The local projection in the density functional theory plus U approach: A critical assessment.
Wang, Yue-Chao; Chen, Ze-Hua; Jiang, Hong
2016-04-14
Density-functional theory plus the Hubbard U correction (DFT + U) method is widely used in first-principles studies of strongly correlated systems, as it can give qualitatively (and sometimes, semi-quantitatively) correct description of energetic and structural properties of many strongly correlated systems with similar computational cost as local density approximation or generalized gradient approximation. On the other hand, the DFT + U approach is limited both theoretically and practically in several important aspects. In particular, the results of DFT + U often depend on the choice of local orbitals (the local projection) defining the subspace in which the Hubbard U correction is applied. In this work we have systematically investigated the issue of the local projection by considering typical transition metal oxides, β-MnO2 and MnO, and comparing the results obtained from different implementations of DFT + U. We found that the choice of the local projection has significant effects on the DFT + U results, which are more significant for systems with stronger covalent bonding (e.g., MnO2) than those with more ionic bonding (e.g., MnO). These findings can help to clarify some confusion arising from the practical use of DFT + U and may also provide insights for the development of new first-principles approaches beyond DFT + U.
Veeder, G. J.
1974-01-01
An improved mass-luminosity relation for faint main-sequence stars derived from recently revised masses for some faint double stars is presented. The total local mass density is increased to nearly 0.2 solar masses per cu pc. This estimate is as large as the mass density required by Oort's (1965) dynamical analysis of stellar motions perpendicular to the galactic plane if the mass is concentrated in a narrow layer.
Van Sistine, Angela; Salzer, John J.; Sugden, Arthur; Giovanelli, Riccardo; Haynes, Martha P.; Janowiecki, Steven; Jaskot, Anne E.; Wilcots, Eric M.
2016-06-01
The ALFALFA Hα survey utilizes a large sample of H i-selected galaxies from the ALFALFA survey to study star formation (SF) in the local universe. ALFALFA Hα contains 1555 galaxies with distances between ˜20 and ˜100 Mpc. We have obtained continuum-subtracted narrowband Hα images and broadband R images for each galaxy, creating one of the largest homogeneous sets of Hα images ever assembled. Our procedures were designed to minimize the uncertainties related to the calculation of the local SF rate density (SFRD). The galaxy sample we constructed is as close to volume-limited as possible, is a robust statistical sample, and spans a wide range of galaxy environments. In this paper, we discuss the properties of our Fall sample of 565 galaxies, our procedure for deriving individual galaxy SF rates, and our method for calculating the local SFRD. We present a preliminary value of log(SFRD[M ⊙ yr-1 Mpc-3]) = -1.747 ± 0.018 (random) ±0.05 (systematic) based on the 565 galaxies in our Fall sub-sample. Compared to the weighted average of SFRD values around z ≈ 2, our local value indicates a drop in the global SFRD of a factor of 10.2 over that lookback time.
Bidin, C Moni; Carraro, G; Mendez, R A; Moyano, M
2014-01-01
In 2012, we applied a three-dimensional formulation to kinematic measurements of the Galactic thick disk and derived a surprisingly low dark matter density at the solar position. This result was challenged by Bovy & Tremaine (2012, ApJ, 756, 89), who claimed that the observational data are consistent with the expected dark matter density if a one-dimensional approach is adopted. We analyze the assumption at the bases of their formulation and their claim that this returns a lower limit for the local dark matter density, which is accurate within 20%. We find that the validity of their formulation depends on the underlying mass distribution. We therefore analyze the predictions that their hypothesis casts on the radial gradient of the azimuthal velocity dV/dR and compare it with observational data as a testbed for the validity of their formulation. We find that their hypothesis requires too steep a profile of dV(Z)/dR, which is inconsistent with the observational data both in the Milky Way and in external ga...
Read, J I
2014-01-01
I review current efforts to measure the mean density of dark matter near the Sun. This encodes valuable dynamical information about our Galaxy and is also of great importance for 'direct detection' dark matter experiments. I discuss theoretical expectations in our current cosmology; the theory behind mass modelling of the Galaxy; and I show how combining local and global measures probes the shape of the Milky Way dark matter halo and the possible presence of a 'dark disc'. I stress the strengths and weaknesses of different methodologies and highlight the continuing need for detailed tests on mock data - particularly in the light of recently discovered evidence for disequilibria in the Milky Way disc. I highlight several recent measurements in order of increasing data complexity and prior, and, correspondingly, decreasing formal error bars. Comparing these measurements with spherical extrapolations from the Milky Way's rotation curve, I show that the Milky Way is consistent with having a spherical dark matter ...
Lunar Localization System (LLS) Project
National Aeronautics and Space Administration — In support of NASA's vision for space, the goal of this project is to research and prototype a multi-component localization system which uses radiometry and vision...
Density estimation from local structure
Van der Walt, Christiaan M
2009-11-01
Full Text Available Mixture Model (GMM) density function of the data and the log-likelihood scores are compared to the scores of a GMM trained with the expectation maximization (EM) algorithm on 5 real-world classification datasets (from the UCI collection). They show...
Locality of correlation in density functional theory.
Burke, Kieron; Cancio, Antonio; Gould, Tim; Pittalis, Stefano
2016-08-07
The Hohenberg-Kohn density functional was long ago shown to reduce to the Thomas-Fermi (TF) approximation in the non-relativistic semiclassical (or large-Z) limit for all matter, i.e., the kinetic energy becomes local. Exchange also becomes local in this limit. Numerical data on the correlation energy of atoms support the conjecture that this is also true for correlation, but much less relevant to atoms. We illustrate how expansions around a large particle number are equivalent to local density approximations and their strong relevance to density functional approximations. Analyzing highly accurate atomic correlation energies, we show that EC → -AC ZlnZ + BCZ as Z → ∞, where Z is the atomic number, AC is known, and we estimate BC to be about 37 mhartree. The local density approximation yields AC exactly, but a very incorrect value for BC, showing that the local approximation is less relevant for the correlation alone. This limit is a benchmark for the non-empirical construction of density functional approximations. We conjecture that, beyond atoms, the leading correction to the local density approximation in the large-Z limit generally takes this form, but with BC a functional of the TF density for the system. The implications for the construction of approximate density functionals are discussed.
High Energy Density Capacitors Project
National Aeronautics and Space Administration — NASA?s future space science missions cannot be realized without the state of the art energy storage devices which require high energy density, high reliability, and...
Local density approximations from finite systems
Entwistle, Mike; Wetherell, Jack; Longstaff, Bradley; Ramsden, James; Godby, Rex
2016-01-01
The local density approximation (LDA) constructed through quantum Monte Carlo calculations of the homogeneous electron gas (HEG) is the most common approximation to the exchange-correlation functional in density functional theory. We introduce an alternative set of LDAs constructed from slab-like systems of one, two and three electrons that resemble the HEG within a finite region, and illustrate the concept in one dimension. Comparing with the exact densities and Kohn-Sham potentials for various test systems, we find that the LDAs give a good account of the self-interaction correction, but are less reliable when correlation is stronger or currents flow.
Limits on the local dark matter density
Read J.I.
2012-02-01
Full Text Available We study the systematic problems in determining the local dark matter density ρdm(R☉ from kinematics of stars in the Solar Neighbourhood, using a simulated Milky Way-like galaxy. We introduce a new unbiased method for recovering ρdm(R☉ based on the moments of the Jeans equations, combined with a Monte Carlo Markov Chain (MCMC technique and apply it to real data [1].
Limits on the local dark matter density
Garbari, Silvia; Lake, George
2011-01-01
We revisit systematics in determining the local dark matter density (rho_dm) from the vertical motion of stars in the Solar Neighbourhood. Using a simulation of a Milky Way-like galaxy, we determine the data-quality required to detect the dark matter density at its expected local value. We introduce a new method for recovering rho_dm that uses moments of the Jeans equations, combined with a Monte Carlo Markov Chain technique to marginalise over the unknown parameters. Given sufficiently good data, we show that our method can recover the correct local dark matter density even in the face of disc inhomogeneities, non-isothermal tracers and a non-separable distribution function. We illustrate the power of our technique by applying it to Hipparcos data [Holmberg & Flynn 2000,2004]. We first make the assumption that the A and F star tracer populations are isothermal. This recovers rho_dm=0.003^{+0.009}_{-0.007}Msun/pc^3 (with 90 per cent confidence), consistent with previous determinations. However, the vertic...
Local tomographic phase microscopy from differential projections
Vishnyakov, G. N.; Levin, G. G.; Minaev, V. L.; Nekrasov, N. A.
2016-12-01
It is proposed to use local tomography for optical studies of the internal structure of transparent phase microscopic objects, for example, living cells. From among the many local tomography methods that exist, the algorithms of back projection summation (in which partial derivatives of projections are used as projection data) are chosen. The application of local tomography to living cells is reasonable because, using optical phase microscopy, one can easily obtain projection data in the form of first-order derivatives of projections applying the methods of differential interference contrast and shear interferometry. The mathematical fundamentals of local tomography in differential projections are considered, and a computer simulation of different local tomography methods is performed. A tomographic phase microscope and the results of reconstructing a local tomogram of an erythrocyte from a set of experimental differential projections are described.
Limits on the local dark matter density
Garbari, Silvia; Read, Justin I.; Lake, George
2011-09-01
We revisit systematics in determining the local dark matter density ρdm from the vertical motion of stars in the solar neighbourhood. Using a simulation of a Milky Way like galaxy, we determine the data quality required to detect ρdm at its expected local value. We introduce a new method for recovering ρdm that uses moments of the Jeans equations, combined with a Markov chain Monte Carlo technique, to marginalize over the unknown parameters. Given sufficiently good data, we show that our method can recover the correct local dark matter density even in the face of disc inhomogeneities, non-isothermal tracers and a non-separable distribution function. We illustrate the power of our technique by applying it to Hipparcos data. We first make the assumption that the A- and F-star tracer populations are isothermal. This recovers ρdm= 0.003+0.009- 0.007 M⊙ pc-3 (ρdm= 0.11+0.34- 0.27 GeV cm-3, with 90 per cent confidence), consistent with previous determinations. However, the vertical dispersion profile of these tracers is poorly known. If we assume instead a non-isothermal profile similar to that of the blue disc stars from SDSS DR-7 recently measured, we obtain a fit with a very similar χ2 value, but with ρdm= 0.033+0.008- 0.009 M⊙ pc-3 (ρdm= 1.25+0.30- 0.34 GeV cm-3 with 90 per cent confidence). This highlights that it is vital to measure the vertical dispersion profile of the tracers to recover an unbiased estimate of ρdm.
Spectral Clustering with Local Projection Distance Measurement
Chen Diao
2015-01-01
Full Text Available Constructing a rational affinity matrix is crucial for spectral clustering. In this paper, a novel spectral clustering via local projection distance measure (LPDM is proposed. In this method, the Local-Projection-Neighborhood (LPN is defined, which is a region between a pair of data, and other data in the LPN are projected onto the straight line among the data pairs. Utilizing the Euclidean distance between projective points, the local spatial structure of data can be well detected to measure the similarity of objects. Then the affinity matrix can be obtained by using a new similarity measurement, which can squeeze or widen the projective distance with the different spatial structure of data. Experimental results show that the LPDM algorithm can obtain desirable results with high performance on synthetic datasets, real-world datasets, and images.
Area density of localization-entropy I: the case of wedge-localization
Schroer, Bert
2006-04-15
Using an appropriately formulated holographic light front projection, we derive an area law for the localization-entropy caused by vacuum polarization on the horizon of a wedge region. Its area density has a simple kinematic relation to the heat bath entropy of the light front algebra. Apart from a change of parametrization the infinite light like length contribution to the light front volume factor corresponds to the short-distance divergence of the area density of the localization entropy. This correspondence is a consequence of the conformal invariance of the light front holography combined with the well-known fact that in conformality relates short to long distances. In the explicit calculation of the strength factor we use the temperature duality relation of rational chiral theories whose derivation will be briefly reviewed. We comment on the potential relevance for the understanding of Black hole entropy. (author)
Local Molecular Orbitals from a Projection onto Localized Centers.
Heßelmann, Andreas
2016-06-14
A localization method for molecular orbitals is presented which exploits the locality of the eigenfunctions associated with the largest eigenvalues of the matrix representation of spatially localized functions. Local molecular orbitals are obtained by a projection of the canonical orbitals onto the set of the eigenvectors which correspond to the largest eigenvalues of these matrices. Two different types of spatially localized functions were chosen in this work, a two-parameter smooth-step-type function and the weight functions determined by a Hirshfeld partitioning of the molecular volume. It is shown that the method can provide fairly local occupied molecular orbitals if the positions of the set of local functions are set to the molecular bond centers. The method can also yield reasonably well-localized virtual molecular orbitals, but here, a sensible choice of the positions of the functions are the atomic sites and the locality then depends more strongly on the shape of the set of local functions. The method is tested for a range of polypeptide molecules in two different conformations, namely, a helical and a β-sheet conformation. Futhermore, it is shown that an adequate locality of the occupied and virtual orbitals can also be obtained for highly delocalized systems.
The density field of the local Universe
Saunders, Will (Oxford Univ. (UK). Dept. of Astrophysics Queen Mary and Westfield Coll., London (UK). Astronomy Unit); Frenk, Carlos (Durham Univ. (UK). Dept. of Physics); Rowan-Robinson, Michael (Queen Mary and Westfield Coll., London (UK). Astronomy Unit) (and others)
1991-01-03
An all-sky redshift survey of galaxies detected by IRAS (the Infrared Astronomical Satellite) has been used to map the Universe out to 140h{sup -1} Mpc (the Hubble constant H{sub 0} identical to 100h km s{sup -1} Mpc{sup -1}). Well-known superclusters and voids are seen, as are others not previously identified. The inferred underlying distribution of density is found to be skewed to high densities (the voids are larger than the superclusters but depart less from the mean density); and there is more structure on large scales than is predicted by the standard cold dark matter theory of galaxy formation. (author).
Localized versus Locality-Preserving Subspace Projections for Face Recognition
Iulian B. Ciocoiu
2007-05-01
Full Text Available Three different localized representation methods and a manifold learning approach to face recognition are compared in terms of recognition accuracy. The techniques under investigation are (a local nonnegative matrix factorization (LNMF; (b independent component analysis (ICA; (c NMF with sparse constraints (NMFsc; (d locality-preserving projections (Laplacian faces. A systematic comparative analysis is conducted in terms of distance metric used, number of selected features, and sources of variability on AR and Olivetti face databases. Results indicate that the relative ranking of the methods is highly task-dependent, and the performances vary significantly upon the distance metric used.
Localized versus Locality-Preserving Subspace Projections for Face Recognition
Costin HaritonN
2007-01-01
Full Text Available Three different localized representation methods and a manifold learning approach to face recognition are compared in terms of recognition accuracy. The techniques under investigation are (a local nonnegative matrix factorization (LNMF; (b independent component analysis (ICA; (c NMF with sparse constraints (NMFsc; (d locality-preserving projections (Laplacian faces. A systematic comparative analysis is conducted in terms of distance metric used, number of selected features, and sources of variability on AR and Olivetti face databases. Results indicate that the relative ranking of the methods is highly task-dependent, and the performances vary significantly upon the distance metric used.
Commonwealth Local Government Forum Pacific Project
Terry Parker
2008-04-01
Full Text Available The Commonwealth Local Government Forum (CLGF Pacific Project works with local government and other stakeholders in nine Pacific Island countries – Cook Islands, Fiji Islands, Kiribati, Samoa, Papua New Guinea, Solomon Islands, Tonga, Tuvalu and Vanuatu. It seeks to strengthen local democracy and good governance, and to help local governments deal with the increasing challenges of service delivery and urban management in the unique Pacific environment. Human settlement patterns in the region are changing rapidly. The Pacific has traditionally been a rural agricultural/subsistence society, but this is no longer the case. The accelerated pace of urbanisation has impacted significantly on Pacific nations and in the very near future the majority of Pacific Islanders will be found in urban areas. Already over 50% of Fiji’s population are urban dwellers. Rapid urbanisation brings with it unique challenges and opportunities. Local governments are at the forefront of this phenomenon, with the responsibility to manage urban development and the transition from rural areas to cities and towns. Their success or failure to manage urbanisation and provide the required levels of physical and social infrastructure will affect many lives in a new urban Pacific. The project now has three components – the main Pacific Regional Project and two country-specific programmes: the Honiara City Council Institutional Capacity Building Project and the Commonwealth Local Government Good Practice Scheme in Papua New Guinea.
Transforming local government by project portfolio management
Hansen, Lars Kristian; Kræmmergaard, Pernille
2013-01-01
Purpose – As public organizations strive for higher e-government maturity, Project Portfolio Management (IT PPM) has become a high priority issue. Assuming control is central in IT PPM, we investigate how a Danish local government conducts control in IT PPM; we identify control problems...... hierarchical levels difficult, which deprives organizations of the opportunity to pursue and display unambiguous value from their e-government initiatives. Originality/value – This paper fulfills an identified need to understand how local governments can improve IT PPM. Keywords – IT Project Portfolio...... Management, e-government, Control theory, control problems, formal mechanisms, informal mechanisms. Article type – Case study...
Approximating local observables on projected entangled pair states
Schwarz, M.; Buerschaper, O.; Eisert, J.
2017-06-01
Tensor network states are for good reasons believed to capture ground states of gapped local Hamiltonians arising in the condensed matter context, states which are in turn expected to satisfy an entanglement area law. However, the computational hardness of contracting projected entangled pair states in two- and higher-dimensional systems is often seen as a significant obstacle when devising higher-dimensional variants of the density-matrix renormalization group method. In this work, we show that for those projected entangled pair states that are expected to provide good approximations of such ground states of local Hamiltonians, one can compute local expectation values in quasipolynomial time. We therefore provide a complexity-theoretic justification of why state-of-the-art numerical tools work so well in practice. We finally turn to the computation of local expectation values on quantum computers, providing a meaningful application for a small-scale quantum computer.
Global and local curvature in density functional theory
Zhao, Qing; Ioannidis, Efthymios I.; Kulik, Heather J.
2016-08-01
Piecewise linearity of the energy with respect to fractional electron removal or addition is a requirement of an electronic structure method that necessitates the presence of a derivative discontinuity at integer electron occupation. Semi-local exchange-correlation (xc) approximations within density functional theory (DFT) fail to reproduce this behavior, giving rise to deviations from linearity with a convex global curvature that is evidence of many-electron, self-interaction error and electron delocalization. Popular functional tuning strategies focus on reproducing piecewise linearity, especially to improve predictions of optical properties. In a divergent approach, Hubbard U-augmented DFT (i.e., DFT+U) treats self-interaction errors by reducing the local curvature of the energy with respect to electron removal or addition from one localized subshell to the surrounding system. Although it has been suggested that DFT+U should simultaneously alleviate global and local curvature in the atomic limit, no detailed study on real systems has been carried out to probe the validity of this statement. In this work, we show when DFT+U should minimize deviations from linearity and demonstrate that a "+U" correction will never worsen the deviation from linearity of the underlying xc approximation. However, we explain varying degrees of efficiency of the approach over 27 octahedral transition metal complexes with respect to transition metal (Sc-Cu) and ligand strength (CO, NH3, and H2O) and investigate select pathological cases where the delocalization error is invisible to DFT+U within an atomic projection framework. Finally, we demonstrate that the global and local curvatures represent different quantities that show opposing behavior with increasing ligand field strength, and we identify where these two may still coincide.
Refractory Coated/Lined Low Density Structures Project
National Aeronautics and Space Administration — This project addresses the development of refractory coated or lined low density structures applicable for advanced future propulsion system technologies. The...
Konstandin, Simon; Nagel, Armin M
2013-02-01
Sampling density-weighted apodization projection reconstruction sequences are evaluated for three-dimensional radial imaging. The readout gradients of the sampling density-weighted apodization sequence are designed such that the locally averaged sampling density matches a Hamming filter function. This technique is compared with density-adapted projection reconstruction with nonfiltered and postfiltered image reconstruction. Sampling density-weighted apodization theoretically allows for a 1.28-fold higher signal-to-noise ratio compared with postfiltered density-adapted projection reconstruction sequences, if T(2)* decay is negligible compared with the readout duration T(RO). Simulations of the point-spread functions are performed for monoexponential and biexponential decay to investigate the effects of T(2)* decay on the performance of the different sequences. Postfiltered density-adapted projection reconstruction performs superior to sampling density-weighted apodization for large T(RO)/T(2)* ratios [>1.36 (monoexponential decay); >0.35 (biexponential decay with T(2s)*/T(2f)* = 10)], if signal-to-noise ratio of point-like objects is considered. In conclusion, it depends on the readout parameters, the T(2)* relaxation times, and the dimensions of the subject which of both sequences is most suitable. Copyright © 2012 Wiley Periodicals, Inc.
Transforming local government by project portfolio management
Hansen, Lars Kristian; Kræmmergaard, Pernille
2013-01-01
Purpose – As public organizations strive for higher e-government maturity, Project Portfolio Management (IT PPM) has become a high priority issue. Assuming control is central in IT PPM, we investigate how a Danish local government conducts control in IT PPM; we identify control problems and formu......Purpose – As public organizations strive for higher e-government maturity, Project Portfolio Management (IT PPM) has become a high priority issue. Assuming control is central in IT PPM, we investigate how a Danish local government conducts control in IT PPM; we identify control problems...... and formulate recommendations to address these. Design/methodology/approach – Adopting principles from Engaged Scholarship, we have conducted a case study using a wide variety of data collection methods, including 29 interviews, one workshop, and analyses of documents. Findings – We find that the local....../implications – As a single qualitative case study, the results are limited to one organization and subject. Practical implications – The paper has implications for IT PPM in Danish local governments and similar organizations in other countries. We show that the lack of formal control mechanisms makes accountability between...
Localized density matrix minimization and linear scaling algorithms
Lai, Rongjie
2015-01-01
We propose a convex variational approach to compute localized density matrices for both zero temperature and finite temperature cases, by adding an entry-wise $\\ell_1$ regularization to the free energy of the quantum system. Based on the fact that the density matrix decays exponential away from the diagonal for insulating system or system at finite temperature, the proposed $\\ell_1$ regularized variational method provides a nice way to approximate the original quantum system. We provide theoretical analysis of the approximation behavior and also design convergence guaranteed numerical algorithms based on Bregman iteration. More importantly, the $\\ell_1$ regularized system naturally leads to localized density matrices with banded structure, which enables us to develop approximating algorithms to find the localized density matrices with computation cost linearly dependent on the problem size.
A Projection FEM for Variable Density Incompressible Flows
Guermond, J.-L.; Quartapelle, L.
2000-11-01
This work describes a new finite element projection method for the computation of incompressible viscous flows of nonuniform density. One original idea of the proposed method consists in factorizing the density variable partly outside and partly inside the time evolution operator in the momentum equation, to prevent spatial discretization errors in the mass conservation to affect the kinetic energy balance of the fluid. It is shown that unconditional stability in the incremental version of the projection method is possible provided two projections are performed per time step. In particular, a second order accurate BDF projection method is presented and its numerical performance is illustrated by test computations and comparisons.
The local density of optical states of a metasurface
Lunnemann, P.; Koenderink, A.F.
2016-01-01
While metamaterials are often desirable for near-field functions, such as perfect lensing, or cloaking, they are often quantified by their response to plane waves from the far field. Here, we present a theoretical analysis of the local density of states near lattices of discrete magnetic scatterers,
Galactoseismology and the Local Density of Dark Matter
Banik, Nilanjan [Florida U.; Widrow, Lawrence M. [Queen' s U., Kingston; Dodelson, Scott [Fermilab
2016-08-10
We model vertical breathing mode perturbations in the Milky Way's stellar disc and study their effects on estimates of the local dark matter density, surface density, and vertical force. Evidence for these perturbations, which involve compression and expansion of the Galactic disc perpendicular to its midplane, come from the SEGUE, RAVE, and LAMOST surveys. We show that their existence may lead to systematic errors of $10\\%$ or greater in the vertical force $K_z(z)$ at $|z|=1.1\\,{\\rm kpc}$. These errors translate to $\\gtrsim 25\\%$ errors in estimates of the local dark matter density. Using different mono-abundant subpopulations as tracers offers a way out: if the inferences from all tracers in the Gaia era agree, then the dark matter determination will be robust. Disagreement in the inferences from different tracers will signal the breakdown of the unperturbed model and perhaps provide the means for determining the nature of the perturbation.
Galactoseismology and the Local Density of Dark Matter
Banik, Nilanjan; Dodelson, Scott
2016-01-01
We model vertical breathing mode perturbations in the Milky Way's stellar disc and study their effects on estimates of the local dark matter density, surface density, and vertical force. Evidence for these perturbations, which involve compression and expansion of the Galactic disc perpendicular to its midplane, come from the SEGUE, RAVE, and LAMOST surveys. We show that their existence may lead to systematic errors of $10\\%$ or greater in the vertical force $K_z(z)$ at $|z|=1.1\\,{\\rm kpc}$. These errors translate to $\\gtrsim 25\\%$ errors in estimates of the local dark matter density. Using different mono-abundant subpopulations as tracers offers a way out: if the inferences from all tracers in the Gaia era agree, then the dark matter determination will be robust. Disagreement in the inferences from different tracers will signal the breakdown of the unperturbed model and perhaps provide the means for determining the nature of the perturbation.
Freihoelser Forst Local Training Area rehabilitation project
Hinchman, R.R.; Zellmer, S.D.; Johnson, D.O.; Severinghaus, W.D.; Brent, J.J. (Army Construction Engineering Research Lab., Champaign, IL (United States). Environmental Div.)
1991-12-01
Intensive and continued use of the Freihoelser Forst Local Training Area (LTA) for military training activities had resulted in serious environmental problems, exemplified by a lack of vegetative cover and severe erosion by water and wind. The project's goal was to develop and demonstrate rapid, cost-effective methods to stabilize the LTA's barren, eroding maneuver areas and make training conditions more realistic. The major factors limiting rehabilitation efforts were the sandy, infertile, and acidic soils. The project was conducted in two phases. Phase I demonstrated and evaluated three separate rehabilitation treatments ranging in cost from moderate to expensive. Each treatment used a different type of soil amendment (fertilizer and straw, compost, or chicken manure), but all used identical seedbed preparation methods and seed mixtures. Phase I was conducted on relatively small replicated plots and was monitored three times during each growing season. All three treatments satisfactorily reestablished vegetation and controlled erosion. Because of their small size, the Phase I demonstration plots had only a minor stabilizing effect on the erosion problems of the LTA as a whole. The Phase II treatment was based on lessons teamed from Phase I and from other revegetation projects in Germany. Phase II revegetated a large area of the LTA, which included nearly all of the most severely disturbed land. Phase II, which was monitored in the same way as Phase I but for a shorter period of time, was highly successful in stabilizing most areas treated. The revegetation plant community was dominated by native grasses and legumes that stabilized the loose, sandy soils and improved the training realism of a major portion of the LTA.
Local Finite Density Theory, Statistical Blocking and Color Superconductivity
Ying, S
2000-01-01
The motivation for the development of a local finite density theory is discussed. One of the problems related to an instability in the baryon number fluctuation of the chiral symmetry breaking phase of the quark system in the local theory is shown to exist. Such an instability problem is removed by taking into account the statistical blocking effects for the quark propagator, which depends on a macroscopic {\\em statistical blocking parameter} $\\epsilon$. This new frame work is then applied to study color superconducting phase of the light quark system.
Self-interaction corrected local spin density calculations of actinides
Petit, Leon; Svane, Axel; Szotek, Z
2010-01-01
We use the self-interaction corrected local spin-density approximation in order to describe localization-delocalization phenomena in the strongly correlated actinide materials. Based on total energy considerations, the methodology enables us to predict the ground-state valency configuration...... of the actinide ions in these compounds from first principles. Here we review a number of applications, ranging from electronic structure calculations of actinide metals, nitrides and carbides to the behaviour under pressure of intermetallics, and O vacancies in PuO2....
