly from the air-side finned surface on a downstream air-side of the hybrid radiator; and a water supply for selectively providing evaporative cooling with water flow by gravity on the elongated vertically extending surface.

16. Toronto hybrid taxi pilot

Energy Technology Data Exchange (ETDEWEB)

Stevens, M. [CrossChasm Technologies, Cambridge, ON (Canada); Marans, B. [Toronto Atmospheric Fund, ON (Canada)

2009-10-15

This paper provided details of a hybrid taxi pilot program conducted to compare the on-road performance of Toyota Camry hybrid vehicles against conventional vehicles over a 1-year period in order to determine the business case and air emission reductions associated with the use of hybrid taxi cabs. Over 750,000 km worth of fuel consumption was captured from 10 Toyota Camry hybrids, a Toyota Prius, and 5 non-hybrid Camry vehicles over an 18-month period. The average real world fuel consumption for the taxis demonstrated that the Toyota Prius has the lowest cost of ownership, while the non-hybrid Camry has the highest cost of ownership. Carbon dioxide (CO{sub 2}) reductions associated with the 10 Camry hybrid taxis were calculated at 236 tonnes over a 7-year taxi service life. Results suggested that the conversion of Toronto's 5680 taxis would yield annual CO{sub 2} emission reductions of over 19,000 tonnes. All hybrid purchasers identified themselves as highly likely to purchase a hybrid again. 5 tabs., 9 figs.

17. Managing hybrid marketing systems.

Science.gov (United States)

Moriarty, R T; Moran, U

1990-01-01

As competition increases and costs become critical, companies that once went to market only one way are adding new channels and using new methods - creating hybrid marketing systems. These hybrid marketing systems hold the promise of greater coverage and reduced costs. But they are also hard to manage; they inevitably raise questions of conflict and control: conflict because marketing units compete for customers; control because new indirect channels are less subject to management authority. Hard as they are to manage, however, hybrid marketing systems promise to become the dominant design, replacing the "purebred" channel strategy in all kinds of businesses. The trick to managing the hybrid is to analyze tasks and channels within and across a marketing system. A map - the hybrid grid - can help managers make sense of their hybrid system. What the chart reveals is that channels are not the basic building blocks of a marketing system; marketing tasks are. The hybrid grid forces managers to consider various combinations of channels and tasks that will optimize both cost and coverage. Managing conflict is also an important element of a successful hybrid system. Managers should first acknowledge the inevitability of conflict. Then they should move to bound it by creating guidelines that spell out which customers to serve through which methods. Finally, a marketing and sales productivity (MSP) system, consisting of a central marketing database, can act as the central nervous system of a hybrid marketing system, helping managers create customized channels and service for specific customer segments.

18. Toronto hybrid taxi pilot

International Nuclear Information System (INIS)

Stevens, M.; Marans, B.

2009-10-01

This paper provided details of a hybrid taxi pilot program conducted to compare the on-road performance of Toyota Camry hybrid vehicles against conventional vehicles over a 1-year period in order to determine the business case and air emission reductions associated with the use of hybrid taxi cabs. Over 750,000 km worth of fuel consumption was captured from 10 Toyota Camry hybrids, a Toyota Prius, and 5 non-hybrid Camry vehicles over an 18-month period. The average real world fuel consumption for the taxis demonstrated that the Toyota Prius has the lowest cost of ownership, while the non-hybrid Camry has the highest cost of ownership. Carbon dioxide (CO 2 ) reductions associated with the 10 Camry hybrid taxis were calculated at 236 tonnes over a 7-year taxi service life. Results suggested that the conversion of Toronto's 5680 taxis would yield annual CO 2 emission reductions of over 19,000 tonnes. All hybrid purchasers identified themselves as highly likely to purchase a hybrid again. 5 tabs., 9 figs.

19. Hybrid FOSS Project

Data.gov (United States)

National Aeronautics and Space Administration — Armstrong researchers are continuing their efforts to further develop FOSS technologies. A hybrid FOSS technique (HyFOSS) employs conventional continuous grating...

20. From hybrid swarms to swarms of hybrids

Science.gov (United States)

Stohlgren, Thomas J.; Szalanski, Allen L; Gaskin, John F.; Young, Nicholas E.; West, Amanda; Jarnevich, Catherine S.; Tripodi, Amber

2014-01-01

Science has shown that the introgression or hybridization of modern humans (Homo sapiens) with Neanderthals up to 40,000 YBP may have led to the swarm of modern humans on earth. However, there is little doubt that modern trade and transportation in support of the humans has continued to introduce additional species, genotypes, and hybrids to every country on the globe. We assessed the utility of species distributions modeling of genotypes to assess the risk of current and future invaders. We evaluated 93 locations of the genus Tamarix for which genetic data were available. Maxent models of habitat suitability showed that the hybrid, T. ramosissima x T. chinensis, was slightly greater than the parent taxa (AUCs > 0.83). General linear models of Africanized honey bees, a hybrid cross of Tanzanian Apis mellifera scutellata and a variety of European honey bee including A. m. ligustica, showed that the Africanized bees (AUC = 0.81) may be displacing European honey bees (AUC > 0.76) over large areas of the southwestern U.S. More important, Maxent modeling of sub-populations (A1 and A26 mitotypes based on mDNA) could be accurately modeled (AUC > 0.9), and they responded differently to environmental drivers. This suggests that rapid evolutionary change may be underway in the Africanized bees, allowing the bees to spread into new areas and extending their total range. Protecting native species and ecosystems may benefit from risk maps of harmful invasive species, hybrids, and genotypes.