Wave Localization and Density Bunching in Pair Ion Plasmas
Mahajan, Swadesh M
2008-01-01
By investigating the nonlinear propagation of high intensity electromagnetic (EM) waves in a pair ion plasma, whose symmetry is broken via contamination by a small fraction of high mass immobile ions, it is shown that this new and interesting state of (laboratory created) matter is capable of supporting structures that strongly localize and bunch the EM radiation with density excess in the region of localization. Testing of this prediction in controlled laboratory experiments can lend credence, inter alia, to conjectures on structure formation (via the same mechanism) in the MEV era of the early universe.
Mattsson, Ann Elisabet; Modine, Normand Arthur; Desjarlais, Michael Paul; Muller, Richard Partain; Sears, Mark P.; Wright, Alan Francis
2006-11-01
A finite temperature version of 'exact-exchange' density functional theory (EXX) has been implemented in Sandia's Socorro code. The method uses the optimized effective potential (OEP) formalism and an efficient gradient-based iterative minimization of the energy. The derivation of the gradient is based on the density matrix, simplifying the extension to finite temperatures. A stand-alone all-electron exact-exchange capability has been developed for testing exact exchange and compatible correlation functionals on small systems. Calculations of eigenvalues for the helium atom, beryllium atom, and the hydrogen molecule are reported, showing excellent agreement with highly converged quantumMonte Carlo calculations. Several approaches to the generation of pseudopotentials for use in EXX calculations have been examined and are discussed. The difficult problem of finding a correlation functional compatible with EXX has been studied and some initial findings are reported.
The Structure of the Local Interstellar Medium V: Electron Densities
Redfield, Seth
2008-01-01
We present a comprehensive survey of CII* absorption detections toward stars within 100 pc in order to measure the distribution of electron densities present in the local interstellar medium (LISM). Using high spectral resolution observations of nearby stars obtained by GHRS and STIS onboard the Hubble Space Telescope, we identify 13 sight lines with 23 individual CII* absorption components, which provide electron density measurements, the vast majority of which are new. We employ several strategies to determine more accurate CII column densities from the saturated CII resonance line, including, constraints of the line width from the optically thin CII* line, constraints from independent temperature measurements of the LISM gas based on line widths of other ions, and third, using measured SII column densities as a proxy for CII column densities. The sample of electron densities appears consistent with a log-normal distribution and an unweighted mean value of n_e(CII_SII) = 0.11^+0.10_-0.05 cm^-3. Seven indivi...
Local thermodynamic mapping for effective liquid density-functional theory
Kyrlidis, Agathagelos; Brown, Robert A.
1992-01-01
The structural-mapping approximation introduced by Lutsko and Baus (1990) in the generalized effective-liquid approximation is extended to include a local thermodynamic mapping based on a spatially dependent effective density for approximating the solid phase in terms of the uniform liquid. This latter approximation, called the local generalized effective-liquid approximation (LGELA) yields excellent predictions for the free energy of hard-sphere solids and for the conditions of coexistence of a hard-sphere fcc solid with a liquid. Moreover, the predicted free energy remains single valued for calculations with more loosely packed crystalline structures, such as the diamond lattice. The spatial dependence of the weighted density makes the LGELA useful in the study of inhomogeneous solids.
The local density of optical states of a metasurface
Lunnemann, Per
2016-01-01
While metamaterials are often desirable for near-field functions, such as perfect lensing, or cloaking, they are often quantified by their response to plane waves from the far field. Here, we present a theoretical analysis of the local density of states near lattices of discrete magnetic scatterers, i.e., the response to near field excitation by a point source. Based on a point-dipole theory using Ewald summation and an array scanning method, we can swiftly and semi-analytically evaluate the local density of states (LDOS) for magnetoelectric point sources in front of an infinite two-dimensional (2D) lattice composed of arbitrary magnetoelectric dipole scatterers. The method takes into account radiation damping as well as all retarded electrodynamic interactions in a self-consistent manner. We show that a lattice of magnetic scatterers evidences characteristic Drexhage oscillations. However, the oscillations are phase shifted relative to the electrically scattering lattice consistent with the difference expect...
Project n.4: local strategies for decontamination
Hubert, Ph. [CEA Centre d`Etudes de Fontenay-aux-Roses, 92 (France). Inst. de Protection et de Surete Nucleaire; Ramzaev, V. [Branch of Institute of Radiation Hygiene, Karchovka, Bryandk (Russian Federation); Antsypov, G. [Chernobyl State Committee of the Republic of Belarus, (Belarus); Sobotovich, E. [Institute of Geochemistry, Mineralogy and Ore formation, Kiev (Ukraine); Anisimova, L. [EMERCOM, Moscow (Russian Federation)
1995-12-31
The efficiencies of a great number of techniques for decontamination or dose reduction in contaminated areas have been investigated by several teams of E.C. and CIS scientists (ECP4 project). Modelling, laboratory and field experiments, and a return from experience from the area contaminated by the Chernobyl accident allowed to assess radiological efficiencies and requirements for the operation of numerous practical solutions. Then those data were supplemented with data on cost and waste generation in order to elaborate all the information for the optimisation of decontamination strategies. Results are presented for about 70 techniques. However, a technique cannot be compared to another from a generic point of view. Rather it is designed for a specific target and the best technology depends on the objectives. It has been decided to implement decision analyses on case studies and the local conditions and objectives have been investigated. Individual doses ranged from 1 to 5 mSv, with the contrasted contributions of internal and external doses. The desire to restore a normal activity in a partially depopulated settlement and concerns about the recent increase in internal doses were typical incentives for action. The decision aiding analysis illustrated that actions can be usually recommended. Results are outlined. (authors). 23 refs.
Poggianti, Bianca M; Finn, Rose; Bamford, Steven; De Lucia, Gabriella; Varela, Jesus; Aragon-Salamanca, Alfonso; Halliday, Claire; Noll, Stefan; Saglia, Roberto; Zaritsky, Dennis; Best, Philip; Clowe, Douglas; Milvang-Jensen, Bo; Jablonka, Pascale; Pello, Roser; Rudnick, Gregory; Simard, Luc; von der Linden, Anja; White, Simon
2008-01-01
We investigate how the [OII] properties and the morphologies of galaxies in clusters and groups at z=0.4-0.8 depend on projected local galaxy density, and compare with the field at similar redshifts and clusters at low-z. In both nearby and distant clusters, higher-density regions contain proportionally fewer star-forming galaxies, and the average [OII] equivalent width of star-forming galaxies is independent of local density. However, in distant clusters the average current star formation rate (SFR) in star-forming galaxies seems to peak at densities ~15-40 galaxies Mpc^{-2}. At odds with low-z results, at high-z the relation between star-forming fraction and local density varies from high- to low-mass clusters. Overall, our results suggest that at high-z the current star formation (SF) activity in star-forming galaxies does not depend strongly on global or local environment, though the possible SFR peak seems at odds with this conclusion. We find that the cluster SFR normalized by cluster mass anticorrelate...
Evolution of classical projected phase space density in billiards
Debabrata Biswas
2005-04-01
The classical phase space density projected on to the configuration space offers a means of comparing classical and quantum evolution. In this alternate approach that we adopt here, we show that for billiards, the eigenfunctions of the coarse-grained projected classical evolution operator are identical to a first approximation to the quantum Neumann eigenfunctions. Moreover, there exists a correspondence between the respective eigenvalues although their time evolutions differ.
Galactoseismology and the local density of dark matter
Banik, Nilanjan; Widrow, Lawrence M.; Dodelson, Scott
2017-02-01
We model vertical breathing mode perturbations in the Milky Way's stellar disc and study their effects on estimates of the local dark matter density, surface density, and vertical force. Evidence for these perturbations, which involve compression and expansion of the Galactic disc perpendicular to the mid-plane, comes from three different surveys of stellar kinematics within a few kiloparsecs of the Sun. We show that their existence may lead to systematic errors of 10 per cent or greater in the vertical force Kz(z) at |z| = 1.1 kpc. These errors translate to ≳ 25 per cent errors in estimates of the local dark matter density. Using different mono-abundant subpopulations as tracers offers a way out: if the inferences from all tracers in the Gaia era agree, then the dark matter determination will be robust. Disagreement in the inferences from different tracers will signal the breakdown of the unperturbed model and perhaps provide the means for determining the nature of the perturbation.
RCP Local School Projects in Alabama.
Regional Curriculum Project, Atlanta, GA.
One of 6 state reports generated by the Regional Curriculum Project (funded under the Elementary and Secondary Education Act), the document describes 4 specific projects implemented through the Alabama State Superintendent's Office beginning in 1966. All 4 projects were designed to improve instructional leadership by defining the role(s) of the…
RCP Local School Projects in South Carolina.
Regional Curriculum Project, Atlanta, GA.
One of 6 state reports of projects and programs operating in cooperation with the Regional Curriculum Project, the document highlights major curriculum-change programs in South Carolina which were initiated in 1966. The 4 projects reported are "Curriculum Study in Berkeley County," which had as its purpose the identification and…
Spin projection with double hybrid density functional theory.
Thompson, Lee M; Hratchian, Hrant P
2014-07-21
A spin projected double-hybrid density functional theory is presented that accounts for different scaling of opposite and same spin terms in the second order correction. This method is applied to three dissociation reactions which in the unprojected formalism exhibit significant spin contamination with higher spin states. This gives rise to a distorted potential surface and can lead to poor geometries and energies. The projected method presented is shown to improve the description of the potential over unprojected double hybrid density functional theory. Comparison is made with the reference states of the two double hybrid functionals considered here (B2PLYP and mPW2PLYP) in which the projected potential surface is degraded by an imbalance in the description of dynamic and static correlation.
RCP Local School Projects in North Carolina.
Regional Curriculum Project, Atlanta, GA.
One of 6 state reports prepared in cooperation with the Regional Curriculum Project, the document discusses 4 major educational programs conducted in North Carolina since 1965. "The Story of Merger and Educational Change in Moore County" is a report relating to school redistricting; "The Mathematics Project in Greensboro"…
The local density of optical states of a metasurface
Lunnemann, Per; Koenderink, A. Femius
2016-02-01
While metamaterials are often desirable for near-field functions, such as perfect lensing, or cloaking, they are often quantified by their response to plane waves from the far field. Here, we present a theoretical analysis of the local density of states near lattices of discrete magnetic scatterers, i.e., the response to near field excitation by a point source. Based on a pointdipole theory using Ewald summation and an array scanning method, we can swiftly and semi-analytically evaluate the local density of states (LDOS) for magnetoelectric point sources in front of an infinite two-dimensional (2D) lattice composed of arbitrary magnetoelectric dipole scatterers. The method takes into account radiation damping as well as all retarded electrodynamic interactions in a self-consistent manner. We show that a lattice of magnetic scatterers evidences characteristic Drexhage oscillations. However, the oscillations are phase shifted relative to the electrically scattering lattice consistent with the difference expected for reflection off homogeneous magnetic respectively electric mirrors. Furthermore, we identify in which source-surface separation regimes the metasurface may be treated as a homogeneous interface, and in which homogenization fails. A strong frequency and in-plane position dependence of the LDOS close to the lattice reveals coupling to guided modes supported by the lattice.
The LC resonance probe for determining local plasma density
Boris, D R; Fernsler, R F; Walton, S G, E-mail: david.boris.ctr@nrl.navy.mi [Naval Research Laboratory, Charge Particle Physics Branch-Code 6752, Plasma Physics Division, 4555 Overlook Ave. SW, Washington, DC 20375 (United States)
2011-04-15
We present a novel plasma diagnostic for measuring local plasma density in reactive-gas plasmas, and depositing plasmas. The diagnostic uses a network analyzer to measure the LC resonance (LCR) frequency of a parallel plate capacitor with inductive leads. The location of the LCR ({omega}{sub R}) in frequency space is then used as a measure of the plasma dielectric constant bold varepsilon{sub p} between the plates. By properly constructing the LCR probe, {omega}{sub R} can be tuned such that {omega}{sub R} >> {omega}{sub ce}, where {omega}{sub ce} is the electron-cyclotron frequency. Thus, the probe can be used in plasmas with varying degrees of magnetization while avoiding complications introduced to bold varepsilon{sub p} when {omega} is comparable to {omega}{sub ce}. Density measurements from the LCR probe are compared with Langmuir probe measurements in an electron-beam generated plasma in which density varied from 10{sup 9} to 10{sup 11} cm{sup -3}. An axial magnetic field, typically used to confine the electron beam, was varied between 0 to 300 G. The LCR probe showed good agreement with a Langmuir probe across the entire range of magnetic fields.
Pair 2-electron reduced density matrix theory using localized orbitals
Head-Marsden, Kade; Mazziotti, David A.
2017-08-01
Full configuration interaction (FCI) restricted to a pairing space yields size-extensive correlation energies but its cost scales exponentially with molecular size. Restricting the variational two-electron reduced-density-matrix (2-RDM) method to represent the same pairing space yields an accurate lower bound to the pair FCI energy at a mean-field-like computational scaling of O (r3) where r is the number of orbitals. In this paper, we show that localized molecular orbitals can be employed to generate an efficient, approximately size-extensive pair 2-RDM method. The use of localized orbitals eliminates the substantial cost of optimizing iteratively the orbitals defining the pairing space without compromising accuracy. In contrast to the localized orbitals, the use of canonical Hartree-Fock molecular orbitals is shown to be both inaccurate and non-size-extensive. The pair 2-RDM has the flexibility to describe the spectra of one-electron RDM occupation numbers from all quantum states that are invariant to time-reversal symmetry. Applications are made to hydrogen chains and their dissociation, n-acene from naphthalene through octacene, and cadmium telluride 2-, 3-, and 4-unit polymers. For the hydrogen chains, the pair 2-RDM method recovers the majority of the energy obtained from similar calculations that iteratively optimize the orbitals. The localized-orbital pair 2-RDM method with its mean-field-like computational scaling and its ability to describe multi-reference correlation has important applications to a range of strongly correlated phenomena in chemistry and physics.
Density and localized states' impact on amorphous carbon electron transport mechanisms
Caicedo-Dávila, S.; Lopez-Acevedo, O.; Velasco-Medina, J.; Avila, A.
2016-12-01
This work discusses the electron transport mechanisms that we obtained as a function of the density of amorphous carbon (a-C) ultra-thin films. We calculated the density of states (total and projected), degree of electronic states' localization, and transmission function using the density functional theory and nonequilibrium Green's functions method. We generated 25 sample a-C structures using ab-initio molecular dynamics within the isothermal-isobaric ensemble. We identified three transport regimes as a function of the density, varying from semimetallic in low-density samples ( ≤2.4 g/cm3) to thermally activated in high-density ( ≥2.9 g/cm3) tetrahedral a-C. The middle-range densities (2.4 g/cm3 ≤ρ≤ 2.9 g/cm3) are characterized by resonant tunneling and hopping transport. Our findings offer a different perspective from the tight-binding model proposed by Katkov and Bhattacharyya [J. Appl. Phys. 113, 183712 (2013)], and agree with experimental observations in low-dimensional carbon systems [see S. Bhattacharyya, Appl. Phys. Lett. 91, 21 (2007)]. Identifying transport regimes is crucial to the process of understanding and applying a-C thin film in electronic devices and electrode coating in biosensors.
Monolithic, Widely Tunable, THz Local Oscillator Project
National Aeronautics and Space Administration — This proposal describes development of a new type of quantum-cascade laser for use as a local oscillator at frequencies above 2 THz. The THz source described is a...
The local density of optical states of a metasurface
Hansen, Per Lunnemann; Koenderink, A. Femius
2016-01-01
While metamaterials are often desirable for near-field functions, such as perfect lensing, or cloaking, they are often quantified by their response to plane waves from the far field. Here, we present a theoretical analysis of the local density of states near lattices of discrete magnetic scatterers......-dimensional (2D) lattice composed of arbitrary magnetoelectric dipole scatterers. The method takes into account radiation damping as well as all retarded electrodynamic interactions in a self-consistent manner. We show that a lattice of magnetic scatterers evidences characteristic Drexhage oscillations. However......, the oscillations are phase shifted relative to the electrically scattering lattice consistent with the difference expected for reflection off homogeneous magnetic respectively electric mirrors. Furthermore, we identify in which source-surface separation regimes the metasurface may be treated as a homogeneous...
EPR Pairs, Local Projections and Quantum Teleportation in Holography
Numasawa, Tokiro; Takayanagi, Tadashi; Watanabe, Kento
2016-01-01
In this paper we analyze three quantum operations in two dimensional conformal field theories (CFTs): local projection measurements, creations of partial entanglement between two CFTs, and swapping of subsystems between two CFTs. We also give their holographic duals and study time evolutions of entanglement entropy. By combining these operations, we present an analogue of quantum teleportation between two CFTs and give its holographic realization. We introduce a new quantity to probe tripartite entanglement by using local projection measurement.
EPR pairs, local projections and quantum teleportation in holography
Numasawa, Tokiro; Shiba, Noburo; Takayanagi, Tadashi; Watanabe, Kento
2016-08-01
In this paper we analyze three quantum operations in two dimensional conformal field theories (CFTs): local projection measurements, creations of partial entanglement between two CFTs, and swapping of subsystems between two CFTs. We also give their holographic duals and study time evolutions of entanglement entropy. By combining these operations, we present an analogue of quantum teleportation between two CFTs and give its holographic realization. We introduce a new quantity to probe tripartite entanglement by using local projection measurement.
Automatic Mouth Localization Using Edge Projection
Mohamed Rizon
2010-01-01
Full Text Available Problem statement: This study presented algorithms to detect mouth from color and intensity images. Approach: First, this algorithm detected the face region in the image and extracts intensity valleys from the face region. Next, the algorithm extracted iris candidates from the valleys and computed the costs for each pair of iris candidates. Finally, a pair of iris candidates was selected as irises by using the computed costs. Projection based method had been used to detect mouth corresponding to irises location. Results: By experiment, the proposed algorithm detected 90% of full mouth region for South East Asian database and 74% for European database. Conclusion: The algorithm was considered successful to detect mouth detection under variation of pose, illumination and orientation. For future improvement, more preprocessing steps might be needed to enhance and eliminate the effect of beard, moustache and illumination.
Superfluid LDA (SLDA): Local Density Approximation for Systems with Superfluid Correlations
Bulgac, A; Bulgac, Aurel; Yu, Yongle
2004-01-01
We present a concise account of our development of the first genuine Local Density Approximation (LDA) to the Energy Density Functional (EDF) for fermionic systems with superfluid correlations, with a particular emphasis to nuclear systems.
Direct discriminant locality preserving projection with Hammerstein polynomial expansion.
Chen, Xi; Zhang, Jiashu; Li, Defang
2012-12-01
Discriminant locality preserving projection (DLPP) is a linear approach that encodes discriminant information into the objective of locality preserving projection and improves its classification ability. To enhance the nonlinear description ability of DLPP, we can optimize the objective function of DLPP in reproducing kernel Hilbert space to form a kernel-based discriminant locality preserving projection (KDLPP). However, KDLPP suffers the following problems: 1) larger computational burden; 2) no explicit mapping functions in KDLPP, which results in more computational burden when projecting a new sample into the low-dimensional subspace; and 3) KDLPP cannot obtain optimal discriminant vectors, which exceedingly optimize the objective of DLPP. To overcome the weaknesses of KDLPP, in this paper, a direct discriminant locality preserving projection with Hammerstein polynomial expansion (HPDDLPP) is proposed. The proposed HPDDLPP directly implements the objective of DLPP in high-dimensional second-order Hammerstein polynomial space without matrix inverse, which extracts the optimal discriminant vectors for DLPP without larger computational burden. Compared with some other related classical methods, experimental results for face and palmprint recognition problems indicate the effectiveness of the proposed HPDDLPP.
Some asymptotic results on density estimators by wavelet projections
Varron, Davit
2012-01-01
Let $(X_i)_{i\\geq 1}$ be an i.i.d. sample on $\\RRR^d$ having density $f$. Given a real function $\\phi$ on $\\RRR^d$ with finite variation and given an integer valued sequence $(j_n)$, let $\\fn$ denote the estimator of $f$ by wavelet projection based on $\\phi$ and with multiresolution level equal to $j_n$. We provide exact rates of almost sure convergence to 0 of the quantity $\\sup_{x\\in H}\\mid \\fn(x)-\\EEE(\\fn)(x)\\mid$, when $n2^{-dj_n}/\\log n \\rar \\infty$ and $H$ is a given hypercube of $\\RRR^d$. We then show that, if $n2^{-dj_n}/\\log n \\rar c$ for a constant $c>0$, then the quantity $\\sup_{x\\in H}\\mid \\fn(x)-f\\mid$ almost surely fails to converge to 0.
Nonconforming local projection stabilization for generalized Oseen equations
Yan-hong BAI; Min-fu FENG; Chuan-long WANG
2010-01-01
A new method of nonconforming local projection stabilization for the generalized Oseen equations is proposed by a nonconforming inf-sup stable element pair for approximating the velocity and the pressure.The method has several attractive features.It adds a local projection term only on the sub-scale(H ≥ h).The stabilized term is simple compared with the residual-free bubble element method.The method can handle the influence of strong convection.The numerical results agree with the theoretical expectations very well.
Zhu, Guangtun Ben; Barrera-Ballesteros, Jorge K.; Heckman, Timothy M.; Zakamska, Nadia L.; Sánchez, Sebastian F.; Yan, Renbin; Brinkmann, Jonathan
2017-07-01
We revisit the relation between the stellar surface density, the gas surface density and the gas-phase metallicity of typical disc galaxies in the local Universe with the SDSS-IV/MaNGA survey, using the star formation rate surface density as an indicator for the gas surface density. We show that these three local parameters form a tight relationship, confirming previous works (e.g. by the PINGS and CALIFA surveys), but with a larger sample. We present a new local leaky-box model, assuming star-formation history and chemical evolution is localized except for outflowing materials. We derive closed-form solutions for the evolution of stellar surface density, gas surface density and gas-phase metallicity, and show that these parameters form a tight relation independent of initial gas density and time. We show that, with canonical values of model parameters, this predicted relation match the observed one well. In addition, we briefly describe a pathway to improving the current semi-analytic models of galaxy formation by incorporating the local leaky-box model in the cosmological context, which can potentially explain simultaneously multiple properties of Milky Way-type disc galaxies, such as the size growth and the global stellar mass-gas metallicity relation.
Density equalizing map projections (cartograms) in public health applications
Merrill, D.W.
1998-05-01
In studying geographic disease distributions, one normally compares rates among arbitrarily defined geographic subareas (e.g. census tracts), thereby sacrificing some of the geographic detail of the original data. The sparser the data, the larger the subareas must be in order to calculate stable rates. This dilemma is avoided with the technique of Density Equalizing Map Projections (DEMP){copyright}. Boundaries of geographic subregions are adjusted to equalize population density over the entire study area. Case locations plotted on the transformed map should have a uniform distribution if the underlying disease risk is constant. On the transformed map, the statistical analysis of the observed distribution is greatly simplified. Even for sparse distributions, the statistical significance of a supposed disease cluster can be calculated with validity. The DEMP algorithm was applied to a data set previously analyzed with conventional techniques; namely, 401 childhood cancer cases in four counties of California. The distribution of cases on the transformed map was analyzed visually and statistically. To check the validity of the method, the identical analysis was performed on 401 artificial cases randomly generated under the assumption of uniform risk. No statistically significant evidence for geographic non-uniformity of rates was found, in agreement with the original analysis performed by the California Department of Health Services.
Complete Localization of HVDC Back-to-Back Project Realized
Yu Xinqiang; Liang Xuming; Wang Zuli; Ye Qing
2006-01-01
The first completely localized DC back-to-back project for asynchronous interconnection between Northwest and Central China plays an important role in realizing national power grid interconnection, spurring indigenous manufacturing industries and promoting DC transmission equipment. Insisting on the principle of autonomous innovation, this project was based on domestic forces in every aspect, from engineering organization, system design, equipment completion, engineering design, equipment manufacturing and procurement to construction and debugging. By passing through strict quality control, intermediate supervision and acceptance test and assessment, the project has been proved up to world advanced level.
PREDICTION OF MAXIMUM DRY DENSITY OF LOCAL GRANULAR ...
methods. A test on a soil of relatively high solid density revealed that the developed relation looses ... where, Pd max is the laboratory maximum dry ... Addis-Jinima Road Rehabilitation. ..... data sets that differ considerably in the magnitude.
Diez, Reinaldo Pis [CEQUINOR, Centro de Quimica Inorganica (CONICET, UNLP), Departamento de Quimica, Facultad de Ciencias Exactas, UNLP CC 962, B1900AVV La Plata (Argentina); Karasiev, Valentin V [Centro de Qimica, Instituto Venezolano de Investigaciones Cientificas, IVIC, Apartado 21827, Caracas 1020-A (Venezuela)
2003-07-14
A relationship between the auxiliary density, {rho}(r), defined within the framework of the weighted density approximation and the kinetic energy modulating factor, A{sub N}([{rho}(r)]; r), which appears in the local-scaling transformation version of density functional theory is presented. This relationship imposes the condition of positiveness on the kinetic energy modulating factor and this, in turn, leads to an important mathematical condition on any approximate kinetic energy density functional. It is shown that two well-known approximate kinetic energy density functionals do not satisfy the above relationship at distances very close to the nucleus. By forcing a given approximate kinetic energy density functional to obey the above condition, both the kinetic and exchange energies can be obtained within a framework similar to that of the weighted density approximation. Results on some closed-shell atomic systems provide support for those ideas.
Dynamics of localized particles from density functional theory
Reinhardt, J.; Brader, J. M.
2012-01-01
A fundamental assumption of the dynamical density functional theory (DDFT) of colloidal systems is that a grand-canonical free-energy functional may be employed to generate the thermodynamic driving forces. Using one-dimensional hard rods as a model system, we analyze the validity of this key assumption and show that unphysical self-interactions of the tagged particle density fields, arising from coupling to a particle reservoir, are responsible for the excessively fast relaxation predicted by the theory. Moreover, our findings suggest that even employing a canonical functional would not lead to an improvement for many-particle systems, if only the total density is considered. We present several possible schemes to suppress these effects by incorporating tagged densities. When applied to confined systems, we demonstrate, using a simple example, that DDFT necessarily leads to delocalized tagged particle density distributions, which do not respect the fundamental geometrical constraints apparent in Brownian dynamics simulation data. The implication of these results for possible applications of DDFT to treat the glass transition are discussed.
Project management initiative local development through specialized training.
Neisy Ramos Acevedo
2013-09-01
Full Text Available The local development should complete a group of basic principles, such as: the design for training and the tools information adapted to the particularity of each territory. This training facilitates, also, the articulation of the stocks deployed by the local leaders, and it increases the administration of the knowledge and the transfer of technologies, processes in those that the nexuses are enlarged between the structures and the population, and where the participation of different present actors is potentialized in the territory. During the year 2010 the Ministry of Economy and Planning begins to offer the possibility to finance projects for the local development, nevertheless these initiatives should be accompanied by a rigorous study of feasibility of the investments. The University of Sancti Spíritus, committed in this zeal, designs the Diplomate of Administration of Projects for Local Initiatives, which offers theoretical tools and it develops practical abilities in the different actors of the local development that facilitate the realization of these studies. The exercise of this graduate's culmination consists on the defence of the study of feasibility of those projects that each municipality identifies as priority for its development.
Video Shot Boundary Recognition Based on Adaptive Locality Preserving Projections
Yongliang Xiao
2013-01-01
Full Text Available A novel video shot boundary recognition method is proposed, which includes two stages of video feature extraction and shot boundary recognition. Firstly, we use adaptive locality preserving projections (ALPP to extract video feature. Unlike locality preserving projections, we define the discriminating similarity with mode prior probabilities and adaptive neighborhood selection strategy which make ALPP more suitable to preserve the local structure and label information of the original data. Secondly, we use an optimized multiple kernel support vector machine to classify video frames into boundary and nonboundary frames, in which the weights of different types of kernels are optimized with an ant colony optimization method. Experimental results show the effectiveness of our method.
Source localization using recursively applied and projected (RAP) MUSIC
Mosher, J.C. [Los Alamos National Lab., NM (United States); Leahy, R.M. [Univ. of Southern California, Los Angeles, CA (United States). Signal and Image Processing Inst.
1998-03-01
A new method for source localization is described that is based on a modification of the well known multiple signal classification (MUSIC) algorithm. In classical MUSIC, the array manifold vector is projected onto an estimate of the signal subspace, but errors in the estimate can make location of multiple sources difficult. Recursively applied and projected (RAP) MUSIC uses each successively located source to form an intermediate array gain matrix, and projects both the array manifold and the signal subspace estimate into its orthogonal complement. The MUSIC projection is then performed in this reduced subspace. Using the metric of principal angles, the authors describe a general form of the RAP-MUSIC algorithm for the case of diversely polarized sources. Through a uniform linear array simulation, the authors demonstrate the improved Monte Carlo performance of RAP-MUSIC relative to MUSIC and two other sequential subspace methods, S and IES-MUSIC.
Enhancing Students’ Local Knowledge Through Themed Garden Project
Esa Norizan
2015-01-01
Full Text Available Traditional or local knowledge is a major issue to be focused on, particularly since the implementation of the Strategic Plan for Biodiversity 2011–2020 and the Aichi Targets “Living in Harmony with Nature”. According to the strategic goals, by 2020, conservation of biodiversity and its sustainable use incorporate what local and indigenous communities have within their traditional knowledge, innovation and practice and their customary use of biological resources are respected at all relevant levels. The older generation among the local people usually use medicinal herbs for various ailments, health care and other cultural purposes. However, encroaching industrialization and the changes in today’s life styles are responsible for the decreasing practice in the local use of herbs especially for healing purposes. It is, therefore, felt worthwhile to encourage young generations such as school children to gain knowledge about these local herbs and record the native uses of these herbs before the information is lost. One biodiversity education program was conducted to facilitate secondary school students to set up a themed garden and find out the local knowledge of the plants they grew in their garden from their family members or communities. The findings revealed that students’ local knowledge on healing improved after they joined the program. Therefore, it is proposed that the themed garden project can enhance students’ local knowledge.
Dissecting the roles of local packing density and longer-range effects in protein sequence evolution
Shahmoradi, Amir
2015-01-01
What are the structural determinants of protein sequence evolution? A number of site-specific structural characteristics have been proposed, most of which are broadly related to either the density of contacts or the solvent accessibility of individual residues. Most importantly, there has been disagreement in the literature over the relative importance of solvent accessibility and local packing density for explaining site-specific sequence variability in proteins. We show here that this discussion has been confounded by the definition of local packing density. The most commonly used measures of local packing, such as the contact number and the weighted contact number, represent by definition the combined effects of local packing density and longer-range effects. As an alternative, we here propose a truly local measure of packing density around a single residue, based on the Voronoi cell volume. We show that the Voronoi cell volume, when calculated relative to the geometric center of amino-acid side chains, be...
Local kinetic-energy density of the Airy gas
Vitos, Levente; Johansson, B.; Kollár, J.
2000-01-01
The Airy gas model is used to derive an expression for the local kinetic energy in the linear potential approximation. The expression contains an explicit Laplacian term 2/5((h) over bar(2)/2m)del(mu)(2)(r) that, according to jellium surface calculations, must be a universal feature of any accura...
Local space density and formation rate of planetary nebulae
Pottasch, [No Value
1996-01-01
Individual distances of 50 nearby planetary nebulae are determined using a variety of methods, but excluding statistical methods or distance scales. These distances, together with a discussion of the sample completeness, are used to determine local PN formation rate. Together with the brightness of
Project Hetura: Reflections on an International Local Government Partnership
Susan Gheller
2010-12-01
Full Text Available The objective of this paper is to provide an overview of the Townsville/Port Moresby partnership activities and explore the challenges and benefits to both Councils from the perspective of a Townsville City Council employee associated with the program. Since 2002, Townsville City Council has been engaged in a capacity building project with the National Capital District Commission (NCDC in Port Moresby, Papua New Guinea. The project, named Hetura, means mateship or friendship in Moto, the predominant language group in Port Moresby. Project Hetura is coordinated through the Commonwealth Local Government Forum’ (CLGF Good Practice Scheme with funding from AusAID. Townsville City Council provides in-kind support through the contribution of staff time and participation while the National Capital District Commission provides a budget allocation for the project. The overarching goal of Project Hetura is to strengthen management, planning, and governance within the NCDC and to improve the capacity of the organisation to deliver efficient, responsive, accountable services to the community. Rather than engaging in a traditional consultancy, the approach by participants of Project Hetura has been that of a partnership built through a relationship of trust and good-will developed over time between the two organisations. Within this partnership, the skills and contributions of all parties are valued, and team members work together to develop sustainable solutions to identified problems.
Advancing Fog Effect on VRML and X3D Using Local Fog Density
Seongah Chin
2004-01-01
In this paper an improved fog effect algorithm in VRML and X3 D is presented with respect to expressing density. The fundamental idea in the approach is to adapt local fog density having influence on Iocal regions with various grades of fog density whereas existing VRML and X3 D only make use of global fog effect. Several filters for making different fog density are presented along with experiments showing the correctness of the proposed method.
High regression rate, high density hybrid fuels Project
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...
Assessing local resources and culture before instituting quality improvement projects.
Hawkins, C Matthew
2014-12-01
The planning phases of quality improvement projects are commonly overlooked. Disorganized planning and implementation can escalate chaos, intensify resistance to change, and increase the likelihood of failure. Two important steps in the planning phase are (1) assessing local resources available to aid in the quality improvement project and (2) evaluating the culture in which the desired change is to be implemented. Assessing local resources includes identifying and engaging key stakeholders and evaluating if appropriate expertise is available for the scope of the project. This process also involves engaging informaticists and gathering available IT tools to plan and automate (to the extent possible) the data-gathering, analysis, and feedback steps. Culture in a department is influenced by the ability and willingness to manage resistance to change, build consensus, span boundaries between stakeholders, and become a learning organization. Allotting appropriate time to perform these preparatory steps will increase the odds of successfully performing a quality improvement project and implementing change. Copyright © 2014 American College of Radiology. Published by Elsevier Inc. All rights reserved.
Tekwa, Edward W; Gonzalez, Andrew; Loreau, Michel
2015-09-07
Cooperation plays a crucial role in many aspects of biology. We use the spatial ecological metrics of local densities to measure and model cooperative interactions. While local densities can be found as technical details in current theories, we aim to establish them as central to an approach that describes spatial effects in the evolution of cooperation. A resulting local interaction model neatly partitions various spatial and non-spatial selection mechanisms. Furthermore, local densities are shown to be fundamental for important metrics of game theory, multilevel selection theory and inclusive fitness theory. The corresponding metrics include structure coefficients, spatial variance, contextual covariance, relatedness, and inbreeding coefficient or F-statistics. Local densities serve as the basis of an emergent spatial theory that draws from and brings unity to multiple theories of cooperation.
Palm Vein Verification Using Multiple Features and Locality Preserving Projections
Ali Mohsin Al-juboori
2014-01-01
Full Text Available Biometrics is defined as identifying people by their physiological characteristic, such as iris pattern, fingerprint, and face, or by some aspects of their behavior, such as voice, signature, and gesture. Considerable attention has been drawn on these issues during the last several decades. And many biometric systems for commercial applications have been successfully developed. Recently, the vein pattern biometric becomes increasingly attractive for its uniqueness, stability, and noninvasiveness. A vein pattern is the physical distribution structure of the blood vessels underneath a person’s skin. The palm vein pattern is very ganglion and it shows a huge number of vessels. The attitude of the palm vein vessels stays in the same location for the whole life and its pattern is definitely unique. In our work, the matching filter method is proposed for the palm vein image enhancement. New palm vein features extraction methods, global feature extracted based on wavelet coefficients and locality preserving projections (WLPP, and local feature based on local binary pattern variance and locality preserving projections (LBPV_LPP have been proposed. Finally, the nearest neighbour matching method has been proposed that verified the test palm vein images. The experimental result shows that the EER to the proposed method is 0.1378%.
Palm vein verification using multiple features and locality preserving projections.
Al-Juboori, Ali Mohsin; Bu, Wei; Wu, Xiangqian; Zhao, Qiushi
2014-01-01
Biometrics is defined as identifying people by their physiological characteristic, such as iris pattern, fingerprint, and face, or by some aspects of their behavior, such as voice, signature, and gesture. Considerable attention has been drawn on these issues during the last several decades. And many biometric systems for commercial applications have been successfully developed. Recently, the vein pattern biometric becomes increasingly attractive for its uniqueness, stability, and noninvasiveness. A vein pattern is the physical distribution structure of the blood vessels underneath a person's skin. The palm vein pattern is very ganglion and it shows a huge number of vessels. The attitude of the palm vein vessels stays in the same location for the whole life and its pattern is definitely unique. In our work, the matching filter method is proposed for the palm vein image enhancement. New palm vein features extraction methods, global feature extracted based on wavelet coefficients and locality preserving projections (WLPP), and local feature based on local binary pattern variance and locality preserving projections (LBPV_LPP) have been proposed. Finally, the nearest neighbour matching method has been proposed that verified the test palm vein images. The experimental result shows that the EER to the proposed method is 0.1378%.
Local random phase approximation with projected oscillator orbitals
Mussard, Bastien
2015-01-01
An approximation to the many-body London dispersion energy in molecular systems is expressed as a functional of the occupied orbitals only. The method is based on the local-RPA theory. The occupied orbitals are localized molecular orbitals and the virtual space is described by projected oscillator orbitals, i.e. functions obtained by multiplying occupied localized orbitals with solid spherical harmonic polynomials having their origin at the orbital centroids. Since we are interested in the long-range part of the correlation energy, responsible for dispersion forces, the electron repulsion is approximated by its multipolar expansion. This procedure leads to a fully non-empirical long-range correlation energy expression. Molecular dispersion coefficients calculated from determinant wave functions obtained by a range-separated hybrid method reproduce experimental values with less than 15% error.
Liu, Song; Zhu, Lizhe; Sheong, Fu Kit; Wang, Wei; Huang, Xuhui
2017-01-30
We present an efficient density-based adaptive-resolution clustering method APLoD for analyzing large-scale molecular dynamics (MD) trajectories. APLoD performs the k-nearest-neighbors search to estimate the density of MD conformations in a local fashion, which can group MD conformations in the same high-density region into a cluster. APLoD greatly improves the popular density peaks algorithm by reducing the running time and the memory usage by 2-3 orders of magnitude for systems ranging from alanine dipeptide to a 370-residue Maltose-binding protein. In addition, we demonstrate that APLoD can produce clusters with various sizes that are adaptive to the underlying density (i.e., larger clusters at low-density regions, while smaller clusters at high-density regions), which is a clear advantage over other popular clustering algorithms including k-centers and k-medoids. We anticipate that APLoD can be widely applied to split ultra-large MD datasets containing millions of conformations for subsequent construction of Markov State Models. © 2016 Wiley Periodicals, Inc. © 2016 Wiley Periodicals, Inc.
ZHU Shouxian; ZHANG Wenjing
2008-01-01
Much has been written of the error in computing the baroclinic pressure gradient (BPG) with sigma coordinates in ocean or atmos- pheric numerical models. The usual way to reduce the error is to subtract area-averaged density stratification of the whole computa- tion region. But if there is great difference between the area-averaged and the local averaged density stratification, the error will be obvious. An example is given to show that the error from this method may be larger than that from no correction sometimes. The definition of local area is put forward. Then, four improved BPG difference schemes of subtracting the local averaged density strat- ification are designed to reduce the error. Two of them are for diagnostic calculation (density field is fixed), and the others are for prognostic calculation (density field is not fixed). The results show that the errors from these schemes all significantly decrease.
Quan, Tingwei; Zhu, Hongyu; Liu, Xiaomao; Liu, Yongfeng; Ding, Jiuping; Zeng, Shaoqun; Huang, Zhen-Li
2011-08-29
Localization-based super-resolution microscopy (or called localization microscopy) rely on repeated imaging and localization of active molecules, and the spatial resolution enhancement of localization microscopy is built upon the sacrifice of its temporal resolution. Developing algorithms for high-density localization of active molecules is a promising approach to increase the speed of localization microscopy. Here we present a new algorithm called SSM_BIC for such purpose. The SSM_BIC combines the advantages of the Structured Sparse Model (SSM) and the Bayesian Information Criterion (BIC). Through simulation and experimental studies, we evaluate systematically the performance between the SSM_BIC and the conventional Sparse algorithm in high-density localization of active molecules. We show that the SSM_BIC is superior in processing single molecule images with weak signal embedded in strong background.
Generation of localized magnetic moments in the charge-density-wave state
Akzyanov, R. S.; Rozhkov, A. V.
2014-01-01
We propose a mechanism explaining the generation of localized magnetic moments in charge-density-wave compounds. Our model Hamiltonian describes an Anderson impurity placed in a host material exhibiting the charge-density wave. There is a region of the model's parameter space, where even weak Coulomb repulsion on the impurity site is able to localize the magnetic moment on the impurity. The phase diagram of a single impurity at T=0 is mapped. To establish the connection with experiment thermo...
Dynamics of Spontaneous Emission Controlled by Local Density of States in Photonic Crystals
Lodahl, Peter; Nikolaev, Ivan S.; van Driel, A. Floris;
2006-01-01
We have measured time-resolved spontaneous emission from quantum dots in 3D photonic crystals. Due to the spatially dependent local density of states, the distribution of decay rates varies strongly with the photonic crystal lattice parameter.......We have measured time-resolved spontaneous emission from quantum dots in 3D photonic crystals. Due to the spatially dependent local density of states, the distribution of decay rates varies strongly with the photonic crystal lattice parameter....
Direct mapping of local redox current density on a monolith electrode by laser scanning.
Lee, Seung-Woo; Lopez, Jeffrey; Saraf, Ravi F
2013-09-15
An optical method of mapping local redox reaction over a monolith electrode using simple laser scanning is described. As the optical signal is linearly proportional to the maximum redox current that is measured concomitantly by voltammetry, the optical signal quantitatively maps the local redox current density distribution. The method is demonstrated on two types of reactions: (1) a reversible reaction where the redox moieties are ionic, and (2) an irreversible reaction on two different types of enzymes immobilized on the electrode where the reaction moieties are nonionic. To demonstrate the scanning capability, the local redox behavior on a "V-shaped" electrode is studied where the local length scale and, hence, the local current density, is nonuniform. The ability to measure the current density distribution by this method will pave the way for multianalyte analysis on a monolith electrode using a standard three-electrode configuration. The method is called Scanning Electrometer for Electrical Double-layer (SEED).
Local virial theorems and closed-orbit theory for spatial density oscillations in fermionic systems
Roccia, J; Koch, A; Murthy, M V N
2009-01-01
We investigate the particle and kinetic energy densities for a system of $N$ fermions confined in a local mean-field potential $V({\\bf r})$. For spherical harmonic oscillators in arbitrary dimensions, exact linear relations between kinetic and potential energy density, termed "local virial theorems", and some exact (integro-) differential equations for the particle density have been earlier derived. Here we use a recently developed semiclassical theory for density oscillations [J. Roccia and M. Brack, Phys. Rev. Lett. {\\bf 100}, 200408 (2008)] to generalize these theorems to arbitrary potentials and test their validity for various anharmonic potentials. We also discuss the relevance of our results for density functional theory. We show, in particular, that the Thomas-Fermi functional for a suitably defined kinetic energy density reproduces the quantum shell oscillations correctly to leading order in the oscillating parts.
Robledo, L. M.
2010-06-01
I discuss the inadequacy of the 'projected density' prescription to be used in density-dependent forces/functionals when calculations beyond mean field are pursued. The case of calculations aimed at the symmetry restoration of mean fields obtained with effective realistic forces of the Skyrme or Gogny type is considered in detail. It is shown that, at least for the restoration of spatial symmetries like rotations, translations or parity, the above prescription yields catastrophic results for the energy that drive the intrinsic wave-function to configurations with infinite deformation, thereby preventing its use both in projection after and before variation.
Robledo, L M
2010-01-01
I discuss the inadequacy of the "projected density" prescription to be used in density dependent forces/functionals when calculations beyond mean field are pursued. The case of calculations aimed at the symmetry restoration of mean fields obtained with effective realistic forces of the Skyrme or Gogny type is considered in detail. It is shown that at least for the restoration of spatial symmetries like rotations, translations or parity the above prescription yields catastrophic results for the energy that drive the intrinsic wave function to configurations with infinite deformation, preventing thereby its use both in projection after and before variation.
Building projected entangled pair states with a local gauge symmetry
Zohar, Erez; Burrello, Michele
2016-04-01
Tensor network states, and in particular projected entangled pair states (PEPS), suggest an innovative approach for the study of lattice gauge theories, both from a pure theoretic point of view, and as a tool for the analysis of the recent proposals for quantum simulations of lattice gauge theories. In this paper we present a framework for describing locally gauge invariant states on lattices using PEPS. The PEPS constructed hereby shall include both bosonic and fermionic states, suitable for all combinations of matter and gauge fields in lattice gauge theories defined by either finite or compact Lie groups.
Building Projected Entangled Pair States with a Local Gauge Symmetry
Zohar, Erez
2015-01-01
Tensor network states, and in particular projected entangled pair states (PEPS), suggest an innovative approach for the study of lattice gauge theories, both from a pure theoretic point of view, and as a tool for the analysis of the recent proposals for quantum simulations of lattice gauge theories. In this paper we present a framework for describing locally gauge invariant states on lattices using PEPS. The PEPS constructed hereby shall include both bosonic and fermionic states, suitable for all combinations of matter and gauge fields in lattice gauge theories defined by either finite or compact Lie groups.
Project Responder: technology needs for local emergency response
Beakley, Guy; Garwin, Thomas; Pollard, Neal A.; Singley, George T., III; Tuohy, Robert V.; Lupo, Jasper
2003-09-01
Since April 2001, the Oklahoma City National Memorial Institute for the Prevention of Terrorism has funded an effort by Hicks &Associates, Inc. and the Terrorism Research Center, Inc., aimed ultimately at improving local, state, and federal emergency responders" capabilities for mitigating the effects of chemical, biological, radiological, nuclear or explosive/ incendiary (CBRNE) terrorism. This effort, titled "Project Responder," began by developing an understanding of how state and local responders view their current capabilities, shortfalls, and needs. This paper discusses some of the results of this first phase of the effort that has resulted in a comprehensive report titled "Emergency Responders" Needs, Goals, and Priorities." This paper addresses two of the capabilities from that report which we believe are of most interest to this conference. There are ten other capabilities discussed in the report, which may also be of interest.
128x128 Ultra-High Density Optical Interconnect Project
National Aeronautics and Space Administration — Future NASA programs like Tertiary Planet Finder (TPF) require high-density deformable mirrors with up to 16,000 actuators to enable direct imaging of planets around...
Refractory Coated/Lined Low Density Structures Project
National Aeronautics and Space Administration — The innovation in this proposed effort is the development of refractory coated or lined low density structures. Lightweight structures are desirable for space...
128x128 Ultra-High Density Optical Interconnect Project
National Aeronautics and Space Administration — Future NASA programs like Tertiary Planet Finder (TPF) require high density deformable mirrors with upto 16,000 actuators to enable direct imaging of planets around...
Ultra-Low-Density (ULD) Polymer Matrix Composites (PMCs) Project
National Aeronautics and Space Administration — This NASA Phase I SBIR proposal seeks to demonstrate a new class of ultra-low-density (ULD) polymer matrix composites of high specific modulus and specific strength...
Chemically and Thermally Stable High Energy Density Silicone Composites Project
National Aeronautics and Space Administration — Thermal energy storage systems with 300 ? 1000 kJ/kg energy density through either phase changes or chemical heat absorption are sought by NASA. This proposed effort...
Sips, K.; Craps, M.; Dewulf, A.
2013-01-01
Local community participation in complex technological projects, where technological innovations and risks need to be managed, is notoriously challenging. Relations with local inhabitants easily take the form of exclusion, protest, controversy or litigation. While such projects represent
Alatas, Husin; Sumaryada, Tony I.; Ahmad, Faozan
2015-01-01
We have investigated the characteristics of local density of optical states (LDOS) at photonic band gap resonant wavelength of an asymmetric waveguide grating based on Green's function formulation. It is found that the LDOS of the considered structure exhibits different characteristics in its localization between the upper and lower resonant wavelengths of the corresponding photonic band gap edges.
Metal-insulator transition and local moment formation: A spin-density functional approach
Ghazali, A.; Leroux-Hugon, P.
1980-01-01
A more thorough description of the metal-insulator transition in correlated systems including local moment formation may be achieved through the spin-density functional method when compared to the Hubbard model. We have applied this method to doped semiconductors and found a transition between an insulating phase with local moments and a metallic one without moments.
High Power Density, Lightweight Thermoelectric Metamaterials for Energy Harvesting Project
National Aeronautics and Space Administration — The objective of this project is to precisely control the flow of thermal, electrical and thermoelectrical energy by advancing the development of a new class of...
Non-Local Density Functional Description of Poly-Para-Phenylene Vinylene
ZHENG Guang; Clark S. J.; Brand S.; Abram R. A.
2007-01-01
A fully non-local exchange-correlation formalism within the framework of density functional theory, known as the weighted density approximation (WDA), has been applied to the conjugated polymer poly-para-phenylene vinylene (PPV) and is shown to lead to a marked improvement in the agreement of theory and experiment for the electronic band structure of the conjugated polymer. In particular, some new model WDA functions are developed, which substantially increase the electronic band gap of the polymer relative to those obtained with the local density approximation and generalized gradient approximation. The calculated band gap of PPV is quantitatively or at 1east semiquantitatively in agreement with the experimental data.
Woodworth, Bradley K; Wheelwright, Nathaniel T; Newman, Amy E M; Norris, D Ryan
2017-08-01
Knowledge of the density-dependent processes that regulate animal populations is key to understanding, predicting, and conserving populations. In migratory birds, density-dependence is most often studied during the breeding season, yet we still lack a robust understanding of the reproductive traits through which density influences individual reproductive success. We used 27-yr of detailed, individual-level productivity data from an island-breeding population of Savannah sparrows Passerculus sandwichensis to evaluate effects of local and total annual population density on female reproductive success. Local density (number of neighbors within 50 m of a female's nest) had stronger effects on the number of young fledged than did total annual population density. Females nesting in areas of high local density were more likely to suffer nest predation and less likely to initiate and fledge a second clutch, which led to fewer young fledged in a season. Fledging fewer young subsequently decreased the likelihood of a female recruiting offspring into the breeding population in a subsequent year. Collectively, these results provide insight into the scale and reproductive mechanisms mediating density-dependent reproductive success and fitness in songbirds. © 2017 by the Ecological Society of America.
Modulating toroidal flow stabilization of edge localized modes with plasma density
Cheng, Shikui; Banerjee, Debabrata
2016-01-01
Recent EAST experiments have demonstrated mitigation and suppression of edge localized modes (ELMs) with toroidal rotation flow in higher collisionality regime, suggesting potential roles of plasma density. In this work, the effects of plasma density on the toroidal flow stabilization of the high-$n$ edge localized modes have been extensively studied in linear calculations for a circular-shaped limiter H-mode tokamak, using the extended MHD code NIMROD. In the single MHD model, toroidal flow has a weak stabilizing effects on the high-$n$ modes. Such a stabilization, however, can be significantly enhanced with the increase in plasma density. Furthermore, our calculations show that the enhanced stabilization of high-$n$ modes from toroidal flow with higher edge plasma density persists in the 2-fluid MHD model. These findings may explain the ELM mitigation and suppression by toroidal rotation in higher collisionality regime due to the enhancement of plasma density obtained in recent EAST experiments.
Freihoelser Forst Local Training Area rehabilitation project. Final report
Hinchman, R.R.; Zellmer, S.D.; Johnson, D.O.; Severinghaus, W.D.; Brent, J.J. [Army Construction Engineering Research Lab., Champaign, IL (United States). Environmental Div.
1991-12-01
Intensive and continued use of the Freihoelser Forst Local Training Area (LTA) for military training activities had resulted in serious environmental problems, exemplified by a lack of vegetative cover and severe erosion by water and wind. The project`s goal was to develop and demonstrate rapid, cost-effective methods to stabilize the LTA`s barren, eroding maneuver areas and make training conditions more realistic. The major factors limiting rehabilitation efforts were the sandy, infertile, and acidic soils. The project was conducted in two phases. Phase I demonstrated and evaluated three separate rehabilitation treatments ranging in cost from moderate to expensive. Each treatment used a different type of soil amendment (fertilizer and straw, compost, or chicken manure), but all used identical seedbed preparation methods and seed mixtures. Phase I was conducted on relatively small replicated plots and was monitored three times during each growing season. All three treatments satisfactorily reestablished vegetation and controlled erosion. Because of their small size, the Phase I demonstration plots had only a minor stabilizing effect on the erosion problems of the LTA as a whole. The Phase II treatment was based on lessons teamed from Phase I and from other revegetation projects in Germany. Phase II revegetated a large area of the LTA, which included nearly all of the most severely disturbed land. Phase II, which was monitored in the same way as Phase I but for a shorter period of time, was highly successful in stabilizing most areas treated. The revegetation plant community was dominated by native grasses and legumes that stabilized the loose, sandy soils and improved the training realism of a major portion of the LTA.
Franco-Pérez, Marco; Ayers, Paul W; Gázquez, José L; Vela, Alberto
2015-12-28
We explore the local and nonlocal response functions of the grand canonical potential density functional at nonzero temperature. In analogy to the zero-temperature treatment, local (e.g., the average electron density and the local softness) and nonlocal (e.g., the softness kernel) intrinsic response functions are defined as partial derivatives of the grand canonical potential with respect to its thermodynamic variables (i.e., the chemical potential of the electron reservoir and the external potential generated by the atomic nuclei). To define the local and nonlocal response functions of the electron density (e.g., the Fukui function, the linear density response function, and the dual descriptor), we differentiate with respect to the average electron number and the external potential. The well-known mathematical relationships between the intrinsic response functions and the electron-density responses are generalized to nonzero temperature, and we prove that in the zero-temperature limit, our results recover well-known identities from the density functional theory of chemical reactivity. Specific working equations and numerical results are provided for the 3-state ensemble model.
Franco-Pérez, Marco, E-mail: francopj@mcmaster.ca, E-mail: ayers@mcmaster.ca, E-mail: jlgm@xanum.uam.mx, E-mail: avela@cinvestav.mx [Department of Chemistry and Chemical Biology, McMaster University, Hamilton, Ontario L8S 4M1 (Canada); Departamento de Química, Universidad Autónoma Metropolitana-Iztapalapa, Av. San Rafael Atlixco 186, México, D.F. 09340 (Mexico); Ayers, Paul W., E-mail: francopj@mcmaster.ca, E-mail: ayers@mcmaster.ca, E-mail: jlgm@xanum.uam.mx, E-mail: avela@cinvestav.mx [Department of Chemistry and Chemical Biology, McMaster University, Hamilton, Ontario L8S 4M1 (Canada); Gázquez, José L., E-mail: francopj@mcmaster.ca, E-mail: ayers@mcmaster.ca, E-mail: jlgm@xanum.uam.mx, E-mail: avela@cinvestav.mx [Departamento de Química, Universidad Autónoma Metropolitana-Iztapalapa, Av. San Rafael Atlixco 186, México, D.F. 09340 (Mexico); Vela, Alberto, E-mail: francopj@mcmaster.ca, E-mail: ayers@mcmaster.ca, E-mail: jlgm@xanum.uam.mx, E-mail: avela@cinvestav.mx [Departamento de Química, Centro de Investigación y de Estudios Avanzados (Cinvestav), Av. Instituto Politécnico Nacional 2508, México, D.F. 07360 (Mexico)
2015-12-28
We explore the local and nonlocal response functions of the grand canonical potential density functional at nonzero temperature. In analogy to the zero-temperature treatment, local (e.g., the average electron density and the local softness) and nonlocal (e.g., the softness kernel) intrinsic response functions are defined as partial derivatives of the grand canonical potential with respect to its thermodynamic variables (i.e., the chemical potential of the electron reservoir and the external potential generated by the atomic nuclei). To define the local and nonlocal response functions of the electron density (e.g., the Fukui function, the linear density response function, and the dual descriptor), we differentiate with respect to the average electron number and the external potential. The well-known mathematical relationships between the intrinsic response functions and the electron-density responses are generalized to nonzero temperature, and we prove that in the zero-temperature limit, our results recover well-known identities from the density functional theory of chemical reactivity. Specific working equations and numerical results are provided for the 3-state ensemble model.
The Environments of Local Luminous Infrared Galaxies: Star Formation Rates increase with Density
Tekola, Abiy G; Berlind, Andreas
2011-01-01
This work studies the environments and star formation relationships of local luminous infrared galaxies (LIRG) in comparison to other types of local and distant z~1 galaxies. The infrared (IR) galaxies are drawn from the IRAS sample. The density of the environment is quantified using 6dF and Point Source Catalogue redshift survey (PSCz) galaxies in a cylinder of 2 Mpc radius and 10 Mpc length. Our most important result shows the existence of a dramatic density difference between local LIRGs and local non-LIRG IR galaxies. LIRGs live in denser environments than non-LIRG IR galaxies implying that L_IR = 10^11 L_sun marks an important transition point among IR-selected local galaxies. We also find that there is a strong correlation between the densities around LIRGs and their L_IR luminosity. On the other hand, the IR-activity of non-LIRG IR galaxies does not show any dependence on environment. Moreover, it is noted that the star formation rate and density around LIRGs are correlated. This trend in local LIRGs i...
Approximate particle number projection for finite range density dependent forces
Valor, A; Robledo, L M
1996-01-01
The Lipkin-Nogami method is generalized to deal with finite range density dependent forces. New expressions are derived and realistic calculations with the Gogny force are performed for the nuclei ^{164}Er and ^{168}Er. The sharp phase transition predicted by the mean field approximation is washed out by the Lipkin-Nogami approach; a much better agreement with the experimental data is reached with the new approach than with the Hartree-Fock_Bogoliubov one, specially at high spins.
Shahmoradi, Amir; Wilke, Claus O
2016-06-01
What are the structural determinants of protein sequence evolution? A number of site-specific structural characteristics have been proposed, most of which are broadly related to either the density of contacts or the solvent accessibility of individual residues. Most importantly, there has been disagreement in the literature over the relative importance of solvent accessibility and local packing density for explaining site-specific sequence variability in proteins. We show that this discussion has been confounded by the definition of local packing density. The most commonly used measures of local packing, such as contact number and the weighted contact number, represent the combined effects of local packing density and longer-range effects. As an alternative, we propose a truly local measure of packing density around a single residue, based on the Voronoi cell volume. We show that the Voronoi cell volume, when calculated relative to the geometric center of amino-acid side chains, behaves nearly identically to the relative solvent accessibility, and each individually can explain, on average, approximately 34% of the site-specific variation in evolutionary rate in a data set of 209 enzymes. An additional 10% of variation can be explained by nonlocal effects that are captured in the weighted contact number. Consequently, evolutionary variation at a site is determined by the combined effects of the immediate amino-acid neighbors of that site and effects mediated by more distant amino acids. We conclude that instead of contrasting solvent accessibility and local packing density, future research should emphasize on the relative importance of immediate contacts and longer-range effects on evolutionary variation. Proteins 2016; 84:841-854. © 2016 Wiley Periodicals, Inc.
A projection and density estimation method for knowledge discovery.
Stanski, Adam; Hellwich, Olaf
2012-01-01
A key ingredient to modern data analysis is probability density estimation. However, it is well known that the curse of dimensionality prevents a proper estimation of densities in high dimensions. The problem is typically circumvented by using a fixed set of assumptions about the data, e.g., by assuming partial independence of features, data on a manifold or a customized kernel. These fixed assumptions limit the applicability of a method. In this paper we propose a framework that uses a flexible set of assumptions instead. It allows to tailor a model to various problems by means of 1d-decompositions. The approach achieves a fast runtime and is not limited by the curse of dimensionality as all estimations are performed in 1d-space. The wide range of applications is demonstrated at two very different real world examples. The first is a data mining software that allows the fully automatic discovery of patterns. The software is publicly available for evaluation. As a second example an image segmentation method is realized. It achieves state of the art performance on a benchmark dataset although it uses only a fraction of the training data and very simple features.
A projection and density estimation method for knowledge discovery.
Adam Stanski
Full Text Available A key ingredient to modern data analysis is probability density estimation. However, it is well known that the curse of dimensionality prevents a proper estimation of densities in high dimensions. The problem is typically circumvented by using a fixed set of assumptions about the data, e.g., by assuming partial independence of features, data on a manifold or a customized kernel. These fixed assumptions limit the applicability of a method. In this paper we propose a framework that uses a flexible set of assumptions instead. It allows to tailor a model to various problems by means of 1d-decompositions. The approach achieves a fast runtime and is not limited by the curse of dimensionality as all estimations are performed in 1d-space. The wide range of applications is demonstrated at two very different real world examples. The first is a data mining software that allows the fully automatic discovery of patterns. The software is publicly available for evaluation. As a second example an image segmentation method is realized. It achieves state of the art performance on a benchmark dataset although it uses only a fraction of the training data and very simple features.
Distribution of local density of states in superstatistical random matrix theory
Abul-Magd, A.Y. [Department of Mathematics, Faculty of Science, Zagazig University, Zagazig (Egypt)]. E-mail: a_y_abul_magd@hotmail.com
2007-07-02
We expose an interesting connection between the distribution of local spectral density of states arising in the theory of disordered systems and the notion of superstatistics introduced by Beck and Cohen and recently incorporated in random matrix theory. The latter represents the matrix-element joint probability density function as an average of the corresponding quantity in the standard random-matrix theory over a distribution of level densities. We show that this distribution is in reasonable agreement with the numerical calculation for a disordered wire, which suggests to use the results of theory of disordered conductors in estimating the parameter distribution of the superstatistical random-matrix ensemble.
Sun, Jianwei; Perdew, John P.; Yang, Zenghui; Peng, Haowei
2016-05-01
The uniform electron gas and the hydrogen atom play fundamental roles in condensed matter physics and quantum chemistry. The former has an infinite number of electrons uniformly distributed over the neutralizing positively charged background, and the latter only one electron bound to the proton. The uniform electron gas was used to derive the local spin density approximation to the exchange-correlation functional that undergirds the development of the Kohn-Sham density functional theory. We show here that the ground-state exchange-correlation energies of the hydrogen atom and many other 1- and 2-electron systems are modeled surprisingly well by a different local spin density approximation (LSDA0). LSDA0 is constructed to satisfy exact constraints but agrees surprisingly well with the exact results for a uniform two-electron density in a finite, curved three-dimensional space. We also apply LSDA0 to excited or noded 1-electron densities, where it works less well. Furthermore, we show that the localization of the exact exchange hole for a 1- or 2-electron ground state can be measured by the ratio of the exact exchange energy to its optimal lower bound.
Local offspring density and sex ratio affect sex allocation in the great tit
Michler, Stephanie P. M.; Nicolaus, Marion; van der Velde, Marco; Radersma, Reinder; Ubels, Richard; Both, Christiaan; Komdeur, Jan; Tinbergen, Joost M.
2013-01-01
The expected fitness gain for offspring of a given sex may depend on local population sex ratio and density. Knowing the influence of such social factors on brood sex ratios may contribute considerably to the understanding of sex allocation in higher vertebrates. For 3 consecutive years, we
Forster transfer and the local optical density of states in erbium-doped silica
de Dood, MJA; Knoester, J; Tip, A; Polman, A
2005-01-01
dOptically excited erbium ions incorporated near the surface of a silica glass decay by spontaneous emission and-at high Er concentration-via Forster energy transfer to quenching sites. By externally modifying the photonic microstructure we vary the local optical density of states (LDOS) in samples
V.V. Eremenko
2016-06-01
Full Text Available The electron local density of states (LDOS are calculated for graphene with isolated vacancies, divacancies and vacancy group of four nearest-neighbor vacancies. A strong anisotropy of behavior of LDOS near Fermi level is demonstrated for atoms near defect. Effect of next-to-nearest neighbor interaction on the properties of graphene with vacancies is established.
Local offspring density and sex ratio affect sex allocation in the great tit
Michler, Stephanie P. M.; Nicolaus, Marion; van der Velde, Marco; Radersma, Reinder; Ubels, Richard; Both, Christiaan; Komdeur, Jan; Tinbergen, Joost M.
2013-01-01
The expected fitness gain for offspring of a given sex may depend on local population sex ratio and density. Knowing the influence of such social factors on brood sex ratios may contribute considerably to the understanding of sex allocation in higher vertebrates. For 3 consecutive years, we manipula
Do sex-specific densities affect local survival of free-ranging great tits?
Michler, Stephanie P. M.; Nicolaus, Marion; Ubels, Richard; van der Velde, Marco; Both, Christiaan; Tinbergen, Joost M.; Komdeur, Jan
2011-01-01
Competition within sexes is expected when resources are sex specific, whereas competition between sexes can occur when similar resources are exploited. Local population density and sex ratio will determine the amount of sex-specific interactions and thus the potential degree of sex-specific
Controlling fluorescent proteins by manipulating the local density of photonic states
Blum, Christian; Cesa, Yanina; Broek, van den Johanna M.; Mosk, Allard P.; Subramaniam, Vinod; Vos, Willem L.; Campagnola, Paul J.; Stelzer, Ernst H.K.; Bally, von Gert
2009-01-01
We present the first demonstration of control of the emission lifetime of a biological emitter by manipulating the local density of optical states (LDOS). LDOS control is achieved by positioning the emitters at defined distances from a metallic mirror. This results in a characteristic oscillation in
Electromagnetic local density of states in graphene-covered porous silicon carbide
Zhou, Ting [Department of Physics, Nanchang University, Nanchang 330031 (China); Wang, Tong-Biao, E-mail: tbwang@ncu.edu.cn [Department of Physics, Nanchang University, Nanchang 330031 (China); Liao, Qing-Hua; Liu, Jiang-Tao; Yu, Tian-Bao [Department of Physics, Nanchang University, Nanchang 330031 (China); Liu, Nian-Hua [Institute for Advanced Study, Nanchang University, Nanchang 330031 (China)
2017-06-21
Surface phonon polariton supported by silicon carbide (SiC) can be strongly coupled with graphene plasmon in the graphene-covered SiC bulk. The spectrum of the electromagnetic local density of states exhibits two peaks whose positions can be tuned by the chemical potential of graphene. In this work, we study the electromagnetic local density of states in the proximity of a graphene-covered SiC with periodic hole arrays. The well-known peak from the coupling of surface polariton supported by SiC and graphene plasmon splits into two. With increased volume ratio of holes, one of the split peak shifts towards high frequencies, whereas the other moves towards low frequencies. The dependence of split-peak positions on the chemical potential and permittivity of filling materials in the holes are also investigated. This study offers another method of modulating the electromagnetic local density of states. - Highlights: • The electromagnetic local density of states in the proximity of graphene-covered anisotropic SiC is firstly studied. • The peak from resonance of surface phonon polaritons in the EM-LDOS spectrum can be split into two. • The split peaks can be tuned by chemical potential, filling factor, and filling materials. • Our results provide a new method to modulate the EM-LDOS.
Mapping the Local Density of Optical States of a Photonic Crystal with Single Quantum Dots
Wang, Qin; Stobbe, Søren; Lodahl, Peter
2011-01-01
We use single self-assembled InGaAs quantum dots as internal probes to map the local density of optical states of photonic crystal membranes. The employed technique separates contributions from nonradiative recombination and spin-flip processes by properly accounting for the role of the exciton...
Definition of current density in the presence of a non-local potential.
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.
Green's Dyadic, Spectral Function, Local Density of States, and Fluctuation Dissipation Theorem
Chew, W C; Dai, Q I
2015-01-01
The spectral functions are studied in conjunction with the dyadic Green's functions for various media. The dyadic Green's functions are found using the eigenfunction expansion method for homogeneous, inhomogeneous, periodic, lossless, lossy, and anisotropic media, guided by the Bloch- Floquet theorem. For the lossless media cases, the spectral functions can be directly related to the photon local density of states, and hence, to the electromagnetic energy density. For the lossy case, the spectral function can be related to the ?eld correlation function. Because of these properties, one can derive properties for ?eld correlations and the Langevin-source correlations without resorting to the uctuation dissipation theorem. The results are corroborated by the uctuation dissipation theorem. An expression for the local density of states for lossy, inhomogeneous, and dispersive media has also been suggested.
Measurement of local current density of all-vanadium redox flow batteries
Hsieh, Wen-Yen; Leu, Chih-Hsing; Wu, Chun-Hsing; Chen, Yong-Song
2014-12-01
This article presents a preliminary study of the measurement of local current density in all-vanadium redox flow batteries. Two batteries are designed and manufactured in this study, and the experimental results are compared. In the first cell, the current collector is divided into 25 segments, and the flow field plate is not segmented, whereas in the other cell, the flow field plate is segmented. The effects of the electrolyte flow rate on the battery efficiencies and the local current density variation are investigated. The experimental results show that the current density near the outlet significantly decreases when the discharge capacity approaches zero. In addition, the battery has a larger discharge depth at a higher electrolyte flow rate.
Coral reef degradation is not correlated with local human population density
Bruno, John F.; Valdivia, Abel
2016-07-01
The global decline of reef-building corals is understood to be due to a combination of local and global stressors. However, many reef scientists assume that local factors predominate and that isolated reefs, far from human activities, are generally healthier and more resilient. Here we show that coral reef degradation is not correlated with human population density. This suggests that local factors such as fishing and pollution are having minimal effects or that their impacts are masked by global drivers such as ocean warming. Our results also suggest that the effects of local and global stressors are antagonistic, rather than synergistic as widely assumed. These findings indicate that local management alone cannot restore coral populations or increase the resilience of reefs to large-scale impacts. They also highlight the truly global reach of anthropogenic warming and the immediate need for drastic and sustained cuts in carbon emissions.
Local gene density predicts the spatial position of genetic loci in the interphase nucleus.
Murmann, Andrea E; Gao, Juntao; Encinosa, Marissa; Gautier, Mathieu; Peter, Marcus E; Eils, Roland; Lichter, Peter; Rowley, Janet D
2005-11-15
Specific chromosomal translocations are hallmarks of many human leukemias. The basis for these translocation events is poorly understood, but it has been assumed that spatial positioning of genes in the nucleus of hematopoietic cells is a contributing factor. Analysis of the nuclear 3D position of the gene MLL, frequently involved in chromosomal translocations and five of its translocation partners (AF4, AF6, AF9, ENL and ELL), and two control loci revealed a characteristic radial distribution pattern in all hematopoietic cells studied. Genes in areas of high local gene density were found positioned towards the nuclear center, whereas genes in regions of low gene density were detected closer to the nuclear periphery. The gene density within a 2 Mbp window was found to be a better predictor for the relative positioning of a genomic locus within the cell nucleus than the gene density of entire chromosomes. Analysis of the position of MLL, AF4, AF6 and AF9 in cell lines carrying chromosomal translocations involving these genes revealed that the position of the normal genes was different from that of the fusion genes, and this was again consistent with the changes in local gene density within a 2 Mbp window. Thus, alterations in gene density directly at translocation junctions could explain the change in the position of affected genes in leukemia cells.
Symmetry-broken local-density approximation for one-dimensional systems
Rogers, Fergus J M; Loos, Pierre-François
2016-01-01
Within density-functional theory, the local-density approximation (LDA) correlation functional is typically built by fitting the difference between the near-exact and Hartree-Fock (HF) energies of the uniform electron gas (UEG), together with analytic perturbative results from the high- and low-density regimes. Near-exact energies are obtained by performing accurate diffusion Monte Carlo calculations, while HF energies are usually assumed to be the Fermi fluid HF energy. However, it has been known since the seminal work of Overhauser that one can obtain lower, symmetry-broken (SB) HF energies at any density. Here, we have computed the SBHF energies of the one-dimensional UEG and constructed a SB version of the LDA (SBLDA) from the results. We compare the performance of the LDA and SBLDA functionals when applied to one-dimensional systems, including atoms and molecules. Generalization to higher dimensions is also discussed.
Local Area Networks--The ENFI Project (Writing on the College Campus).
Stine, Linda
1989-01-01
Describes Electronic Networks for Interaction (ENFI), a local area network project developed at Gallaudet University to empower students with hearing impairments. Notes that this project can be adapted easily for use with traditional students. (MM)
Local activation time sampling density for atrial tachycardia contact mapping: how much is enough?
Williams, Steven E; Harrison, James L; Chubb, Henry; Whitaker, John; Kiedrowicz, Radek; Rinaldi, Christopher A; Cooklin, Michael; Wright, Matthew; Niederer, Steven; O'Neill, Mark D
2017-04-03
Local activation time (LAT) mapping forms the cornerstone of atrial tachycardia diagnosis. Although anatomic and positional accuracy of electroanatomic mapping (EAM) systems have been validated, the effect of electrode sampling density on LAT map reconstruction is not known. Here, we study the effect of chamber geometry and activation complexity on optimal LAT sampling density using a combined in silico and in vivo approach. In vivo 21 atrial tachycardia maps were studied in three groups: (1) focal activation, (2) macro-re-entry, and (3) localized re-entry. In silico activation was simulated on a 4×4cm atrial monolayer, sampled randomly at 0.25-10 points/cm2 and used to re-interpolate LAT maps. Activation patterns were studied in the geometrically simple porcine right atrium (RA) and complex human left atrium (LA). Activation complexity was introduced into the porcine RA by incomplete inter-caval linear ablation. In all cases, optimal sampling density was defined as the highest density resulting in minimal further error reduction in the re-interpolated maps. Optimal sampling densities for LA tachycardias were 0.67 ± 0.17 points/cm2 (focal activation), 1.05 ± 0.32 points/cm2 (macro-re-entry) and 1.23 ± 0.26 points/cm2 (localized re-entry), P = 0.0031. Increasing activation complexity was associated with increased optimal sampling density both in silico (focal activation 1.09 ± 0.14 points/cm2; re-entry 1.44 ± 0.49 points/cm2; spiral-wave 1.50 ± 0.34 points/cm2, P density (0.61 ± 0.22 points/cm2 vs. 1.0 ± 0.34 points/cm2, P = 0.0015). Optimal sampling densities can be identified to maximize diagnostic yield of LAT maps. Greater sampling density is required to correctly reveal complex activation and represent activation across complex geometries. Overall, the optimal sampling density for LAT map interpolation defined in this study was ∼1.0-1.5 points/cm2.
Projected current density comparison in tDCS block and smooth FE modeling.
Indahlastari, Aprinda; Chauhan, Munish; Sadleir, Rosalind J
2016-08-01
Current density distribution and projected current density calculation following transcranial direct current stimulation (tDCS) forward model in a human head were compared between two modeling pipelines: block and smooth. Block model was directly constructed from MRI voxel resolution and simulated in C. Smooth models underwent a boundary smoothing process by applying recursive Gaussian filters and simulated in COMSOL. Three smoothing levels were added to determine their effects on current density distribution compared to block models. Median current density percentage differences were calculated in anterior superior temporal gyrus (ASTG), hippocampus (HIP), inferior frontal gyrus (IFG), occipital lobes (OCC) and precentral gyrus (PRC) and normalized against a baseline value. A maximum of + 20% difference in median current density was found for three standard electrode montages: F3-RS, T7-T8 and Cz-Oz. Furthermore, median current density percentage differences in each montage target brain structures were found to be within + 7%. Higher levels of smoothing increased median current density percentage differences in T7-T8 and Cz-Oz target structures. However, while demonstrating similar trends in each montage, additional smoothing levels showed no clear relationship between their smoothing effects and calculated median current density in the five cortical structures. Finally, relative L2 error in reconstructed projected current density was found to be 17% and 21% for block and smooth pipelines, respectively. Overall, a block model workflow may be a more attractive alternative for simulating tDCS stimulation because involves a shorter modeling time and independence from commercial modeling platforms.
Bounds on the local energy density of holographic CFTs from bulk geometry
Fischetti, Sebastian; Wiseman, Toby
2016-01-01
The stress tensor is a basic local operator in any field theory; in the context of AdS/CFT, it is the operator which is dual to the bulk geometry itself. Here we exploit this feature by using the bulk geometry to place constraints on the local energy density in static states of holographic $(2+1)$-dimensional CFTs living on a closed (but otherwise generally curved) spatial geometry. We allow for the presence of a marginal scalar deformation, dual to a massless scalar field in the bulk. For certain vacuum states in which the bulk geometry is well-behaved at zero temperature, we find that the bulk equations of motion imply that the local energy density integrated over specific boundary domains is negative. In the absence of scalar deformations, we use the inverse mean curvature flow to show that if the CFT spatial geometry has spherical topology but non-constant curvature, the local energy density must be positive somewhere. This result extends to other topologies, but only for certain types of vacuum; in parti...
Bounds on the local energy density of holographic CFTs from bulk geometry
Fischetti, Sebastian; Hickling, Andrew; Wiseman, Toby
2016-11-01
The stress tensor is a basic local operator in any field theory; in the context of AdS/CFT, it is the operator which is dual to the bulk geometry itself. Here we exploit this feature by using the bulk geometry to place constraints on the local energy density in static states of holographic (2+1)-dimensional CFTs living on a closed (but otherwise generally curved) spatial geometry. We allow for the presence of a marginal scalar deformation, dual to a massless scalar field in the bulk. For certain vacuum states in which the bulk geometry is well-behaved at zero temperature, we find that the bulk equations of motion imply that the local energy density integrated over specific boundary domains is negative. In the absence of scalar deformations, we use the inverse mean curvature flow to show that if the CFT spatial geometry has spherical topology but non-constant curvature, the local energy density must be positive somewhere. This result extends to other topologies, but only for certain types of vacuum; in particular, for a generic toroidal boundary, the vacuum’s bulk dual must be the zero-temperature limit of a toroidal black hole.
Phototactic number-density flux in the localized bioconvection of Euglena gracilis
Shoji, Erika; Suematsu, Nobuhiko; Nishimori, Hiraku; Awazu, Akinori; Izumi, Shunsuke; Iima, Makoto
2014-11-01
Euglena gracilis is a unicellular phototactic flagellate; it escapes from light sources if the light intensity is higher than 200 W/m2 (negative phototaxis). When the suspension of E. gracilis is illuminated from the bottom by strong light, bioconvection patterns are generated. In the case of E. gracilis, the patterns can be spatially localized. The localization mechanism has not been clarified. We report experimental results related to the localization mechanism. In particular, we experimentally measured the strength of the phototaxis in the lateral direction as well as vertical direction. We prepared a thin container in which the suspension is included, and gave the linearly-changing light intensity. We found the number density gets a peak at a particular light intensity, which never happens if the suspension has the vertical phototaxis only. Further, we succeeded in getting the function representing lateral phototaxis. The relationship between the measured functions and the localized convection cells will be also reported.
Tonatiuh Rangel
2015-06-01
Full Text Available Using benzenediamine and benzenedithiol molecular junctions as benchmarks, we investigate the widespread analysis of the quantum transport conductance in terms of the projected density of states (PDOS onto molecular orbitals (MOs. We first consider two different methods for identifying the relevant MOs: (1 diagonalization of the Hamiltonian of the isolated molecule and (2 diagonalization of a submatrix of the junction Hamiltonian constructed by considering only basis elements localized on the molecule. We find that these two methods can lead to substantially different MOs and hence PDOS. Furthermore, within Method 1, the PDOS can differ depending on the isolated molecule chosen to represent the molecular junction (e.g., with or without dangling bonds; within Method 2, the PDOS depends on the chosen basis set. We show that these differences can be critical when the PDOS is used to provide a physical interpretation of the conductance (especially when its value is small, as it happens typically at zero bias. In this work, we propose a new approach in an attempt to reconcile the two traditional methods. Although some improvements were achieved, the main problems remain unsolved. Our results raise more general questions and doubts on a PDOS-based analysis of the conductance.
Exact density functional and wave function embedding schemes based on orbital localization
Hégely, Bence; Nagy, Péter R.; Ferenczy, György G.; Kállay, Mihály
2016-08-01
Exact schemes for the embedding of density functional theory (DFT) and wave function theory (WFT) methods into lower-level DFT or WFT approaches are introduced utilizing orbital localization. First, a simple modification of the projector-based embedding scheme of Manby and co-workers [J. Chem. Phys. 140, 18A507 (2014)] is proposed. We also use localized orbitals to partition the system, but instead of augmenting the Fock operator with a somewhat arbitrary level-shift projector we solve the Huzinaga-equation, which strictly enforces the Pauli exclusion principle. Second, the embedding of WFT methods in local correlation approaches is studied. Since the latter methods split up the system into local domains, very simple embedding theories can be defined if the domains of the active subsystem and the environment are treated at a different level. The considered embedding schemes are benchmarked for reaction energies and compared to quantum mechanics (QM)/molecular mechanics (MM) and vacuum embedding. We conclude that for DFT-in-DFT embedding, the Huzinaga-equation-based scheme is more efficient than the other approaches, but QM/MM or even simple vacuum embedding is still competitive in particular cases. Concerning the embedding of wave function methods, the clear winner is the embedding of WFT into low-level local correlation approaches, and WFT-in-DFT embedding can only be more advantageous if a non-hybrid density functional is employed.
Brooks, Jeremy S; Waylen, Kerry A; Borgerhoff Mulder, Monique
2012-12-26
Community-based conservation (CBC) promotes the idea that conservation success requires engaging with, and providing benefits for, local communities. However, CBC projects are neither consistently successful nor free of controversy. Innovative recent studies evaluating the factors associated with success and failure typically examine only a single resource domain, have limited geographic scope, consider only one outcome, or ignore the nested nature of socioecological systems. To remedy these issues, we use a global comparative database of CBC projects identified by systematic review to evaluate success in four outcome domains (attitudes, behaviors, ecological, economic) and explore synergies and trade-offs among these outcomes. We test hypotheses about how features of the national context, project design, and local community characteristics affect these measures of success. Using bivariate analyses and multivariate proportional odds logistic regressions within a multilevel analysis and model-fitting framework, we show that project design, particularly capacity-building in local communities, is associated with success across all outcomes. In addition, some characteristics of the local community in which projects are conducted, such as tenure regimes and supportive cultural beliefs and institutions, are important for project success. Surprisingly, there is little evidence that national context systematically influences project outcomes. We also find evidence of synergies between pairs of outcomes, particularly between ecological and economic success. We suggest that well-designed and implemented projects can overcome many of the obstacles imposed by local and national conditions to succeed in multiple domains.
Density of states controls Anderson localization in disordered photonic crystal waveguides
Garcia-Fernández, David; Smolka, Stephan; Stobbe, Søren
2010-01-01
-of-plane losses are non-negligible, ℓe can be approximated to be the localization length ξ. The extinction mean-free path shows a fivefold variation between the low- and the high-DOS regime, and it becomes shorter than the sample length thus giving rise to strongly confined modes. The dispersive behavior of ℓe......We prove Anderson localization in a disordered photonic crystal waveguide by measuring the ensemble-averaged extinction mean-free path, ℓe, which is controlled by the dispersion in the photon density of states (DOS) of the photonic crystal waveguide. Except for the very low DOS case, where out...
Orbital localization, charge transfer, and band gaps in semilocal density-functional theory.
Armiento, R; Kümmel, S
2013-07-19
We derive an exchange energy functional of generalized gradient form with a corresponding potential that changes discontinuously at integer particle numbers. The functional is semilocal, yet incorporates key features that are connected to the derivative discontinuity of Kohn-Sham density-functional theory. We validate our construction for several paradigm systems and explain how it addresses central well-known deficiencies of antecedent semilocal methods, i.e., the description of charge transfer, properly localized orbitals, and band gaps. We find, e.g., an improved shell structure for atoms, eigenvalues that more closely correspond to ionization energies, and an improved description of band structure where localized states are lowered in energy.
Olsen, Thomas; Thygesen, Kristian S.
2012-01-01
while chemical bond strengths and absolute correlation energies are systematically underestimated. In this work we extend the RPA by including a parameter-free renormalized version of the adiabatic local-density (ALDA) exchange-correlation kernel. The renormalization consists of a (local) truncation...... of the ALDA kernel for wave vectors q > 2kF, which is found to yield excellent results for the homogeneous electron gas. In addition, the kernel significantly improves both the absolute correlation energies and atomization energies of small molecules over RPA and ALDA. The renormalization can...
Ergodic Properties of Local Spectral Density for a Conservative System of Coupled Quantum States
Starovoitov, V S
2002-01-01
The shape and the inverse participation ratio (IPR) of local spectral density (LSD) are studied for a generic isolated system of coupled quantum states, the Hamiltonian of which is represented by a band random matrix with the disordered leading diagonal. We find for the matrices with arbitrary small band that the lack of ergodicity for LSD can be associated with an exponential increase in IPR with the ratio $v/\\Delta_c$ ($v$ - the root of mean square for off-diagonal matrix elements, $\\Delta_c$ - the energy spacing between directly coupled basis states). Criterions specifying transition to localization and ergodicity for LSD are considered.
Fitting density models to observational data - The local Schmidt law in molecular clouds
Lombardi, Marco; Alves, João
2013-01-01
We consider the general problem of fitting a parametric density model to discrete observations, taken to follow a non-homogeneous Poisson point process. This class of models is very common, and can be used to describe many astrophysical processes, including the distribution of protostars in molecular clouds. We give the expression for the likelihood of a given spatial density distribution of protostars and apply it to infer the most probable dependence of the protostellar surface density on the gas surface density. Finally, we apply this general technique to model the distribution of protostars in the Orion molecular cloud and robustly derive the local star formation scaling (Schmidt) law for a molecular cloud. We find that in this cloud the protostellar surface density, \\Sigma_YSO, is directly proportional to the square gas column density, here expressed as infrared extinction in the K-band, A_K: more precisely, \\Sigma_YSO = (1.65 +/- 0.19) A_K^(2.03 +/- 0.15) stars pc^-2.
Sofaer, Helen R; Skagen, Susan K; Barsugli, Joseph J; Rashford, Benjamin S; Reese, Gordon C; Hoeting, Jennifer A; Wood, Andrew W; Noon, Barry R
2016-09-01
Climate change poses major challenges for conservation and management because it alters the area, quality, and spatial distribution of habitat for natural populations. To assess species' vulnerability to climate change and target ongoing conservation investments, researchers and managers often consider the effects of projected changes in climate and land use on future habitat availability and quality and the uncertainty associated with these projections. Here, we draw on tools from hydrology and climate science to project the impact of climate change on the density of wetlands in the Prairie Pothole Region of the USA, a critical area for breeding waterfowl and other wetland-dependent species. We evaluate the potential for a trade-off in the value of conservation investments under current and future climatic conditions and consider the joint effects of climate and land use. We use an integrated set of hydrological and climatological projections that provide physically based measures of water balance under historical and projected future climatic conditions. In addition, we use historical projections derived from ten general circulation models (GCMs) as a baseline from which to assess climate change impacts, rather than historical climate data. This method isolates the impact of greenhouse gas emissions and ensures that modeling errors are incorporated into the baseline rather than attributed to climate change. Our work shows that, on average, densities of wetlands (here defined as wetland basins holding water) are projected to decline across the U.S. Prairie Pothole Region, but that GCMs differ in both the magnitude and the direction of projected impacts. However, we found little evidence for a shift in the locations expected to provide the highest wetland densities under current vs. projected climatic conditions. This result was robust to the inclusion of projected changes in land use under climate change. We suggest that targeting conservation towards wetland
Sofaer, Helen; Skagen, Susan; Barsugli, Joseph J.; Rashford, Benjamin S.; Reese, Gordon C.; Hoeting, Jennifer A.; Wood, Andrew W.; Noon, Barry R.
2016-01-01
Climate change poses major challenges for conservation and management because it alters the area, quality, and spatial distribution of habitat for natural populations. To assess species’ vulnerability to climate change and target ongoing conservation investments, researchers and managers often consider the effects of projected changes in climate and land use on future habitat availability and quality and the uncertainty associated with these projections. Here, we draw on tools from hydrology and climate science to project the impact of climate change on the density of wetlands in the Prairie Pothole Region of the USA, a critical area for breeding waterfowl and other wetland-dependent species. We evaluate the potential for a trade-off in the value of conservation investments under current and future climatic conditions and consider the joint effects of climate and land use. We use an integrated set of hydrological and climatological projections that provide physically based measures of water balance under historical and projected future climatic conditions. In addition, we use historical projections derived from ten general circulation models (GCMs) as a baseline from which to assess climate change impacts, rather than historical climate data. This method isolates the impact of greenhouse gas emissions and ensures that modeling errors are incorporated into the baseline rather than attributed to climate change. Our work shows that, on average, densities of wetlands (here defined as wetland basins holding water) are projected to decline across the U.S. Prairie Pothole Region, but that GCMs differ in both the magnitude and the direction of projected impacts. However, we found little evidence for a shift in the locations expected to provide the highest wetland densities under current vs. projected climatic conditions. This result was robust to the inclusion of projected changes in land use under climate change. We suggest that targeting conservation towards wetland
Nagesh, Jayashree; Brumer, Paul; Izmaylov, Artur F
2016-01-01
We extend the localized operator partitioning method (LOPM) [J. Nagesh, A.F. Izmaylov, and P. Brumer, J. Chem. Phys. 142, 084114 (2015)] to the time-dependent density functional theory (TD-DFT) framework to partition molecular electronic energies of excited states in a rigorous manner. A molecular fragment is defined as a collection of atoms using Stratman-Scuseria-Frisch atomic partitioning. A numerically efficient scheme for evaluating the fragment excitation energy is derived employing a resolution of the identity to preserve standard one- and two-electron integrals in the final expressions. The utility of this partitioning approach is demonstrated by examining several excited states of two bichromophoric compounds: 9-((1-naphthyl)-methyl)-anthracene and 4-((2-naphthyl)-methyl)-benzaldehyde. The LOPM is found to provide nontrivial insights into the nature of electronic energy localization that are not accessible using simple density difference analysis.
Universal dynamics of density correlations at the transition to the many-body localized state
Mierzejewski, M.; Herbrych, J.; Prelovšek, P.
2016-12-01
Within one-dimensional disordered models of interacting fermions, we perform a numerical study of several dynamical density correlations, which can serve as hallmarks of the transition to the many-body localized state. The results confirm that density-wave correlations exhibit quite an abrupt change with increasing disorder, with a nonvanishing long-time value characteristic for the nonergodic phase. In addition, our results reveal a logarithmic variation of correlations in time in a wide time window, which we can bring in connection with the anomalous behavior of the dynamical conductivity near the transition. Our results support the view that the transition to many-body localization can be characterized by universal dynamical exponents.
Caixia Lv
2016-06-01
Full Text Available Synaptic ribbons are structures made largely of the protein Ribeye that hold synaptic vesicles near release sites in non-spiking cells in some sensory systems. Here, we introduce frameshift mutations in the two zebrafish genes encoding for Ribeye and thus remove Ribeye protein from neuromast hair cells. Despite Ribeye depletion, vesicles collect around ribbon-like structures that lack electron density, which we term “ghost ribbons.” Ghost ribbons are smaller in size but possess a similar number of smaller vesicles and are poorly localized to synapses and calcium channels. These hair cells exhibit enhanced exocytosis, as measured by capacitance, and recordings from afferent neurons post-synaptic to hair cells show no significant difference in spike rates. Our results suggest that Ribeye makes up most of the synaptic ribbon density in neuromast hair cells and is necessary for proper localization of calcium channels and synaptic ribbons.
The Van der Waals interaction of the hydrogen molecule an exact local energy density functional
Choy, T C
1999-01-01
We verify that the van der Waals interaction and hence all dispersion interactions for the hydrogen molecule given by: W''= -{A/R^6}-{B/R^8}-{C/R^10}- ..., in which R is the internuclear separation, are exactly soluble. The constants A=6.4990267..., B=124.3990835 ... and C=1135.2140398... (in Hartree units) first obtained approximately by Pauling and Beach (PB) [1] using a linear variational method, can be shown to be obtainable to any desired accuracy via our exact solution. In addition we shall show that a local energy density functional can be obtained, whose variational solution rederives the exact solution for this problem. This demonstrates explicitly that a static local density functional theory exists for this system. We conclude with remarks about generalising the method to other hydrogenic systems and also to helium.
Titantah, John Tatini; Karttunen, Mikko
2013-10-21
Structure and dynamics of water remain a challenge. Resolving the properties of hydrogen bonding lies at the heart of this puzzle. We employ ab initio Molecular Dynamics (AIMD) simulations over a wide temperature range. The total simulation time was ≈ 2 ns. Both bulk water and water in the presence of a small hydrophobic molecule were simulated. We show that large-angle jumps and bond bifurcations are fundamental properties of water dynamics and that they are intimately coupled to both local density and hydrogen bond strength oscillations in scales from about 60 to a few hundred femtoseconds: Local density differences are the driving force for bond bifurcations and the consequent large-angle jumps. The jumps are intimately connected to the recently predicted hydrogen bond energy asymmetry. Our analysis also appears to confirm the existence of the so-called negativity track provided by the lone pairs of electrons on the oxygen atom to enable water rotation.
Probing the local density of states in three dimensions with a scanning single quantum emitter
Schell, Andreas W; Benson, Oliver
2013-01-01
Their intrinsic properties render single quantum systems as ideal tools for quantum enhanced sensing and microscopy. As an additional benefit, their size is typically on an atomic scale which enables sensing with very high spatial resolution. Here, we report on utilizing a single nitrogen vacancy center in nanodiamond for performing three-dimensional scanning-probe fluorescence lifetime imaging microscopy. By measuring changes of the single emitter's lifetime information on the local density of optical states is acquired at the nanoscale. This technique to gather information on the local density of optical states is important for the understanding of fundamental quantum optical processes as well as for the engineering of novel photonic and plasmonic devices.
Generation of localized magnetic moments in the charge-density-wave state
Akzyanov, Ramil S.; Rozhkov, Alexander V.
2015-08-01
We propose a mechanism explaining the generation of localized magnetic moments in charge-density-wave compounds. Our model Hamiltonian describes an Anderson impurity placed in a host material exhibiting the charge-density wave. There is a region of the model's parameter space, where even weak Coulomb repulsion on the impurity site is able to localize the magnetic moment on the impurity. The phase diagram of a single impurity at T = 0 is mapped. To establish the connection with experiment, the thermodynamic properties of a random impurity ensemble is studied. Magnetic susceptibility of the ensemble diverges at low temperature; heat capacity as a function of the magnetic field demonstrates pronounced low field peak. Both features are consistent with experiments on orthorhombic TaS3 and blue bronze.
Global hybrids from the semiclassical atom theory satisfying the local density linear response
Fabiano, E; Cortona, P; Della Sala, F
2015-01-01
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. 106, 186406, (2011)] 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 energetical and structural testings, including thermochemistry and geometry, transition metal complexes, non-covalent 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\\% o...
A second-order projection method for variable-density flows
Bell, John B.; Marcus, Daniel L.
1992-08-01
The second-order projection method presented for variable-density, incompressible flows is based on a second-order, fractional-step scheme in which diffusion-convection terms are advanced without enforcing the compressibility condition. The resulting, intermediate velocity field is then projected onto the space of discretely divergence-free vector fields. Attention is given to the form taken by the method in the cases of finite-amplitude density variation; simplifications for a Boussinesq approximation are given, in conjunction with numerical results validating the method's convergence properties.
Projected gradient algorithms for Hartree-Fock and density matrix functional theory calculations
Cancès, Eric; Pernal, Katarzyna
2008-04-01
We present projected gradient algorithms designed for optimizing various functionals defined on the set of N-representable one-electron reduced density matrices. We show that projected gradient algorithms are efficient in minimizing the Hartree-Fock or the Müller-Buijse-Baerends functional. On the other hand, they converge very slowly when applied to the recently proposed BBk (k =1,2,3) functionals [O. Gritsenko et al., J. Chem. Phys. 122, 204102 (2005)]. This is due to the fact that the BBk functionals are not proper functionals of the density matrix.
Band theoretical investigation of substituted CrO2 within the local density approximation
1994-01-01
The effects of substitutions at différent concentrations within the lattice of CrO2 are investigated assuming ordered configurations. For this purpose we use self-consistent band structure calculations based on the local spin density approximation. All results show an antiparallel spin alignment between host Cr and the substitutional M = Ir, Os, Pt. Depending on the nature of M and its concentration, CrO2 transforms from a half metallic ferromagnet to a halfmetallic or metallic ferrimagnet.
Green Function Approach to the Calculation of the Local Density of States in the Graphitic Nanocone
Smotlacha Jan
2016-01-01
Full Text Available Graphene and other nanostructures belong to the center of interest of today’s physics research. The local density of states of the graphitic nanocone influenced by the spin–orbit interaction was calculated. Numerical calculations and the Green function approach were used to solve this problem. It was proven in the second case that the second order approximation is not sufficient for this purpose.
Enhanced toroidal flow stabilization of edge localized modes with increased plasma density
Cheng, Shikui; Zhu, Ping; Banerjee, Debabrata
2017-09-01
Toroidal flow alone is generally thought to have an important influence on tokamak edge pedestal stability, even though theoretical analysis often predicts merely a weak stabilizing effect of toroidal flow on the edge localized modes (ELMs) in experimental parameter regimes. For the first time, we find from two-fluid MHD calculations that such a stabilization, however, can be significantly enhanced by increasing the edge plasma density. Our finding resolves a long-standing mystery whether or how toroidal rotation can indeed have an effective influence on ELMs, and explains why the ELM mitigation and suppression by toroidal rotation are more favorably achieved in higher collisionality regime in recent experiments. The finding suggests a new control scheme on modulating toroidal flow stabilization of ELMs with plasma density, along with a new additional constraint on the optimal level of plasma density for the desired edge plasma conditions.
Routing Strategy Based on Local Density Sensing in Delay Tolerant Network
Fucai Wang
2014-02-01
Full Text Available Aiming at the interval connectivity and the limitation of available storage and internodes throughput in delay tolerant network, this paper designs a kind of Density-Aware Routing Scheme (DARS for its messaging service. According to the density of nodes, the direction that messages are forwarded to the dense area is decided. The change of correlation time between networks is used to evaluate local density and decide how to exchange information with a certain node met in the process of moving. Simulation results show that the proposed scheme has simplicity and low complexity. In the delay tolerant network of non-uniform node distribution, the message transfer rate and communication overhead get fairly good effect.
Vyboishchikov, Sergei F
2017-09-03
We propose a simple method of calculating the electron correlation energy density e_c(r) and the correlation potential V_c(r) from second-order Møller-Plesset amplitudes and its generalization for the case of a Configuration Interaction wavefunction, based on Nesbet's theorem. The correlation energy density obtained by this method for free and spherically confined Be and He atoms was employed to fit a local analytical density functional based on Wigner's functional. The functional is capable to reproduce a strong increase of the correlation energy with decreasing the confined radius for the Be atom. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
The Local Galaxy Density and the Arm Class of Spiral Galaxies
Giuricin, G; Mardirossian, F; Mezzetti, M
1993-01-01
We have examined the effect of the environmental density on the arm classification of an extensive sample of spiral galaxies included in the Nearby Galaxy Catalog (Tully, 1988a). We have also explored the dependence of the arm class of a galaxy on other factors, such as its blue absolute magnitude and its disk-to-total mass ratio, inferred in the literature either from the gradient of a good galaxy rotation curve or from a photometric mass decomposition method. We have found that the arm class is strongly related to the absolute magnitude in the mid-type spirals (in the sense that grand design galaxies are, on average, more luminous than flocculent objects), whilst this relation is considerably weaker in the early and late types. In general the influence of the local density on the arm structure appears to be much weaker than that of the absolute magnitude. The local density acts essentially in strengthening the arm class--absolute magnitude relation for the mid types, whereas no environmental density effects...
Hao, Feng; Armiento, Rickard; Mattsson, Ann E
2014-05-14
We have previously proposed that further improved functionals for density functional theory can be constructed based on the Armiento-Mattsson subsystem functional scheme if, in addition to the uniform electron gas and surface models used in the Armiento-Mattsson 2005 functional, a model for the strongly confined electron gas is also added. However, of central importance for this scheme is an index that identifies regions in space where the correction provided by the confined electron gas should be applied. The electron localization function (ELF) is a well-known indicator of strongly localized electrons. We use a model of a confined electron gas based on the harmonic oscillator to show that regions with high ELF directly coincide with regions where common exchange energy functionals have large errors. This suggests that the harmonic oscillator model together with an index based on the ELF provides the crucial ingredients for future improved semi-local functionals. For a practical illustration of how the proposed scheme is intended to work for a physical system we discuss monoclinic cupric oxide, CuO. A thorough discussion of this system leads us to promote the cell geometry of CuO as a useful benchmark for future semi-local functionals. Very high ELF values are found in a shell around the O ions, and take its maximum value along the Cu-O directions. An estimate of the exchange functional error from the effect of electron confinement in these regions suggests a magnitude and sign that could account for the error in cell geometry.
Jacob Tagarirofa
2013-02-01
Full Text Available The study sought to evaluate the effectiveness of community participation in rural development projects in Zimbabwe testing the credibility of the popularized supposition that almost all contemporary development efforts characteristically embrace local participation. Public participation is widely assumed to be an essential ingredient for the fruition of rural development efforts. The research made use of quantitative and qualitative research methodologies in which unstructured interviews, focus group discussions and questionnaires were used as data gathering instruments. The analysis of data was enabled by the use of People-Centered Development (PCD as a conceptual framework. Findings revealed that the level of community participation in the district is not only minimal, but it is also top down. This has much to do with the negative perceptions by facilitating agents viewing local people as passive recipients of externally crafted models of development and other factors such as the power dynamics within and between the community and other stakeholders. The research also found preferential treatment of other tribal groups by the facilitating agent, intra group conflicts and bureaucratic and political influence as obstacles militating against effective participation. Based on these findings, and consistent with the wider literature, recommendation are that the nature of community engagement should be based on the principle of equal partnership among all stakeholders as this would encourage full cooperation and thus effective participation.
Parallel and Low-Order Scaling Implementation of Hartree-Fock Exchange Using Local Density Fitting.
Köppl, Christoph; Werner, Hans-Joachim
2016-07-12
Calculations using modern linear-scaling electron-correlation methods are often much faster than the necessary reference Hartree-Fock (HF) calculations. We report a newly implemented HF program that speeds up the most time-consuming step, namely, the evaluation of the exchange contributions to the Fock matrix. Using localized orbitals and their sparsity, local density fitting (LDF), and atomic orbital domains, we demonstrate that the calculation of the exchange matrix scales asymptotically linearly with molecular size. The remaining parts of the HF calculation scale cubically but become dominant only for very large molecular sizes or with many processing cores. The method is well parallelized, and the speedup scales well with up to about 100 CPU cores on multiple compute nodes. The effect of the local approximations on the accuracy of computed HF and local second-order Møller-Plesset perturbation theory energies is systematically investigated, and default values are established for the parameters that determine the domain sizes. Using these values, calculations for molecules with hundreds of atoms in combination with triple-ζ basis sets can be carried out in less than 1 h, with just a few compute nodes. The method can also be used to speed up density functional theory calculations with hybrid functionals that contain HF exchange.
de Lasson, Jakob Rosenkrantz; Kristensen, Philip Trøst
2013-01-01
We present a numerical formalism for solving the Lippmann-Schwinger equation for the electric field in three dimensions. The formalism may be applied to scatterers of different shapes and embedded in different background media, and we develop it in detail for the specific case of spherical scatterers in a homogeneous background medium. In addition, we show how several physically important quantities may readily be calculated with the formalism. These quantities include the extinction cross section, the total Green's tensor, the projected local density of states and the Purcell factor as well as the quasinormal modes of leaky resonators with the associated resonance frequencies and quality factors. We demonstrate the calculations for the well-known plasmonic dimer consisting of two silver nanoparticles and thus illustrate the versatility of the formalism for use in modeling of advanced nanophotonic devices.
Tammam, Salma N; Azzazy, Hassan M E; Breitinger, Hans G; Lamprecht, Alf
2015-12-07
Many recently discovered therapeutic proteins exert their main function in the nucleus, thus requiring both efficient uptake and correct intracellular targeting. Chitosan nanoparticles (NPs) have attracted interest as protein delivery vehicles due to their biocompatibility and ability to escape the endosomes offering high potential for nuclear delivery. Molecular entry into the nucleus occurs through the nuclear pore complexes, the efficiency of which is dependent on NP size and the presence of nuclear localization sequence (NLS). Chitosan nanoparticles of different sizes (S-NPs ≈ 25 nm; L-NP ≈ 150 nm) were formulated, and they were modified with different densities of the octapeptide NLS CPKKKRKV (S-NPs, 0.25, 0.5, 2.0 NLS/nm(2); L-NPs, 0.6, 0.9, 2 NLS/nm(2)). Unmodified and NLS-tagged NPs were evaluated for their protein loading capacity, extent of cell association, cell uptake, cell surface binding, and finally nuclear delivery efficiency in L929 fibroblasts. To avoid errors generated with cell fractionation and nuclear isolation protocols, nuclear delivery was assessed in intact cells utilizing Förster resonance energy transfer (FRET) fluorometry and microscopy. Although L-NPs showed ≈10-fold increase in protein loading per NP when compared to S-NPs, due to higher cell association and uptake S-NPs showed superior protein delivery. NLS exerts a size and density dependent effect on nanoparticle uptake and surface binding, with a general reduction in NP cell surface binding and an increase in cell uptake with the increase in NLS density (up to 8.4-fold increase in uptake of High-NLS-L-NPs (2 NLS/nm(2)) compared to unmodified L-NPs). However, for nuclear delivery, unmodified S-NPs show higher nuclear localization rates when compared to NLS modified NPs (up to 5-fold by FRET microscopy). For L-NPs an intermediate NLS density (0.9 NLS/nm(2)) seems to provide highest nuclear localization (3.7-fold increase in nuclear delivery compared to High
Localized form of Fock terms in nuclear covariant density functional theory
Liang, Haozhao; Ring, Peter; Roca-Maza, Xavier; Meng, Jie
2012-01-01
In most of the successful versions of covariant density functional theory in nuclei, the Fock terms are not included explicitly, which leads to local functionals and forms the basis of their widespread applicability at present. However, it has serious consequences for the description of Gamow-Teller resonances (GTR) and spin-dipole resonances (SDR) which can only be cured by adding further phenomenological parameters. Relativistic Hartree-Fock models do not suffer from these problems. They can successfully describe the GTR and SDR as well as the isovector part of the Dirac effective mass without any additional parameters. However, they are non-local and require considerable numerical efforts. By the zero-range reduction and the Fierz transformation, a new method is proposed to take into account the Fock terms in local functionals, which retains the simplicity of conventional models and provides proper descriptions of the spin-isospin channels and the Dirac masses.
3D Velocity and Density Reconstructions of the Local Universe with Cosmicflows-1
Courtois, Helene M; Tully, R Brent; Gottlober, Stefan
2011-01-01
This paper presents an analysis of the local peculiar velocity field based on the Wiener Filter reconstruction method. We used our currently available catalog of distance measurements containing 1,797 galaxies within 3000 km/s: Cosmicflows-1. The Wiener Filter method is used to recover the full 3D peculiar velocity field from the observed map of radial velocities and to recover the underlying linear density field. The velocity field within a data zone of 3000 km/s is decomposed into a local component that is generated within the data zone and a tidal one that is generated by the mass distribution outside that zone. The tidal component is characterized by a coherent flow toward the Norma-Hydra-Centaurus (Great Attractor) region while the local component is dominated by a flow toward the Virgo Cluster and away from the Local Void. A detailed analysis shows that the local flow is predominantly governed by the Local Void and the Virgo Cluster plays a lesser role. The analysis procedure was tested against a mock c...
Pillet, S; Souhassou, M; Lecomte, C; Schwarz, K; Blaha, P; Rérat, M; Lichanot, A; Roversi, P
2001-05-01
This electron-density study on corundum (alpha-Al2O3) is part of the Multipole Refinement Project supported by the IUCr Commission on Charge, Spin and Momentum Densities. For this purpose, eight different data sets (two experimental and six theoretical) were chosen from which the electron density was derived by multipolar refinement (using the MOLLY program). The two experimental data sets were collected on a conventional CAD4 and at ESRF, ID11 with a CCD detector, respectively. The theoretical data sets consist of static, dynamic, static noisy and dynamic noisy moduli of structure factors calculated at the Hartree-Fock (HF) and density functional theory (DFT) levels. Comparisons of deformation and residual densities show that the multipolar analysis works satisfactorily but also indicate some drawbacks in the refinement. Some solutions and improvements during the refinements are proposed like contraction or expansion of the inner atomic shells or increasing the order of the spherical harmonic expansion.
Simultaneous Localization and Mapping for Planetary Surface Mobility Project
National Aeronautics and Space Administration — ProtoInnovations, LLC and Carnegie Mellon University have formed a partnership to commercially develop localization and mapping technologies for planetary rovers....
Stallings, J. (ed.); García, Magali
2001-01-01
Metadata only record Critical elements of integrated conservation and development (ICD) projects include protecting the environmental integrity of a geographic area over the long term, improving the economic security of local people, and assuring the sustainability of project activities (Ack 1991). Our project has recognized sustainability as a multi-faceted concept that includes four distinct realms: the technical, economic, institutional, and social.
Locally Constructed Analogs (LOCA) Daily CMIP5 Climate Projections
Federal Geographic Data Committee — This archive contains 64 projections of daily LOCA CMIP5 climate over the contiguous United States. This archive includes these meteorological variables at 1/16th...
Locally Constructed Analogs (LOCA) Daily CMIP5 Climate Projections
US Bureau of Reclamation, Department of the Interior — This archive contains 64 projections of daily LOCA CMIP5 climate over the contiguous United States. This archive includes these meteorological variables at 1/16th...
The Structure, Density, and Local Environment Distribution in Ab Initio Liquid Water
Santra, Biswajit; Distasio, Robert A., Jr.; Wu, Xifan; Car, Roberto
2014-03-01
We have performed extensive ab initio molecular dynamics (AIMD) simulations of liquid water at ambient conditions in the canonical (NVT) and isothermal-isobaric (NPT) ensembles to understand the individual and collective importance of exact exchange, van der Waals interactions, and nuclear quantum effects on the structural properties of liquid water. AIMD simulations which include these effects result in oxygen-oxygen radial distribution functions which are in excellent agreement with experiments and a liquid water structure having an equilibrium density within 1% of the experimental value of 1 g/cm3. A detailed analysis of the distribution of local structure in ambient liquid water has revealed that the inherent potential energy surface is bimodal with respect to high- and low-density molecular environments, consistent with the existence of polymorphism in the amorphous phases of water. With these findings in mind, the methodology presented herein overcomes the well-known limitations of semi-local density functional theory (GGA-DFT) providing a detailed and accurate microscopic description of ambient liquid water. DOE: DE-SC0008626, DOE: DE-SC0005180, NSF: CHE-0956500.
GVA Stadelmann
2008-07-01
Full Text Available It is a clinical challenge to obtain a sufficient orthopaedic implant fixation in weak osteoporotic bone. When the primary implant fixation is poor, micromotions occur at the bone-implant interface, activating osteoclasts, which leads to implant loosening. Bisphosphonate can be used to prevent the osteoclastic response, but when administered systemically its bioavailability is low and the time it takes for the drug to reach the periprosthetic bone may be a limiting factor. Recent data has shown that delivering bisphosphonate locally from the implant surface could be an interesting solution. Local bisphosphonate delivery increased periprosthetic bone density, which leads to a stronger implant fixation, as demonstrated in rats by the increased implant pullout force. The aim of the present study was to verify the positive effect on periprosthetic bone remodelling of local bisphosphonate delivery in an osteoporotic sheep model. Four implants coated with zoledronate and two control implants were inserted in the femoral condyle of ovariectomized sheep for 4 weeks. The bone at the implant surface was 50% higher in the zoledronate-group compared to control group. This effect was significant up to a distance of 400µm from the implant surface. The presented results are similar to what was observed in the osteoporotic rat model, which suggest that the concept of releasing zoledronate locally from the implant to increase the implant fixation is not species specific. The results of this trial study support the claim that local zoledronate could increase the fixation of an implant in weak bone.
YAN Hao; WANG Hu; WANG Yong-hui; ZHANG Yu-mei
2013-01-01
Background The classification of Alzheimer's disease (AD) from magnetic resonance imaging (MRI) has been challenged by lack of effective and reliable biomarkers due to inter-subject variability.This article presents a classification method for AD based on kernel density estimation (KDE) of local features.Methods First,a large number of local features were extracted from stable image blobs to represent various anatomical patterns for potential effective biomarkers.Based on distinctive descriptors and locations,the local features were robustly clustered to identify correspondences of the same underlying patterns.Then,the KDE was used to estimate distribution parameters of the correspondences by weighting contributions according to their distances.Thus,biomarkers could be reliably quantified by reducing the effects of further away correspondences which were more likely noises from inter-subject variability.Finally,the Bayes classifier was applied on the distribution parameters for the classification of AD.Results Experiments were performed on different divisions of a publicly available database to investigate the accuracy and the effects of age and AD severity.Our method achieved an equal error classification rate of 0.85 for subject aged 60-80 years exhibiting mild AD and outperformed a recent local feature-based work regardless of both effects.Conclusions We proposed a volumetric brain MRI classification method for neurodegenerative disease based on statistics of local features using KDE.The method may be potentially useful for the computer-aided diagnosis in clinical settings.
Schroer, Bert [Centro Brasileiro de Pesquisas Fisicas (CBPF), Rio de Janeiro, RJ (Brazil)]. E-mail: schroer@cbpf.br
2002-08-01
The lightfront quantization of the 70s is reviewed in the more rigorous setting of lightfront (LF) restriction of free fields in which the lightfront is considered to be linear extension of the upper causal horizon of a wedge region. Particular attention is given to the change of localization structure in passing from the wedge to its horizon which results in the emergence of a transverse quantum mechanical substructure of the QFT on the horizon and its lightfront extension. The vacuum fluctuations of QFT on the LF are compressed into the direction of the lightray (where they become associated with a chiral QFT) and lead to the notion of area density of a 'split localization' entropy. To overcome the limitation of this restriction approach and include interacting theories with non-canonical short distance behavior, we introduce a new concept of algebraic lightfront holography which uses ideas of algebraic QFT, in particular the modular structure of its associated local operator algebras. In this way the localization properties of LF degrees of freedom including the absence of transverse vacuum fluctuations are confirmed to be stable against interactions. The important universality aspect of lightfront holography is emphasized. Only in this way one is able to extract from the 'split-localization' entropy a split-independent additive entropy-like measure of the entanglement of the vacuum upon restriction to the horizon algebra. (author)
Jiawei Luo
Full Text Available Computational approaches aided by computer science have been used to predict essential proteins and are faster than expensive, time-consuming, laborious experimental approaches. However, the performance of such approaches is still poor, making practical applications of computational approaches difficult in some fields. Hence, the development of more suitable and efficient computing methods is necessary for identification of essential proteins.In this paper, we propose a new method for predicting essential proteins in a protein interaction network, local interaction density combined with protein complexes (LIDC, based on statistical analyses of essential proteins and protein complexes. First, we introduce a new local topological centrality, local interaction density (LID, of the yeast PPI network; second, we discuss a new integration strategy for multiple bioinformatics. The LIDC method was then developed through a combination of LID and protein complex information based on our new integration strategy. The purpose of LIDC is discovery of important features of essential proteins with their neighbors in real protein complexes, thereby improving the efficiency of identification.Experimental results based on three different PPI(protein-protein interaction networks of Saccharomyces cerevisiae and Escherichia coli showed that LIDC outperformed classical topological centrality measures and some recent combinational methods. Moreover, when predicting MIPS datasets, the better improvement of performance obtained by LIDC is over all nine reference methods (i.e., DC, BC, NC, LID, PeC, CoEWC, WDC, ION, and UC.LIDC is more effective for the prediction of essential proteins than other recently developed methods.
Luo, Jiawei; Qi, Yi
2015-01-01
Background Computational approaches aided by computer science have been used to predict essential proteins and are faster than expensive, time-consuming, laborious experimental approaches. However, the performance of such approaches is still poor, making practical applications of computational approaches difficult in some fields. Hence, the development of more suitable and efficient computing methods is necessary for identification of essential proteins. Method In this paper, we propose a new method for predicting essential proteins in a protein interaction network, local interaction density combined with protein complexes (LIDC), based on statistical analyses of essential proteins and protein complexes. First, we introduce a new local topological centrality, local interaction density (LID), of the yeast PPI network; second, we discuss a new integration strategy for multiple bioinformatics. The LIDC method was then developed through a combination of LID and protein complex information based on our new integration strategy. The purpose of LIDC is discovery of important features of essential proteins with their neighbors in real protein complexes, thereby improving the efficiency of identification. Results Experimental results based on three different PPI(protein-protein interaction) networks of Saccharomyces cerevisiae and Escherichia coli showed that LIDC outperformed classical topological centrality measures and some recent combinational methods. Moreover, when predicting MIPS datasets, the better improvement of performance obtained by LIDC is over all nine reference methods (i.e., DC, BC, NC, LID, PeC, CoEWC, WDC, ION, and UC). Conclusions LIDC is more effective for the prediction of essential proteins than other recently developed methods. PMID:26125187
High Power Room Temperature Terahertz Local Oscillator Project
National Aeronautics and Space Administration — We propose to build a high-power, room temperature compact continuous wave terahertz local oscillator for driving heterodyne receivers in the 1-5 THz frequency...
Where Does the Density Localize? Convergent Behavior for Global Hybrids, Range Separation, and DFT+U
Gani, Terry Z H
2016-01-01
Approximate density functional theory (DFT) suffers from many-electron self- interaction error, otherwise known as delocalization error, that may be diagnosed and then corrected through elimination of the deviation from exact piecewise linear behavior between integer electron numbers. Although paths to correction of energetic delocalization error are well- established, the impact of these corrections on the electron density is less well-studied. Here, we compare the effect on density delocalization of DFT+U, global hybrid tuning, and range- separated hybrid tuning on a diverse test set of 32 transition metal complexes and observe the three methods to have qualitatively equivalent effects on the ground state density. Regardless of valence orbital diffuseness (i.e., from 2p to 5p), ligand electronegativity (i.e., from Al to O), basis set (i.e., plane wave versus localized basis set), metal (i.e., Ti, Fe, Ni) and spin state, or tuning method, we consistently observe substantial charge loss at the metal and gain ...
The dipole moment of the spin density as a local indicator for phase transitions
Schmitz, D.; Schmitz-Antoniak, C.; Warland, A.; Darbandi, M.; Haldar, S.; Bhandary, S.; Eriksson, O.; Sanyal, B.; Wende, H.
2014-07-01
The intra-atomic magnetic dipole moment - frequently called term - plays an important role in the determination of spin magnetic moments by x-ray absorption spectroscopy for systems with nonspherical spin density distributions. In this work, we present the dipole moment as a sensitive monitor to changes in the electronic structure in the vicinity of a phase transiton. In particular, we studied the dipole moment at the Fe2+ and Fe3+ sites of magnetite as an indicator for the Verwey transition by a combination of x-ray magnetic circular dichroism and density functional theory. Our experimental results prove that there exists a local change in the electronic structure at temperatures above the Verwey transition correlated to the known spin reorientation. Furthermore, it is shown that measurement of the dipole moment is a powerful tool to observe this transition in small magnetite nanoparticles for which it is usually screened by blocking effects in classical magnetometry.
Karaveli, Sinan; Zia, Rashid
2013-01-01
We identify a solid-state quantum emitter whose room-temperature radiative decay is mediated by a nearly equal mixture of isotropic electric dipole (ED) and magnetic dipole (MD) transitions. Using energy-momentum spectroscopy, we experimentally show that the near-infrared $^3$T$_2{\\rightarrow}^3$A$_2$ emission from divalent-nickel-doped magnesium oxide (Ni$^{2+}$:MgO) is composed of $\\sim$50% MD and $\\sim$50% ED transitions. We then demonstrate that the spontaneous emission rate of these ions near planar interfaces is determined by the combined electric and magnetic local density of optical states (LDOS). This electromagnetic LDOS probes the total mode density, and thus similar to thermal emission, these unique electronic emitters effectively excite all polarizations and orientations of the electromagnetic field.
Local distortion in Co-doped LSMO from entropy-maximized charge density distribution
Syed Ali, K.S. [Department of Physics, The Madura College, Madurai 625011 (India); Saravanan, R., E-mail: saragow@dataone.i [Department of Physics, The Madura College, Madurai 625011 (India); Pashchenko, A.V.; Pashchenko, V.P. [Galkin Donetsk Institute of Physics and Technology, National Academy of Sciences of Ukraine, Donetsk 83114 (Ukraine)
2010-07-09
Perovskite structure manganites La{sub 0.67}Sr{sub 0.22}Mn{sub 1.11-x}Co{sub x}O{sub 3} were prepared by the solid state reaction method. An X-ray analysis of the structure was undertaken using the Rietveld technique on the experimental powder X-ray diffraction data and, then, a charge density distribution study was undertaken, using the maximum entropy method (MEM). The charge density in the unit cell was reconstructed and the effect of Co{sup 3+} doping in the Mn-O matrix was studied. Local distortions due to Co doping were analyzed and the results are now discussed.
The dipole moment of the spin density as a local indicator for phase transitions.
Schmitz, D; Schmitz-Antoniak, C; Warland, A; Darbandi, M; Haldar, S; Bhandary, S; Eriksson, O; Sanyal, B; Wende, H
2014-07-21
The intra-atomic magnetic dipole moment - frequently called ⟨Tz⟩ term - plays an important role in the determination of spin magnetic moments by x-ray absorption spectroscopy for systems with nonspherical spin density distributions. In this work, we present the dipole moment as a sensitive monitor to changes in the electronic structure in the vicinity of a phase transiton. In particular, we studied the dipole moment at the Fe(2+) and Fe(3+) sites of magnetite as an indicator for the Verwey transition by a combination of x-ray magnetic circular dichroism and density functional theory. Our experimental results prove that there exists a local change in the electronic structure at temperatures above the Verwey transition correlated to the known spin reorientation. Furthermore, it is shown that measurement of the dipole moment is a powerful tool to observe this transition in small magnetite nanoparticles for which it is usually screened by blocking effects in classical magnetometry.
Landau hamiltonians with random potentials localization and the density of states
Combes, J M; Combes, J M; Hislop, P D
1994-01-01
We prove the existence of localized states at the edges of the bands for the two-dimensional Landau Hamiltonian with a random potential, of arbitrary disorder, provided that the magnetic field is sufficiently large. The corresponding eigenfunctions decay exponentially with the magnetic field and distance. We also prove that the integrated density of states is Lipschitz continuous away from the Landau energies. The proof relies on a Wegner estimate for the finite-area magnetic Hamiltonians with random potentials and exponential decay estimates for the finite-area Green's functions. The proof of the decay estimates for the Green's functions uses fundamental results from two-dimensional bond percolation theory.
A convergent scheme for a non-local coupled system modelling dislocations densities dynamics
Hajj, A. El; Forcadel, N.
2008-06-01
In this paper, we study a non-local coupled system that arises in the theory of dislocations densities dynamics. Within the framework of viscosity solutions, we prove a long time existence and uniqueness result for the solution of this model. We also propose a convergent numerical scheme and we prove a Crandall-Lions type error estimate between the continuous solution and the numerical one. As far as we know, this is the first error estimate of Crandall-Lions type for Hamilton-Jacobi systems. We also provide some numerical simulations.
Observation of spatial fluctuations of the local density of states in random photonic media.
Birowosuto, M D; Skipetrov, S E; Vos, W L; Mosk, A P
2010-07-02
We experimentally study spatial fluctuations of the local density of states (LDOS) inside three-dimensional random photonic media. The LDOS is probed at many positions inside random photonic media by measuring emission rates of a large number of individual fluorescent nanospheres. The emission rates are observed to fluctuate spatially, and the variance of the fluctuations increases with the scattering strength. The measured variance of the emission rates agrees well with a model that takes into account the effect of the nearest scatterer only.
Landau parameters for energy density functionals generated by local finite-range pseudopotentials
Idini, Andrea; Dobaczewski, Jacek
2016-01-01
In Landau theory of Fermi liquids, the particle-hole interaction near the Fermi energy in different spin-isospin channels is probed in terms of an expansion over the Legendre polynomials. This provides a useful and efficient way to constrain properties of nuclear energy density functionals in symmetric nuclear matter and finite nuclei. In this study, we present general expressions for Landau parameters corresponding to a two-body central local regularized pseudopotential. We also show results obtained for two recently adjusted NLO and N$^2$LO parametrizations. Such pseudopotentials will be used to determine mean-field and beyond-mean-field properties of paired nuclei across the entire nuclear chart.
Frankowski, Marek, E-mail: mfrankow@agh.edu.pl; Czapkiewicz, Maciej; Skowronski, Witold; Stobiecki, Tomasz
2014-02-15
We present a model introducing the Landau–Lifshitz–Gilbert equation with a Slonczewski's Spin-Transfer-Torque (STT) component in order to take into account spin polarized current influence on the magnetization dynamics, which was developed as an Object Oriented MicroMagnetic Framework extension. We implement the following computations: magnetoresistance of vertical channels is calculated from the local spin arrangement, local current density is used to calculate the in-plane and perpendicular STT components as well as the Oersted field, which is caused by the vertical current flow. The model allows for an analysis of all listed components separately, therefore, the contribution of each physical phenomenon in dynamic behavior of Magnetic Tunnel Junction (MTJ) magnetization is discussed. The simulated switching voltage is compared with the experimental data measured in MTJ nanopillars.
Resolving phase information of the optical local density of state with scattering near-field probes
Prasad, R.; Vincent, R.
2016-10-01
We theoretically discuss the link between the phase measured using a scattering optical scanning near-field microscopy (s-SNOM) and the local density of optical states (LDOS). A remarkable result is that the LDOS information is directly included in the phase of the probe. Therefore by monitoring the spatial variation of the trans-scattering phase, we locally measure the phase modulation associated with the probe and the optical paths. We demonstrate numerically that a technique involving two-phase imaging of a sample with two different sized tips should allow to obtain the image the pLDOS. For this imaging method, numerical comparison with extinction probe measurement shows crucial qualitative and quantitative improvement.
Voyager 1 in the Local Interstellar Medium: Cosmic-ray Energy Density and Ionization Rate
Cummings, A. C.; Stone, E. C.; Heikkila, B. C.; Lal, N.; Webber, W. R.; Johannesson, G.; Moskalenko, I.; Orlando, E.; Porter, T.
2015-12-01
We present the energy spectra of cosmic ay nuclei and electrons in the local interstellar medium (LISM) from the Cosmic Ray Subsystem on Voyager 1 (V1). We use four models of the local interstellar spectra of nuclei and one of electrons that are constrained by the observations to compute the energy density and ionization rate of atomic H in the LISM above 3 MeV for electrons and protons and above 3 MeV/nuc for nuclei with Z > 1. We find that the total cosmic-ray energy density is in the range 0.82-0.97 eV/cm3, which includes a contribution of 0.023 eV/cm3 from electrons. We find the cosmic-ray ionization rate of atomic H to be in the range 1.45-1.58 x 10-17 s-1, which is a factor of more than 10 below the cosmic-ray ionization rate in diffuse interstellar clouds based on astrochemistry methods. We discuss possible reasons for this difference. Voyager data analysis is supported by NASA Grant NNN12AA012. GALPROP development is supported by NASA Grants NNX13AC47G and NNX10AE78G.
Housing improvement projects in Indonesia: responding to local demand.
Josodipoero, R I
2003-06-01
For more than three decades, environmental health programmes in Indonesia have emphasized prevention and treatment of the high incidence of disease among villagers. One of the main causes of disease is the unhygienic conditions of typical rural houses - two-room constructions with dirt floors and walls of lightly fired bricks or woven bamboo skins. While most houses have few or no windows, the occupants frequently cook, eat, sleep and even keep animals in a single room. The main objective of the housing improvement programme was to improve air circulation and introduce more sunlight to kill bacteria, avoid dampness and eliminate smoke from cooking. The programme encourages villagers to construct a permanent floor, enlarge existing windows or insert new windows for good ventilation. This presentation will share the 'success stories' of housing improvement projects in Indonesia that adopted demand-responsive approaches instead of the conventional 'supply approach'. Through exercises like Wealth Classification and Social Mapping, a demand-responsive approach lets the community decide who is eligible for assistance, resulting in higher participation and accurate information on community demand and on materials needed. In addition to the successes, the failures will be discussed at field level. This presentation will discuss the lessons learned from: the World Bank-funded Kalisemut Case Study; government's Family Welfare Movement; Plan International's project in Yogyakarta, and AusAID-funded Sustainable Development through Community Participation Project in Lombok.
Tagliapietra, V; Rosà, R; Arnoldi, D; Cagnacci, F; Capelli, G; Montarsi, F; Hauffe, H C; Rizzoli, A
2011-12-29
The wood tick Ixodes ricinus, one of the most common arthropod-borne disease vectors, is of increasing relevance for human and animal health in Europe. The aim of this study was to determine the relative contribution of several abiotic and biotic factors potentially affecting questing activity and local abundance of I. ricinus in Italy, considering the scale at which these factors interact with the host-seeking ticks. Within EDEN, a large-scale EU collaborative project on eco-epidemiology of vector-borne diseases, we collected questing ticks for three consecutive years using a standard protocol at eleven sites in the Italian Alps and Apennines. A total of 25 447 I. ricinus were collected. All sites showed the same annual pattern of tick activity (bimodal for nymphs and unimodal for larvae and adults), although the abundance of nymphs was statistically different between sites and years. A Generalized Linear Mixed Model and a Linear Mixed Model fitted to data for nymphs, showed that while the principal variables affecting the local abundance of questing ticks were saturation deficit (an index combining temperature and relative humidity) and red deer density, the most important variable affecting questing nymph activity was saturation deficit. As for the timing of seasonal emergence, we confirmed that the threshold temperature at this latitude for larvae is 10°C (mean maximum) while that for nymphs is 8°C.
Characteristic of Secondary Flow Caused by Local Density Change in Standing Acoustic Fields
Tonsho, Kazuyuki; Hirosawa, Takuya; Kusakawa, Hiroshi; Kuwahara, Takuo; Tanabe, Mitsuaki
Secondary flow is a flow which is caused by the interference between standing acoustic fields and local density change. The behavior of the secondary flow depends on the location of the given local density change in the standing acoustic fields. When the density change is given at the middle of a velocity node and the neighboring velocity anti-node (middle point) or when it is given at the velocity anti-node in standing acoustic fields, the secondary flow shows particular behavior. Characteristic of the secondary flow at the two positions was predicted by numerical simulations. It was examined from these simulations whether the driving mechanism of the flow can be explained by the kind of acoustic radiation force that has been proposed so far. The predicted secondary flow was verified by experiments. For both the simulations and experiments, the standing acoustic fields generated in a cylinder are employed. In the experiments, the acoustic fields are generated by two loud speakers that are vibrated in same phase in a chamber. The employed resonance frequency is about 1000 Hz. The chamber is filled with air of room temperature and atmospheric pressure. In the numerical simulations and experiments, the local density change is given by heating or cooling. Because the secondary flow is influenced by buoyancy, the numerical simulations were done without taking gravity force into account and a part of the experiments were done by the microgravity condition using a drop tower. As a result of the simulations, at the middle point, the heated air was blown toward the node and the cooled air was blown toward the anti-node. It is clarified that the secondary flow is driven by the expected kind of acoustic radiation force. At the anti-node, both the heated and cooled air expands perpendicular to the traveling direction of the sound wave. The driving mechanism of the secondary flow can not be explained by the acoustic radiation force, and a detailed analysis is done. Through the
Puckett, Elbridge Gerry; Almgren, Ann S.; Bell, John B.; Marcus, Daniel L.; Rider, William J.
1997-01-01
We present a numerical method for computing solutions of the incompressible Euler or Navier-Stokes equations when a principal feature of the flow is the presence of an interface between two fluids with different fluid properties. The method is based on a second-order projection method for variable density flows using an "approximate projection" formulation. The boundary between the fluids is tracked with a second-order, volume-of-fluid interface tracking algorithm. We present results for viscious Rayleigh-Taylor problems at early time with equal and unequal viscosities to demonstrate the convergence of the algorithm. We also present computational results for the Rayleigh-Taylor instability in air-helium and for bubbles and drops in an air-water system without surface tension to demonstrate the behavior of the algorithm on problems with large density and viscosity contrasts.
Olney, Cynthia A.; Backus, Joyce E. B.; Klein, Lori J.
2010-01-01
Objectives: Through interviews with the National Library of Medicine's MedlinePlus Go Local collaborators, an evaluation team sought to identify process characteristics that are critical for long-term sustainability of Go Local projects and to describe the impact that Go Local projects have on sponsoring institutions. Methods: Go Local project coordinators (n = 44) at 31 sponsor institutions participated in semi-structured interviews about their experiences developing and maintaining Go Local sites. Interviews were summarized, checked for accuracy by the participating librarians, and analyzed using a general inductive methodology. Results: Institutional factors that support Go Local projects were identified through the interviews, as well as strategies for staffing and partnerships with external organizations. Positive outcomes for sponsoring institutions also were identified. Conclusions: The findings may influence the National Library of Medicine team's decisions about improvements to its Go Local system and the support it provides to sponsoring institutions. The findings may benefit current sponsoring institutions as well as those considering or planning a Go Local project. PMID:20098657
Olney, Cynthia A; Backus, Joyce E B; Klein, Lori J
2010-01-01
Through interviews with the National Library of Medicine's MedlinePlus Go Local collaborators, an evaluation team sought to identify process characteristics that are critical for long-term sustainability of Go Local projects and to describe the impact that Go Local projects have on sponsoring institutions. Go Local project coordinators (n = 44) at 31 sponsor institutions participated in semi-structured interviews about their experiences developing and maintaining Go Local sites. Interviews were summarized, checked for accuracy by the participating librarians, and analyzed using a general inductive methodology. Institutional factors that support Go Local projects were identified through the interviews, as well as strategies for staffing and partnerships with external organizations. Positive outcomes for sponsoring institutions also were identified. The findings may influence the National Library of Medicine team's decisions about improvements to its Go Local system and the support it provides to sponsoring institutions. The findings may benefit current sponsoring institutions as well as those considering or planning a Go Local project.
Managing Project Team in Local Government B.A. Amujiri Abstract ...
Religion Dept
government and discovered that managing project team is indispensable in local governments .... members are properly briefed on the tasks and work involved. It requires the ... implementation structures enabling organizations to coordinate.
Self-maps of p-local infinite projective spaces
LIN XianZu
2012-01-01
Denote by Z(p) (resp.(Z)p) the p localization (resp.p completion) of Z.Then we have the canonical inclusion Z(p) (→) (Z)p.Let S2n-1(p) be the p-local (2n-1)-sphere and let B2n(p) be a connected p-local space satisfying S2n-1(p) (≌) ΩB2n(p); then H*(B2n(p),Z(p)) =Z(p)[u] with ｜u｜ =2n.Define the degree of a self-map f of B2n(p) to be k ∈ Z(p) such that f*(u) =ku.Using the theory of integer-valued polynomials we show that there exists a self-map of B2n(p) of degree k if rand only if k is an n-th power in (Z)p.
Enhancing Development Benefits to Local Communities from Hydropower Projects : A Literature Review
World Bank
2009-01-01
The World Bank began a three-year pilot initiative to develop a framework for enhancing development benefits to local communities in hydropower projects. There has been a wide array of approaches in the past two decades that all have in common the objective of designing and implementing means and mechanisms to ensure local communities a more equitable share of project benefits. The World B...
RAISING LEARNER AWARENESS OF LOCAL WISDOM IN TOUR-RELATED PROJECT TEACHING
2012-01-01
Abstract: This study investigated how CLT (Communicative Language Teaching) and awareness-raising enhanced Thai learners’ awareness of their local wisdom in a tour-related project work with three specific purposes, which were to explore how the learners interacted with textual representations of their local wisdom to create their project, what extent CLT and awareness-raising tasks developed their communicative competence of the target language, and what object of awareness that the tasks cou...
Lücke, O. H.; Arroyo, I. G.
2015-10-01
The eastern part of the oceanic Cocos Plate presents a heterogeneous crustal structure due to diverse origins and ages as well as plate-hot spot interactions which originated the Cocos Ridge, a structure that converges with the Caribbean Plate in southeastern Costa Rica. The complex structure of the oceanic plate directly influences the dynamics and geometry of the subduction zone along the Middle American Trench. In this paper an integrated interpretation of the slab geometry in Costa Rica is presented based on 3-D density modeling of combined satellite and surface gravity data, constrained by available geophysical and geological data and seismological information obtained from local networks. The results show the continuation of steep subduction geometry from the Nicaraguan margin into northwestern Costa Rica, followed by a moderate dipping slab under the Central Cordillera toward the end of the Central American Volcanic Arc. Contrary to commonly assumed, to the southeast end of the volcanic arc, our preferred model shows a steep, coherent slab that extends up to the landward projection of the Panama Fracture Zone. Overall, a gradual change in the depth of the intraplate seismicity is observed, reaching 220 km in the northwestern part, and becoming progressively shallower toward the southeast, where it reaches a maximum depth of 75 km. The changes in the terminal depth of the observed seismicity correlate with the increased density in the modeled slab. The absence of intermediate depth (> 75 km) intraplate seismicity in the southeastern section and the higher densities for the subducted slab in this area, support a model in which dehydration reactions in the subducted slab cease at a shallower depth, originating an anhydrous and thus aseismic slab.
A New Measurement of the Electron Density in the Local Interstellar Medium
Wood, Brian E.; Linsky, Jeffrey L.
1997-01-01
Using the echelle-A grating of the Goddard High-Resolution Spectrograph, we have observed the C II λλ1335, 1336 emission lines of the nearby (d = 13.3 pc) star system Capella (G8 III + G1 III). Interstellar C II absorption features are detected within both stellar emission lines. The ground-state and excited-state C II column densities derived from these absorption lines imply an electron density of ne = 0.11+0.12-0.06 cm-3 in the local interstellar medium (LISM). Unlike previous derivations of ne from Mg II/Mg I ratios, the density suggested by the C II lines is independent of assumptions about ionization equilibrium. Current estimates of the H I density in the LISM are in the range 0.1-0.2 cm-3. The He I/H I ratio toward the white dwarf G191-B2B, which is only 7° from Capella, has been measured to be He I/H I = 0.068-0.082 from the Extreme-Ultraviolet Explorer data. These results indicate hydrogen and helium ionization fractions toward Capella of X(H) = 0.45 +/- 0.25 and X(He) = 0.57 +/- 0.23, respectively, confirming that hydrogen and helium are substantially ionized in the LISM. Based on observations with the NASA/ESA Hubble Space Telescope, obtained at the Space Telescope Science Institute, which is operated by the Association of Universities for Research in Astronomy Inc., under NASA contract NAS5-26555.
The impact of local stellar radiation on the HI column density distribution
Rahmati, Alireza; Pawlik, Andreas H; Raičević, Milan
2013-01-01
It is often assumed that local sources of ionizing radiation have little impact on the distribution of HI in the post-reionization Universe. While this is a good assumption for the IGM, analytic arguments suggest that local sources may typically be more important than the background radiation for high column density absorbers (N_HI > 10^17 /cm^2). We post-process cosmological simulations with accurate radiation transport to investigate the impact of local stellar sources on the HI distribution. We demonstrate that the limited numerical resolution and the simplified treatment of the ISM that are typical of current cosmological simulations provide significant challenges, but that many of the problems can be overcome by taking two steps. First, using ISM particles rather than stellar particles as sources results in a much better sampling of the source distribution. Second, by rescaling the source luminosities so that the amount of radiation escaping into the IGM agrees with that required to produce the observed ...
Johansen, Jeppe; Stobbe, Søren; Nikolaev, I.S.
2007-01-01
We have measured time-resolved spontaneous emission from quantum dots near a dielectric interface with known photonic local density of states. We thus experimentally determine the quantum efficiency and the dipole moment, important for quantum optics.......We have measured time-resolved spontaneous emission from quantum dots near a dielectric interface with known photonic local density of states. We thus experimentally determine the quantum efficiency and the dipole moment, important for quantum optics....
Towards Adaptive Urban Water Management: Up-Scaling Local Projects
Zhou, Qianqian; Quitzau, Maj-Britt; Hoffmann, Birgitte
2013-01-01
Increasingly, the need for adaptive urban water management approaches is advertised, but the transition towards such approaches in the urban water sector seems to be slow. The purpose of this paper is to provide an in-depth study of how an innovative approach has been adopted in practice by looking...... of rainwater. This insight into the processes of learning aggregation of water practices points towards the important role that the dedicated work performed by local facilitators and intermediaries play in relation to a transition towards more adaptive urban water management....
Lai, Dakun; Liu, Chenguang; Eggen, Michael D.; Iaizzo, Paul A.; He, Bin
2011-07-01
Localization of the source of cardiac ectopic activity has direct clinical benefits for determining the location of the corresponding ectopic focus. In this study, a recently developed current-density (CD)-based localization approach was experimentally evaluated in noninvasively localizing the origin of the cardiac ectopic activity from body-surface potential maps (BSPMs) in a well-controlled experimental setting. The cardiac ectopic activities were induced in four well-controlled intact pigs by single-site pacing at various sites within the left ventricle (LV). In each pacing study, the origin of the induced ectopic activity was localized by reconstructing the CD distribution on the endocardial surface of the LV from the measured BSPMs and compared with the estimated single moving dipole (SMD) solution and precise pacing site (PS). Over the 60 analyzed beats corresponding to ten pacing sites (six for each), the mean and standard deviation of the distance between the locations of maximum CD value and the corresponding PSs were 16.9 mm and 4.6 mm, respectively. In comparison, the averaged distance between the SMD locations and the corresponding PSs was slightly larger (18.4 ± 3.4 mm). The obtained CD distribution of activated sources extending from the stimulus site also showed high consistency with the endocardial potential maps estimated by a minimally invasive endocardial mapping system. The present experimental results suggest that the CD method is able to locate the approximate site of the origin of a cardiac ectopic activity, and that the distribution of the CD can portray the propagation of early activation of an ectopic beat.
RAISING LEARNER AWARENESS OF LOCAL WISDOM IN TOUR-RELATED PROJECT TEACHING
Amporn Sa-ngiamwibool
2012-01-01
Full Text Available Abstract: This study investigated how CLT (Communicative Language Teaching and awareness-raising enhanced Thai learners’ awareness of their local wisdom in a tour-related project work with three specific purposes, which were to explore how the learners interacted with textual representations of their local wisdom to create their project, what extent CLT and awareness-raising tasks developed their communicative competence of the target language, and what object of awareness that the tasks could help the learners realize while working on their projects. This study was triangulated. The elicitation instruments were project instructions, CLT and awareness-raising tasks, pretests and posttests based on TOEIC (Test of English for International Communication, learner logs, interviews, and observation notes. The study revealed that, first, on the awareness of local wisdom in a tour-related project work, the learners interacted with textual representations of their local wisdom through theme-centered learning process. Second, on the enhancement of CLT and awareness-raising, CLT allowed the learners to deal with interactive, spontaneous, and more meaningful communication actively while awareness-raising helped the learners consciously focus on semantic, linguistic, and pragmatic aspects of the target language. Lastly, on object of awareness, CLT and awareness-raising tasks could lead the learners to realize these objects of awareness: nature of experiential learning, subject content, and skill content. For pedagogical implications, project-based teaching with the support of CLT and awareness-raising tasks can raise learner awareness of local wisdom in tour-related topics effectively. Pedagogical implications illustrated some practical applications of CLT and awareness-raising tasks for enhancing learner awareness in ESP project work in a Thai classroom. Future inquiry should replicate this study or apply to business or other ESP project instructions
Tailoring correlations of the local density of states in disordered photonic materials
Riboli, F; Monaco, G; Caselli, N; Intonti, F; Gurioli, M; Skipetrov, S E
2016-01-01
We present experimental evidence for the different mechanisms driving the fluctuations of the local density of states (LDOS) in disordered photonic systems. We establish a clear link between the microscopic structure of the material and the frequency correlation function of LDOS accessed by a near-field hyperspectral imaging technique. We show, in particular, that short- and long-range frequency correlations of LDOS are controlled by different physical processes (multiple or single scattering processes, respectively) that can be---to some extent---manipulated independently. We also demonstrate that the single scattering contribution to the LDOS fluctuations is sensitive to subwavelength features of the material and, in particular, to the correlation length of its dielectric function. Our work paves the way towards a complete control of statistical properties of disordered photonic systems, allowing for designing materials with predefined LDOS correlations.
Directional Local Density of States of Classical and Quantum Propagating Surface Plasmons
Berthel, Martin; Jiang, Quanbo; Pham, Aline; Bellessa, Joel; Genet, Cyriaque; Huant, Serge; Drezet, Aurélien
2017-01-01
We theoretically and experimentally introduce the concept of the local density of states (LDOS) associated with propagative surface plasmons (PSPs) launched along a structured thin gold film (a concept we call PSP LDOS). The alternative method couples a near-field optical microscope, in either the classical or the quantum regime of excitation, to a far-field leakage-radiation microscope. This method allows for selecting and collecting a very narrow portion of the directional SP wave vectors, thereby offering sufficient resolution to probe the collimation efficiency of a SP beam for a source near the focal point of a Bragg parabolic reflector. We are able to build and image the PSP LDOS in a fully integrated quantum SP launcher by depositing a diamond nanocrystal hosting nitrogen-vacancy centers at the focal point of the mirror. Our demonstration of the PSP LDOS with quantized SPs offers alternative prospects in the field of quantum plasmonics.
Structure of Eigenstates and Local Spectral Density of States A Three-Orbital Schematic Shell Model
Wang, W; Casati, G; Wang, Wen-ge
1998-01-01
The average shape of the Spectral Local Density of States (LDOS) and eigenfunctions (EFs) has been studied numerically for a conservative dynamical model (three-orbital Lipkin-Meshkov-Glick model) which can exhibit strong chaos in the classical limit. The attention is paid to the comparison of the shape of LDOS with that known for random matrix models, as well as to the shape of the EFs, for different values of the perturbation strength. The classical counterparts of the LDOS has also been studied and found in a remarkable agreement with the quantum calculations. Finally, by making use of a generalization of Brillouin- Wigner perturbation expansion, the form of long tails of LDOS and EFs is given analytically and confirmed numerically.
Schatzl, Magdalena; Glaser, Martin; Brehm, Moritz; Simbula, Angelica; Galli, Matteo; Fromherz, Thomas; Schäffler, Friedrich
2016-01-01
We report on mapping of the local density of states in L3 photonic crystal resonators (PCR) via deterministically positioned single Ge quantum dots (QDs). Perfect site-control of Ge QDs on pre-patterned silicon-on-insulator substrates was exploited to fabricate in one processing run almost 300 L3 PCRs containing single QDs in systematically varying positions in the cavities. The alignment precision of the QD emitters was better than 20 nm. This type of parallel processing is essentially based on standard Si device technologies and is therefore scalable to any number and configuration of PCR structures. As a first demonstrator, we probed the coupling efficiency of a single Ge QD to the L3 cavity modes as a function of their spatial overlap. The results are in excellent agreement with finite-difference time-domain simulations.
Mattsson, Ann E.; Wills, John M.
2013-03-01
The inability to computationally describe the physics governing the properties of actinides and their alloys is the poster child of failure of existing Density Functional Theory exchange-correlation functionals. The intricate competition between localization and delocalization of the electrons, present in these materials, exposes the limitations of functionals only designed to properly describe one or the other situation. We will discuss the manifestation of this competition in real materials and propositions on how to construct a functional able to accurately describe properties of these materials. I addition we will discuss both the importance of using the Dirac equation to describe the relativistic effects in these materials, and the connection to the physics of transition metal oxides. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000.
Broadband enhancement of local density of states using silicon-compatible hyperbolic metamaterials
Wang, Yu; Inampudi, Sandeep; Capretti, Antonio [Department of Electrical and Computer Engineering and Photonics Center, Boston University, 8 Saint Mary' s Street Boston, Massachusetts 02215 (United States); Sugimoto, Hiroshi [Department of Electrical and Computer Engineering and Photonics Center, Boston University, 8 Saint Mary' s Street Boston, Massachusetts 02215 (United States); Department of Electrical and Electronic Engineering, Graduate School of Engineering, Kobe University, Rokkodai, Nada, Kobe 657-8501 (Japan); Fujii, Minoru [Department of Electrical and Electronic Engineering, Graduate School of Engineering, Kobe University, Rokkodai, Nada, Kobe 657-8501 (Japan); Dal Negro, Luca, E-mail: dalnegro@bu.edu [Department of Electrical and Computer Engineering and Photonics Center, Boston University, 8 Saint Mary' s Street Boston, Massachusetts 02215 (United States); Division of Materials Science and Engineering, Boston University, 15 Saint Mary' s Street, Brookline, Massachusetts 02446 (United States)
2015-06-15
Light emitting silicon quantum dots by colloidal synthesis were uniformly spin-coated into a 20 nm-thick film and deposited atop a hyperbolic metamaterial of alternating TiN and SiO{sub 2} sub-wavelength layers. Using steady-state and time-resolved photoluminescence spectroscopy as a function of the emission wavelength in partnership with rigorous electromagnetic modeling of dipolar emission, we demonstrate enhanced Local Density of States and coupling to high-k modes in a broad spectral range. These findings provide an alternative approach for the engineering of novel Si-compatible broadband sources that leverage the control of radiative transitions in hyperbolic metamaterials and the flexibility of the widespread Si platform.
Decay of density waves in coupled one-dimensional many-body-localized systems
Prelovšek, Peter
2016-10-01
This work analyzes the behavior of coupled disordered one-dimensional systems as modelled by identical fermionic Hubbard chains with the on-site potential disorder and coupling emerging through the interchain hopping t'. The study is motivated by the experiment on fermionic cold atoms on a disordered lattice, where a decay rate of the quenched density wave was measured. We present a derivation of the decay rate Γ within perturbation theory and show that, even at large disorder along the chains, the interaction leads to finite Γ >0 , the mechanism being the interaction-induced coupling of in-chain localized and interchain extended single-fermion states. Explicit expressions for Γ are presented for a weak interaction U U >t' . It is shown that, in both regimes, Γ increases with the interchain hopping t', as well as decreases with increasing disorder.
Lim, S. P.; Sheng, D. N.
2016-07-01
A many-body localized (MBL) state is a new state of matter emerging in a disordered interacting system at high-energy densities through a disorder-driven dynamic phase transition. The nature of the phase transition and the evolution of the MBL phase near the transition are the focus of intense theoretical studies with open issues in the field. We develop an entanglement density matrix renormalization group (En-DMRG) algorithm to accurately target highly excited states for MBL systems. By studying the one-dimensional Heisenberg spin chain in a random field, we demonstrate the accuracy of the method in obtaining energy eigenstates and the corresponding statistical results of quantum states in the MBL phase. Based on large system simulations by En-DMRG for excited states, we demonstrate some interesting features in the entanglement entropy distribution function, which is characterized by two peaks: one at zero and another one at the quantized entropy S =ln2 with an exponential decay tail on the S >ln2 side. Combining En-DMRG with exact diagonalization simulations, we demonstrate that the transition from the MBL phase to the delocalized ergodic phase is driven by rare events where the locally entangled spin pairs develop power-law correlations. The corresponding phase diagram contains an intermediate or crossover regime, which has power-law spin-z correlations resulting from contributions of the rare events. We discuss the physical picture for the numerical observations in this regime, where various distribution functions are distinctly different from results deep in the ergodic and MBL phases for finite-size systems. Our results may provide new insights for understanding the phase transition in such systems.
INT-WFS + 2dFGRS The Local Space & Luminosity Density
Cross, N; Lemon, D; Cross, Nicholas; Driver, Simon; Lemon, David
2000-01-01
We discuss the quantification of the local galaxy population and the impact of the ``New Era of Wide-Field Astronomy'' on this field, and, in particular, systematic errors in the measurement of the Luminosity Function. New results from the 2dFGRS are shown in which some of these selection effects have been removed. We introduce an INT-WFS project which will further reduce the selection biases. We show that there is a correlation between the surface brightness and the luminosity of galaxies and that new technologies are having a big impact on this field. Finally selection criteria from different surveys are modelled and it is shown that some of the major selection effects are surface brightness selection effects.
Improvements to local projective noise reduction through higher order and multiscale refinements
Moore, Jack Murdoch; Small, Michael; Karrech, Ali
2015-06-01
The broad spectrum characteristic of signals from nonlinear systems obstructs noise reduction techniques developed for linear systems. Local projection was developed to reduce noise while preserving nonlinear deterministic structures, and a second order refinement to local projection which was proposed ten years ago does so particularly effectively. It involves adjusting the origin of the projection subspace to better accommodate the geometry of the attractor. This paper describes an analytic motivation for the enhancement from which follows further higher order and multiple scale refinements. However, the established enhancement is frequently as or more effective than the new filters arising from solely geometric considerations. Investigation of the way that measurement errors reinforce or cancel throughout the refined local projection procedure explains the special efficacy of the existing enhancement, and leads to a new second order refinement offering widespread gains. Different local projective filters are found to be best suited to different noise levels. At low noise levels, the optimal order increases as noise increases. At intermediate levels second order tends to be optimal, while at high noise levels prototypical local projection is most effective. The new higher order filters perform better relative to established filters for longer signals or signals corresponding to higher dimensional attractors.
BAI Yu-Lin; CHENG Xiao-Hong; CHEN Xiang-Rong; YANG Xiang-Dong; ZHU Jun
2004-01-01
@@ The intermolecular interactions potentials for two configurations of CH4-Ne complex are calculated with local density approximation methods in the frame of density functional theory. It is found that the calculated potentials have two minima when the distance between the carbon atom of CH4 and the Ne atom takes R = 5.80 a.u.and 6.20a. u. for both the two configurations. For the edge configuration, the corresponding depth of the potential is 0.0669536 eV and 0.0671416 eV. For the face configuration, the corresponding depth of the potential is 0.0737956 eV and 0.0645506 eV. The global minimum occurs at R = 5.80 a.u. for the face configuration with a depth of the potential 0.0737956 eV. The depths of our calculation are in better agreement with the experimental data than the quantum chemical calculation approach, while the position of minimum potential for our calculation is underestimated.
Sergio Daniel Moreira-Ascarrunz
2016-12-01
Full Text Available The aim of the present investigation was to investigate the nutritional yield, nutrient density, stability, and adaptability of organically produced wheat for sustainable and nutritional high value food production. This study evaluated the nutritional yield of four minerals (Fe, Zn, Cu, and Mg in 19 wheat genotypes, selected as being locally adapted under organic agriculture conditions. The new metric of nutritional yield was calculated for each genotype and they were evaluated for stability using the Additive Main effects and Multiplicative Interaction (AMMI stability analysis and for genotypic value, stability, and adaptability using the Best Linear Unbiased Prediction (BLUP procedure. The results indicated that there were genotypes suitable for production under organic agriculture conditions with satisfactory yields (>4000 kg·ha−1. Furthermore, these genotypes showed high nutritional yield and nutrient density for the four minerals studied. Additionally, since these genotypes were stable and adaptable over three environmentally different years, they were designated “balanced genotypes” for the four minerals and for the aforementioned characteristics. Selection and breeding of such “balanced genotypes” may offer an alternative to producing nutritious food under low-input agriculture conditions. Furthermore, the type of evaluation presented here may also be of interest for implementation in research conducted in developing countries, following the objectives of producing enough nutrients for a growing population.
Cs diffusion in local Taiwan laterite with different solution concentration, pH and packing density
Wang, T.-H. [Department of Engineering and System Science, National Tsing Hua University, Hsinchu 300, Taiwan (China); Li, M.-H. [Institute of Hydrological Sciences, National Central University, Jungli 320, Taiwan (China); Teng, S.-P. [Department of Engineering and System Science, National Tsing Hua University, Hsinchu 300, Taiwan (China); Institute of Nuclear Engineering and Science, National Tsing Hua University, Hsinchu 300, Taiwan (China)], E-mail: spteng@ess.nthu.edu.tw
2008-09-15
In this work we used an 'in-diffusion' method to study the effects of pH, solution concentration and packing density on Cs diffusion by packing local Taiwan laterite (LTL) into modified capillary columns with 5 mm diameter. These packed columns were first pre-equilibrated with synthetic groundwater (GW) for 3 weeks. The diffusion experiments were then carried out at ambient condition for 2 weeks. Our experimental results showed that the Cs diffusion profile fits Fick's second law very well in given experimental conditions, indicating the validity of modified capillary column method. Generally speaking, Cs diffusion in LTL decreases as the pH increases and as Cs concentration decreases. The apparent diffusion coefficient (D{sub a}) increases from 5.52x10{sup -12} (10{sup -7} M) to 2.18x10{sup -11} (10{sup -3} M) m{sup 2}/s, while the effective diffusion coefficient (D{sub e}) shows slight variation as the Cs concentration changes. Both the derived D{sub a} and D{sub e} values decrease as the pH increases, implying that the diffusion mechanisms of Cs nuclide in alkaline and acid environment are different. In addition, our results show that Cs diffusion is unaffected by the given packing density, indicating the interlaminary space is not the major determinant of Cs adsorption and diffusion in LTL.
Independent constraints on local non-Gaussianity from the peculiar velocity and density fields
Ma, Yin-Zhe; Scott, Douglas
2013-01-01
Primordial, non-Gaussian perturbations can generate scale-dependent bias in the galaxy distribution. This in turn will modify correlations between galaxy positions and peculiar velocities at late times, since peculiar velocities reflect the underlying matter distribution, whereas galaxies are a biased tracer of the same. We study this effect, and show that non-Gaussianity can be constrained by comparing the observed peculiar velocity field to a model velocity field reconstructed from the galaxy density field assuming linear bias. The amplitude of the spatial correlations in the residual map obtained after subtracting one velocity field from the other is directly proportional to the strength of the primordial non-Gaussianity. We construct the corresponding likelihood function use it to constrain the amplitude of the linear flow $\\beta$ and the amplitude of local non-Gaussianity $f^{NL}_{local}$. Applying our method to two observational data sets, the Type-Ia supernovae (A1SN) and Spiral Field \\textit{I}-band (...
Almgren, Ann S.; Bell, John B.; Colella, Phillip; Howell, Louis H.; Welcome, Michael L.
1998-05-01
In this paper we present a method for solving the equations governing time-dependent, variable density incompressible flow in two or three dimensions on an adaptive hierarchy of grids. The method is based on a projection formulation in which we first solve advection-diffusion equations to predict intermediate velocities, and then project these velocities onto a space of approximately divergence-free vector fields. Our treatment of the first step uses a specialized second-order upwind method for differencing the nonlinear convection terms that provides a robust treatment of these terms suitable for inviscid and high Reynolds number flow. Density and other scalars are advected in such a way as to maintain conservation, if appropriate, and free-stream preservation. Our approach to adaptive refinement uses a nested hierarchy of logically-rectangular girds with simultaneous refinement of the girds in both space and time. The integration algorithm on the grid hierarchy is a recursive procedure in which coarse grids are advanced in time, fine grids are advanced multiple steps to reach the same time as the coarse grids and the data at different levels are then synchronized. The single grid algorithm is described briefly, but the emphasis here is on the time-stepping procedure for the adaptive hierarchy. Numerical examples are presented to demonstrate the algorithms's accuracy and convergence properties, and illustrate the behavior of the method. An additional example demonstrates the performance of the method on a more realistic problem, namely, a three-dimensional variable density shear layer.
Rincón, Elizabeth; Pérez, Patricia; Chamorro, Eduardo
2007-11-01
The local reactivity proclivities in a series of simple substituted nitrenes (N-X) and phosphinidenes (P-X) have been explored for the lowest-lying singlet and triplet electronic states within the framework of spin-polarized density functional theory (SP-DFT). Linear correlations have been found between both the global and local philicities for spin polarization and the vertical singlet-triplet energy gaps. The accumulation and depletion of the electron or spin density can be directly related to the electronegativity of the substituent atoms. The local analysis has been achieved on the basis of a recent implementation of condensed-to-site SP-DFT Fukui functions.
Marchukov, O. V.; Eriksen, E. H.; Midtgaard, J. M.
2016-01-01
-trivial geometric factors that depend solely on the geometry of the confinement through the single-particle eigenstates of the external potential. To obtain accurate effective Hamiltonians to describe such systems one needs to be able to compute these geometric factors with high precision which is difficult due...... to the computational complexity of the high-dimensional integrals involved. An approach using the local density approximation would therefore be a most welcome approximation due to its simplicity. Here we assess the accuracy of the local density approximation by going beyond the simple harmonic oscillator that has...
Rubin, Jacques
2014-01-01
Relativistic stereometric coordinates supplied by relativistic auto-locating positioning systems made up of four satellites supplemented by a fifth one are defined in addition to the well-known emission and reception coordinates. Such a constellation of five satellites defines a so-called relativistic localizing system. The determination of such systems is motivated by the need to not only locate (within a grid) users utilizing receivers but, more generally, to localize any spacetime event. The angles measured on the celestial spheres of the five satellites enter into the definition. Therefore, there are, up to scalings, intrinsic physical coordinates related to the underlying conformal structure of spacetime. Moreover, they indicate that spacetime must be endowed everywhere with a local projective geometry characteristic of a so-called generalized Cartan space locally modeled on four-dimensional, real projective space. The particular process of localization providing the relativistic stereometric coordinates...
The Effective Number Density of Galaxies for Weak Lensing Measurements in the LSST Project
Chang, C; Jain, B; Kahn, S M; Kirkby, D; Connolly, A; Krughoff, S; Peng, E; Peterson, J R
2013-01-01
Future weak lensing surveys potentially hold the highest statistical power for constraining cosmological parameters compared to other cosmological probes. The statistical power of a weak lensing survey is determined by the sky coverage, the inverse of the noise in shear measurements, and the galaxy number density. The combination of the latter two factors is often expressed in terms of $n_{\\rm eff}$ -- the "effective number density of galaxies used for weak lensing measurements". In this work, we estimate $n_{\\rm eff}$ for the Large Synoptic Survey Telescope (LSST) project, the most powerful ground-based lensing survey planned for the next two decades. We investigate how the following factors affect the resulting $n_{\\rm eff}$ of the survey with detailed simulations: (1) survey time, (2) shear measurement algorithm, (3) algorithm for combining multiple exposures, (4) inclusion of data from multiple filter bands, (5) redshift distribution of the galaxies, and (6) masking and blending. For the first time, we qu...
SAMURAI-TPC: A Time Projection Chamber for Constraining the Asymmetry Energy at High Density
McIntosh, A. B.; Maass, N.; Yennello, S. J.; Barney, J.; Chajecki, Z.; Chan, C. F.; Dunn, J. W.; Estee, J.; Gilbert, J.; Lu, F.; Lynch, W. G.; Shane, R.; Tsang, M. B.; Famiano, M.; Isobe, T.; Sakurai, H.; Taketani, A.; Murakami, T.; Samurai-Tpc Collaboration
2011-10-01
The SAMURAI-TPC is a time projection chamber designed to measure pions and light charged particles. By measuring pion yield ratios and particle flow in heavy ion collisions around E = 200A MeV, we expect to constrain the behavior of the nuclear asymmetry energy around twice saturation density. In this talk, the design and construction of the TPC components will be discussed. Upon completion, the SAMURAI-TPC will be installed in the SAMURAI spectrometer at the Radioactive Isotope Beam Facility at RIKEN, Japan. This work is supported by the Department of Energy (DE-SC0004835).
RAISING LEARNER AWARENESS OF LOCAL WISDOM IN TOUR-RELATED PROJECT TEACHING
Amporn Sa-ngiamwibool
2012-01-01
Full Text Available This study investigated how CLT (Communicative Language Teaching and awareness-raising enhanced Thai learners’ awareness of their local wisdom in a tour-related project work with three specific purposes, which were to explore how the learners interacted with textual representations of their local wisdom to create their project, what extent CLT and awareness-raising tasks developed their communicative competence of the target language, and what object of awareness that the tasks could help the learners realize while working on their projects. This study was triangulated. The elicitation instruments were project instructions, CLT and awareness-raising tasks, pretests and posttests based on TOEIC (Test of English for International Communication, learner logs, interviews, and observation notes. The study revealed that, first, on the awareness of local wisdom in a tour-related project work, the learners interacted with textual representations of their local wisdom through theme-centered learning process. Second, on the enhancement of CLT and awareness-raising, CLT allowed the learners to deal with interactive, spontaneous, and more meaningful communication actively while awareness-raising helped the learners consciously focus on semantic, linguistic, and pragmatic aspects of the target language. Lastly, on object of awareness, CLT and awareness-raising tasks could lead the learners to realize these objects of awareness: nature of experiential learning, subject content, and skill content. For pedagogical implications, project-based teaching with the support of CLT and awareness-raising tasks can raise learner awareness of local wisdom in tour-related topics effectively. Pedagogical implications illustrated some practical applications of CLT and awareness-raising tasks for enhancing learner awareness in ESP project work in a Thai classroom. Future inquiry should replicate this study or apply to business or other ESP project instructions.
Optimal neighbor graph-based orthogonal tensor locality preserving projection for image recognition
Yuan, Sen; Mao, Xia
2016-11-01
As a typical multilinear dimensionality reduction (DR) method, tensor locality preserving projection (TLPP) has been successfully applied in many practical problems. However, TLPP depends mainly on preserving its local neighbor graph which often suffers from the following issues: (1) the neighbor graph is constructed with the Euclidean distance which fails to consider the relationships among different coordinates for tensor data; (2) the affinity matrix only focuses on the local structure information of samples while ignoring the existing label information; (3) the projection matrices are nonorthogonal, thus it is difficult to preserve the local manifold structure. To address these problems, a multilinear DR algorithm called optimal neighbor graph-based orthogonal tensor locality preserving projection (OG-OTLPP) is proposed. In OG-OTLPP, an optimal neighbor graph is first built according to tensor distance. Then the affinity matrix of data is defined by utilizing both the label information and the intrinsic local geometric properties of the data. Finally, in order to improve the manifold preserving ability, an efficient and stable scheme is designed to iteratively learn the orthogonal projections. We evaluate the proposed algorithm by applying it to image recognition. The experimental results on five public image databases demonstrate the effectiveness of our algorithm.
Pokhrel, Damodar
Interstitial and intracavitary brachytherapy plays an essential role in management of several malignancies. However, the achievable accuracy of brachytherapy treatment for prostate and cervical cancer is limited due to the lack of intraoperative planning and adaptive replanning. A major problem in implementing TRUS-based intraoperative planning is an inability of TRUS to accurately localize individual seed poses (positions and orientations) relative to the prostate volume during or after the implantation. For the locally advanced cervical cancer patient, manual drawing of the source positions on orthogonal films can not localize the full 3D intracavitary brachytherapy (ICB) applicator geometry. A new iterative forward projection matching (IFPM) algorithm can explicitly localize each individual seed/applicator by iteratively matching computed projections of the post-implant patient with the measured projections. This thesis describes adaptation and implementation of a novel IFPM algorithm that addresses hitherto unsolved problems in localization of brachytherapy seeds and applicators. The prototype implementation of 3-parameter point-seed IFPM algorithm was experimentally validated using a set of a few cone-beam CT (CBCT) projections of both the phantom and post-implant patient's datasets. Geometric uncertainty due to gantry angle inaccuracy was incorporated. After this, IFPM algorithm was extended to 5-parameter elongated line-seed model which automatically reconstructs individual seed orientation as well as position. The accuracy of this algorithm was tested using both the synthetic-measured projections of clinically-realistic Model-6711 125I seed arrangements and measured projections of an in-house precision-machined prostate implant phantom that allows the orientations and locations of up to 100 seeds to be set to known values. The seed reconstruction error for simulation was less than 0.6 mm/3o. For the physical phantom experiments, IFPM absolute accuracy for
Harry, KJ; Higa, K; Srinivasan, V; Balsara, NP
2016-08-10
Understanding and controlling the electrochemical deposition of lithium is imperative for the safe use of rechargeable batteries with a lithium metal anode. Solid block copolymer electrolyte membranes are known to enhance the stability of lithium metal anodes by mechanically suppressing the formation of lithium protrusions during battery charging. Time-resolved hard X-ray microtomography was used to monitor the internal structure of a symmetric lithium-polymer cell during galvanostatic polarization. The microtomography images were used to determine the local rate of lithium deposition, i.e. local current density, in the vicinity of a lithium globule growing through the electrolyte. Measurements of electrolyte displacement enabled estimation of local stresses in the electrolyte. At early times, the current density was maximized at the globule tip, as expected from simple current distribution arguments. At later times, the current density was maximized at the globule perimeter. We show that this phenomenon is related to the local stress fields that arise as the electrolyte is deformed. The local current density, normalized for the radius of curvature, decreases with increasing compressive stresses at the lithium-polymer interface. To our knowledge, our study provides the first direct measurement showing the influence of local mechanical stresses on the deposition kinetics at lithium metal electrodes.
Dam, J.; Harkema, S.; Feil, D.
1983-01-01
The results of the determination of the electron density of u-oxalic acid dihydrate at 100 K by means of X-ray diffraction are reported as part of the project on the accurate determination of electron densities which was initiated by the International Union of Crystallography. An extensive data set,
IT Mangement for Transforming Local Government - a Danish Collaborative Practice Research Project
Kræmmergaard, Pernille; Agger Nielsen, Jeppe
2011-01-01
The aim of this paper is to present the methodology and preliminary findings from an on-going Danish collaborative practice research project concerning IT-Management in Transformational e-Government - DISIMIT. The ambition of the DISIMIT project is to improve IT management in local governments...... of eGovernment maturity and diagnosed the six main challenges faced by local governments in their efforts of realizing transformational e-Government. From these challenges, the project chose three challenges to investigate further according to the principles from Collaborative Practice Research......, the challenges were categorized into 3 longitudinale theme tracks from 2010 – 2012). These challenges were – 1) Value Creation and Benefit Realization, 2) Strategy Execution and Project Portfolio Management and 3) Social Alignment and Communication....
Y. G. Udod
2017-03-01
Full Text Available The article contains a brief description of the Community-led local development approach (local development under the leadership of the community, CLLD and the main purpose of its use in the European Union. The study indicated periods of the major initiatives to support local development in EU. Moreover the article posted CLLD approach principles’ evolution and the basic principles of the LEADER method and its application in CLLD, which can be applied in Ukraine. Subject to the provisions of the European Economic and Social Committee (EESC for further CLLD-approach distribution the five trends were identified that must be considered when forming a Regional local development projects support system in Ukraine: Multi-fund financing; Unification; Networking and collaboration; Extending the approach; Simplifying the process. The characteristic of the present phase of CLLD-approach, in particular, of the European Network for Rural Development (ENRD, which attaches great importance to the dissemination of the most effective CLLD practices and establish partnerships between communities and territories where the approach is implemented. The study found out the relationship between Community-led local development and Community-driven development (CDD supported by the World Bank.
Kaye, Jason; Yang, Chao
2014-01-01
Kohn-Sham density functional theory is one of the most widely used electronic structure theories. The recently developed adaptive local basis functions form an accurate and systematically improvable basis set for solving Kohn-Sham density functional theory using discontinuous Galerkin methods, requiring a small number of basis functions per atom. In this paper we develop residual-based a posteriori error estimates for the adaptive local basis approach, which can be used to guide non-uniform basis refinement for highly inhomogeneous systems such as surfaces and large molecules. The adaptive local basis functions are non-polynomial basis functions, and standard a posteriori error estimates for $hp$-refinement using polynomial basis functions do not directly apply. We generalize the error estimates for $hp$-refinement to non-polynomial basis functions. We demonstrate the practical use of the a posteriori error estimator in performing three-dimensional Kohn-Sham density functional theory calculations for quasi-2D...
Theoretical background to orient the universitary projects management to local development.
Naybi Salas Vargas
2012-03-01
Full Text Available Nowadays the resources administration is a problem to be solved, and is remarkable the universities role to orient knowledge to the expected local development. With the communion of the university and the main decisors at local and territorial contexts, it is evident the development of alternatives that diminish existing breaches in the known projects management Anytime the projects development context is diverse and multicultural, all the knowledge elements that provide new forms are useful experiences without point out unique recipees. The development dynamic evolution in the territories continues being an urgency for human survival.The projects management, notable in international cooperation actions as the international dimension of the extensionist activity and in the science contributions, are reduced in their foccus to the promotion of local development, what points out the need to orient the universitary processes to the territorial development of the province, in particular the projects management. The objective of this work is to offer a guidance of foundations that allow to orient the management of universtary projects to local development.
Local density of optical states in the band gap of a finite photonic crysta
Yeganegi, Elahe; Mosk, Allard P; Vos, Willem L
2014-01-01
We study the local density of states (LDOS) in a finite photonic crystal, in particular in the frequency range of the band gap. We propose a new point of view on the band gap, which we consider to be the result of vacuum fluctuations in free space that tunnel in the forbidden range in the crystal. As a result, we arrive at a model for the LDOS that is in two major items modified compared to the well-known expression for infinite crystals. Firstly, we modify the Dirac delta functions to become Lorentzians with a width set by the crystal size. Secondly, building on characterization of the fields versus frequency and position we calculated the fields in the band gap. We start from the fields at the band edges, interpolated in space and position, and incorporating the exponential damping in the band gap. We compare our proposed model to exact calculations in one dimension using the transfer matrix method and find very good agreement. Notably, we find that in finite crystals, the LDOS depends on frequency, on posi...
Characteristics of local photonic state density in an infinite two-dimensional photonic crystal
Zhou Yun-Song; Wang Xue-Hua; Gu Ben-Yuan; Wang Fu-He
2005-01-01
The local density of photonic states (LDPS) of an infinite two-dimensional (2D) photonic crystal (PC) composed of rotated square-pillars in a 2D square lattice is calculated in terms of the plane-wave expansion method in a combination with the point group theory. The calculation results show that the LDPS strongly depends on the spatial positions.The variations of the LDPS as functions of the radial coordinate and frequency exhibit "mountain chain" structures with sharp peaks. The LDPS with large value spans a finite area and falls abruptly down to small value at the position corresponding to the interfaces between two different refractive index materials. The larger/lower LDPS occurs inward the lower/larger dielectric-constant medium. This feature can be well interpreted by the continuity of electricdisplacement vector at the interface. In the frequency range of the pseudo-PBG (photonic band gap), the LDPS keeps very low value over the whole Wiger-Seitz cell. It indicates that the spontaneous emission in 2D PCs cannot be prohibited completely, but it can be inhibited intensively when the resonate frequency falls into the pseudo-PBG.
Local density approximation results for bond length alternation in the infinite polyyne chain
Bylaska, Eric; Weare, John
1998-03-01
Calculations for large even numbered carbon ring molecules and band structure calculations for the infinite polyyne chain within the local density approximation are reported. We studied the alternation of bond lengths in this system as a function of size. Particular focus is on alternation in the infinite system. For intermediate and large sized Cn rings with n satisfying n=4N (doubly-antiaromatic rings) there is a substantial first order Jahn-Teller distortion which decreases for large N. On the other hand, for Cn rings satisfying n=4N+2 (doubly-aromatic rings) the second order Jahn-Teller distortion does not produce bond length alternation even by the large C_42 ring. The persistance of aromatic behavior in the very large carbon rings manifests itself in the band structure calculations by making the amount of bond length alternation predicted for the infinite polyyne chain extremely sensitive to the numerical treatment of the Brillouin zone. We have shown that the infinite polyyne has a finite amount of bond length alternation but the condensation energy is very small.
Yang, Xiong Wei; Lee, Joong Seok; Kim, Yoon Young
2016-11-01
Because effective material properties are essential concepts in the analyses of wave phenomena in metamaterials, they may also be utilized in the optimal design of metamaterials. In this work, we propose a topology optimization method directly using the Effective Mass Density (EMD) concept to maximize the first bandgaps of two-dimensional solid Locally Resonant Acoustic Metamaterials (LRAMs). When the first bandgap is characterized by the negative EMD, the bandgap maximization can be formulated efficiently as a topology optimization problem to broaden the frequency zone of the negative EMD values. In this work, EMD is calculated by considering the macroscopic isotropy of LRAMs in the long wavelength limit. To facilitate the analytical sensitivity analysis, we propose an elaborate calculation scheme of EMD. A sensitivity averaging technique is also suggested to guarantee the macroscopically isotropic behavior of the LRAMs. In the present study, the coating layer interfacing the core and the matrix of a ternary LRAM is chosen as the design region because it significantly influences the bandgap. By considering several numerical examples, the validity of this method is verified, and the effects of the mass constraint ratios on the optimized results are also investigated.
RKKY interaction and local density of states for a triangular triple quantum dot system
Xiong, Yong-Chen; Wang, Wei-Zhong; Luo, Shi-Jun; Yang, Jun-Tao; Huang, Hai-Ming
2016-02-01
By means of the numerical renormalization group technique, we study the local density of states (LDOS) for a triangular triple quantum dot system, with two dots connected in parallel to the conduction leads. We find the location of the Ruderman-Kittel-Kasuya-Yosida (RKKY) peak identified in the LDOS could be illustrated as JRKKY = aΓ2 / U +bt22 / U, with U being the on-site Coulomb repulsion, Γ the dot-lead coupling, and t2 the hopping between the connected dots and the side dot. When the hopping between two connected dots t1 turns on, the spectrum weight of the RKKY peaks decreases due to the competition between the direct and the RKKY interactions. As t1 increases beyond a critical point t1c, two connected dots form a spin singlet, and decouple from both the side dot and the conduction leads, thus the Kondo and RKKY peaks could not be found. For t1 1 ≥t1 c, it drops to zero.
Spontaneous-emission control by local density of states of photonic crystal cavity
Jiang Bin; Zhang Ye-Jin; Zhou Wen-Jun; Chen Wei; Liu An-Jin; Zheng Wan-Hua
2011-01-01
The local density of states (LDOS) of two-dimensional square lattice photonic crystal (PhC) defect cavity is studied. The results show that the LDOS in the centre is greatly reduced, while the LDOS at the point off the centre (for example, at the point (0.3a, 0.4a), where a is the lattice constant) is extremely enhanced. Further, the disordered radii are introduced to imitate the real devices fabricated in our experiment, and then we study the LDOS of PhC cavity with configurations of different disordered radii. The results show that in the disordered cavity, the LDOS in the centre is still greatly reduced, while the LDOS at the point (0.3a, 0.4a) is still extremely enhanced. It shows that the LDOS analysis is useful. When a laser is designed on the basis of the square lattice PhC rod cavity, in order to enhance the spontaneous emission, the active materials should not be inserted in the centre of the cavity, but located at positions off the centre. So LDOS method gives a guide to design the positions of the active materials (quantum dots) in the lasers.
Lin, L., E-mail: lianglin@ucla.edu; Ding, W. X.; Brower, D. L. [Department of Physics and Astronomy, University of California Los Angeles, Los Angeles, California 90095 (United States)
2014-11-15
Combined polarimetry-interferometry capability permits simultaneous measurement of line-integrated density and Faraday effect with fast time response (∼1 μs) and high sensitivity. Faraday effect fluctuations with phase shift of order 0.05° associated with global tearing modes are resolved with an uncertainty ∼0.01°. For physics investigations, local density fluctuations are obtained by inverting the line-integrated interferometry data. The local magnetic and current density fluctuations are then reconstructed using a parameterized fit of the polarimetry data. Reconstructed 2D images of density and magnetic field fluctuations in a poloidal cross section exhibit significantly different spatial structure. Combined with their relative phase, the magnetic-fluctuation-induced particle transport flux and its spatial distribution are resolved.
Lin, L; Ding, W X; Brower, D L
2014-11-01
Combined polarimetry-interferometry capability permits simultaneous measurement of line-integrated density and Faraday effect with fast time response (∼1 μs) and high sensitivity. Faraday effect fluctuations with phase shift of order 0.05° associated with global tearing modes are resolved with an uncertainty ∼0.01°. For physics investigations, local density fluctuations are obtained by inverting the line-integrated interferometry data. The local magnetic and current density fluctuations are then reconstructed using a parameterized fit of the polarimetry data. Reconstructed 2D images of density and magnetic field fluctuations in a poloidal cross section exhibit significantly different spatial structure. Combined with their relative phase, the magnetic-fluctuation-induced particle transport flux and its spatial distribution are resolved.
NONE
2012-06-15
The driving force behind the Integrated Energy Mapping and Analysis project was the identification and analysis of a suite of pathways that the Cowichan Valley Regional District (CVRD) can utilise to increase its energy resilience, as well as reduce energy consumption and GHG emissions, with a primary focus on the residential sector. Mapping and analysis undertaken will support provincial energy and GHG reduction targets, and the suite of pathways outlined will address a CVRD internal target that calls for 75% of the region's energy within the residential sector to come from locally sourced renewables by 2050. The target has been developed as a mechanism to meet resilience and climate action target. The maps and findings produced are to be integrated as part of a regional policy framework currently under development. Task 5 focused on energy projection mapping to estimate and visualise the energy consumption density and GHG emissions under different scenarios. The scenarios from task 4 were built around the energy consumption density of the residential sector under future land use patterns and rely on different energy source combinations (the suite of pathways). In task 5 the energy usage under the different scenarios were fed back into GIS, thereby giving a visual representation of forecasted residential energy consumption per unit area. The methodology is identical to that used in task 2 where current usage was mapped, whereas the mapping in this task is for future forecasts. These results are documented in this report. In addition, GHG mapping under the various scenarios was also undertaken. (LN)
Gibbs, G V; Spackman, M A; Jayatilaka, D; Rosso, K M; Cox, D F
2006-11-01
For a variety of molecules and earth materials, the theoretical local kinetic energy density, G(r(c)), increases and the local potential energy density, V(r(c)), decreases as the M-O bond lengths (M = first- and second-row metal atoms bonded to O) decrease and the electron density, rho(r(c)), accumulates at the bond critical points, r(c). Despite the claim that the local kinetic energy density per electronic charge, G(r(c))/rho(r(c)), classifies bonded interactions as shared interactions when less than unity and closed-shell when greater, the ratio was found to increase from 0.5 to 2.5 au as the local electronic energy density, H(r(c)) = G(r(c)) + V(r(c)), decreases and becomes progressively more negative. The ratio appears to be a measure of the character of a given M-O bonded interaction, the greater the ratio, the larger the value of rho(r(c)), the smaller the coordination number of the M atom and the more shared the bonded interaction. H(r(c))/rho(r(c)) versus G(r(c))/rho(r(c)) scatter diagrams categorize the M-O bonded interactions into domains with the local electronic energy density per electron charge, H(r(c))/rho(r(c)), tending to decrease as the electronegativity differences for the bonded pairs of atoms decrease. The values of G(r(c)) and V(r(c)), estimated with a gradient-corrected electron gas theory expression and the local virial theorem, are in good agreement with theoretical values, particularly for the bonded interactions involving second-row M atoms. The agreement is poorer for shared C-O and N-O bonded interactions.
Low-enriched uranium high-density target project. Compendium report
Vandegrift, George; Brown, M. Alex; Jerden, James L.; Gelis, Artem V.; Stepinski, Dominique C.; Wiedmeyer, Stanley; Youker, Amanda; Hebden, Andrew; Solbrekken, G; Allen, C; Robertson., D; El-Gizawy, Sherif; Govindarajan, Srisharan; Hoyer, Annemarie; Makarewicz, Philip; Harris, Jacob; Graybill, Brian; Gunn, Andy; Berlin, James; Bryan, Chris; Sherman, Steven; Hobbs, Randy; Griffin, F. P.; Chandler, David; Hurt, C. J.; Williams, Paul; Creasy, John; Tjader, Barak; McFall, Danielle; Longmire, Hollie
2016-09-01
At present, most ^{99}Mo is produced in research, test, or isotope production reactors by irradiation of highly enriched uranium targets. To achieve the denser form of uranium needed for switching from high to low enriched uranium (LEU), targets in the form of a metal foil (~125-150 µm thick) are being developed. The LEU High Density Target Project successfully demonstrated several iterations of an LEU-fission-based Mo-99 technology that has the potential to provide the world’s supply of Mo-99, should major producers choose to utilize the technology. Over 50 annular high density targets have been successfully tested, and the assembly and disassembly of targets have been improved and optimized. Two target front-end processes (acidic and electrochemical) have been scaled up and demonstrated to allow for the high-density target technology to mate up to the existing producer technology for target processing. In the event that a new target processing line is started, the chemical processing of the targets is greatly simplified. Extensive modeling and safety analysis has been conducted, and the target has been qualified to be inserted into the High Flux Isotope Reactor, which is considered above and beyond the requirements for the typical use of this target due to high fluence and irradiation duration.
IT Mangement for Transforming Local Government - a Danish Collaborative Practice Research Project
Kræmmergaard, Pernille; Agger Nielsen, Jeppe
2011-01-01
The aim of this paper is to present the methodology and preliminary findings from an on-going Danish collaborative practice research project concerning IT-Management in Transformational e-Government - DISIMIT. The ambition of the DISIMIT project is to improve IT management in local governments (m......, the challenges were categorized into 3 longitudinale theme tracks from 2010 – 2012). These challenges were – 1) Value Creation and Benefit Realization, 2) Strategy Execution and Project Portfolio Management and 3) Social Alignment and Communication....
Abílio Amiguinho
2005-01-01
Full Text Available The process of socio-educational territorialisation in rural contexts is the topic of this text. The theme corresponds to a challenge to address it having as main axis of discussion either the problem of social exclusion or that of local development. The reasons to locate the discussion in this last field of analysis are discussed in the first part of the text. Theoretical and political reasons are there articulated because the question is about projects whose intentions and practices call for the political both in the theoretical debate and in the choices that anticipate intervention. From research conducted for several years, I use contributions that aim at discuss and enlighten how school can be a potential locus of local development. Its identification and recognition as local institution (either because of those that work and live in it or because of those that act in the surrounding context are crucial steps to progressively constitute school as a partner for development. The promotion of the local values and roots, the reconstruction of socio-personal and local identities, the production of sociabilities and the equation and solution of shared problems were the dimensions of a socio-educative intervention, markedly globalising. This scenario, as it is argued, was also, intentionally, one of transformation and of deliberate change of school and of the administration of the educative territoires.
George Schin
2013-12-01
Full Text Available This paper aims at outlining a successful implementation of a project within LEADER framework, which is a local development method which allows local actors to develop an area by using its endogenous development potential. After a brief presentation of the characteristics of regional development strategies in Romania, there were emphasized the objectives and activities encompassed in a local development plan, managed by the leaders of the local action group called ‘Vrancea County’. In order to reinforce the strengths of Vrancea County and implicitly to assure a sustainable development of this area from the South-East part of Romania, a LAG constituted through a partnership between public and private actors settled a set of priorities to be exploited by means of specific actions. The goal of this paper is to highlight these priorities, by integrating them in a project management approach. The paper concludes with specifications about how Microsoft Project software could support project management initiatives that will be developed by the LAG Vrancea County in the next period.
Rasch, E.D.
2012-01-01
In this article, I analyze how Guatemalan indigenous citizens claim their rights to be citizens and agents of their own development through local resistance to large-scale mining projects. These indigenous communities face massive resource extraction by multinational mining companies that endangers
IT Mangement for Transforming Local Government - a Danish Collaborative Practice Research Project
Kræmmergaard, Pernille; Agger Nielsen, Jeppe
2011-01-01
The aim of this paper is to present the methodology and preliminary findings from an on-going Danish collaborative practice research project concerning IT-Management in Transformational e-Government - DISIMIT. The ambition of the DISIMIT project is to improve IT management in local governments...... (municipalities) and to contribute with knowledge about IT-Management to the IS literature in general and to the e-government literature in particular. The paper reports on the process of conducting collaborative practice research and the selected findings from the empirical research activities. Up till now...... of eGovernment maturity and diagnosed the six main challenges faced by local governments in their efforts of realizing transformational e-Government. From these challenges, the project chose three challenges to investigate further according to the principles from Collaborative Practice Research...
Sybilska, A.; Lisker, T.; Kuntschner, H.; Vazdekis, A.; van de Ven, G.; Peletier, R.; Falcón-Barroso, J.; Vijayaraghavan, R.; Janz, J.
2017-09-01
We present the first in a series of papers in The role of Environment in shaping Low-mass Early-type Nearby galaxies (hELENa) project. In this paper, we combine our sample of 20 low-mass early types (dEs) with 258 massive early types (ETGs) from the ATLAS3D survey - all observed with the SAURON integral field unit - to investigate early-type galaxies' stellar population scaling relations and the dependence of the population properties on local environment, extended to the low-σ regime of dEs. The ages in our sample show more scatter at lower σ values, indicative of less massive galaxies being affected by the environment to a higher degree. The shape of the age-σ relations for cluster versus non-cluster galaxies suggests that cluster environment speeds up the placing of galaxies on the red sequence. While the scaling relations are tighter for cluster than for the field/group objects, we find no evidence for a difference in average population characteristics of the two samples. We investigate the properties of our sample in the Virgo cluster as a function of number density (rather than simple clustrocentric distance) and find that dE ages correlate with the local density such that galaxies in regions of lower density are younger, likely because they are later arrivals to the cluster or have experienced less pre-processing in groups, and consequently used up their gas reservoir more recently. Overall, dE properties correlate more strongly with density than those of massive ETGs, which was expected as less massive galaxies are more susceptible to external influences.
Gibbs, Gerald V.; Cox, David F.; Rosso, Kevin M.; Ross, Nancy L.; Downs, R. T.; Spackman, M. A.
2007-03-01
Bond critical point and local energy density properties together with net atomic charges were calculated for theoretical electron density distributions, F(r), generated for a variety of Fe and Cu metal-sulfide materials with high- and low-spin Fe atoms in octahedral coordination and high-spin Fe atoms in tetrahedral coordination. The electron density, F(rc), the Laplacian, 32F(rc), the local kinetic energy, G(rc), and the oxidation state of Fe increase as the local potential energy density, V(rc), the Fe-S bond lengths, and the coordination numbers of the Fe atoms decrease. The properties of the bonded interactions for the octahedrally coordinated low-spin Fe atoms for pyrite and marcasite are distinct from those for high-spin Fe atoms for troilite, smythite, and greigite. The Fe-S bond lengths are shorter and the values of F(rc) and 32F(rc) are larger for pyrite and marcasite, indicating that the accumulation and local concentration of F(r) in the internuclear region are greater than those involving the longer, high-spin Fe-S bonded interactions. The net atomic charges and the bonded radii calculated for the Fe and S atoms in pyrite and marcasite are also smaller than those for sulfides with high-spin octahedrally coordinated Fe atoms. Collectively, the Fe-S interactions are indicated to be intermediate in character with the low-spin Fe-S interactions having greater shared character than the highspin interactions. The bond lengths observed for chalcopyrite together with the calculated bond critical point properties are consistent with the formula Cu+Fe3+S2. The bond length is shorter and the F(rc) value is larger for the FeS4 tetrahedron displayed by metastable greigite than those displayed by chalcopyrite and cubanite, consistent with a proposal that the Fe atom in greigite is tetravalent. S-S bond paths exist between each of the surface S atoms of adjacent slabs of FeS6 octahedra comprising the layer sulfide smythite, suggesting that the neutral Fe3S4 slabs are
Szczykutowicz, Timothy P., E-mail: tszczykutowicz@uwhealth.org [Department of Radiology, University of Wisconsin-Madison, Madison, Wisconsin 53705 (United States); Department of Medical Physics, University of Wisconsin-Madison, Madison, Wisconsin 53705 (United States); Department of Biomedical Engineering, University of Wisconsin-Madison, Madison, Wisconsin 53706 (United States); Labby, Zacariah E.; Wallace, Charles [Department of Human Oncology, University of Wisconsin-Madison, Madison, Wisconsin 53705 (United States); Rubert, Nicholas [Department of Medical Physics, University of Wisconsin-Madison, Madison, Wisconsin 53705 (United States)
2016-02-15
Purpose: Accurate CT radiograph angle is not usually important in diagnostic CT. However, there are applications in radiation oncology and interventional radiology in which the orientation of the x-ray source and detector with respect to the patient is clinically important. The authors present a method for measuring the accuracy of the tube/detector assembly with respect to the prescribed tube/detector position for CT localizer, fluoroscopic, and general radiograph imaging using diagnostic, mobile, and c-arm based CT systems. Methods: A mathematical expression relating the x-ray projection of two metal BBs is related to gantry angle. Measurement of the BBs at a prescribed gantry (i.e., c-arm) angle can be obtained and using this relation the prescribed versus actual gantry angle compared. No special service mode or proprietary information is required, only access to projection images is required. Projection images are available in CT via CT localizer radiographs and in the interventional setting via fluorography. Results: The technique was demonstrated on two systems, a mobile CT scanner and a diagnostic CT scanner. The results confirmed a known issue with the mobile scanner and accurately described the CT localizer angle of the diagnostic system tested. Conclusions: This method can be used to quantify gantry angle, which is important when projection images are used for procedure guidance, such as in brachytherapy and interventional radiology applications.
Mihai V. Putz
2009-11-01
Full Text Available The density matrix theory, the ancestor of density functional theory, provides the immediate framework for Path Integral (PI development, allowing the canonical density be extended for the many-electronic systems through the density functional closure relationship. Yet, the use of path integral formalism for electronic density prescription presents several advantages: assures the inner quantum mechanical description of the system by parameterized paths; averages the quantum fluctuations; behaves as the propagator for time-space evolution of quantum information; resembles Schrödinger equation; allows quantum statistical description of the system through partition function computing. In this framework, four levels of path integral formalism were presented: the Feynman quantum mechanical, the semiclassical, the Feynman-Kleinert effective classical, and the Fokker-Planck non-equilibrium ones. In each case the density matrix or/and the canonical density were rigorously defined and presented. The practical specializations for quantum free and harmonic motions, for statistical high and low temperature limits, the smearing justification for the Bohr’s quantum stability postulate with the paradigmatic Hydrogen atomic excursion, along the quantum chemical calculation of semiclassical electronegativity and hardness, of chemical action and Mulliken electronegativity, as well as by the Markovian generalizations of Becke-Edgecombe electronic focalization functions – all advocate for the reliability of assuming PI formalism of quantum mechanics as a versatile one, suited for analytically and/or computationally modeling of a variety of fundamental physical and chemical reactivity concepts characterizing the (density driving many-electronic systems.
Properties of Dark Matter Halos as a Function of Local Environment Density
Lee, Christoph T; Behroozi, Peter; Rodriguez-Puebla, Aldo; Hellinger, Doug; Dekel, Avishai
2016-01-01
We study how properties of discrete dark matter halos depend on halo environment, characterized by the mass density around the halos on scales from 0.5 to 16 $\\hmpc$. We find that low mass halos (those less massive than the characteristic mass $M_{\\rm C}$ of halos collapsing at a given epoch) in high-density environments have lower accretion rates, lower spins, higher concentrations, and rounder shapes than halos in median density environments. Halos in median and low-density environments have similar accretion rates and concentrations, but halos in low density environments have lower spins and are more elongated. Halos of a given mass in high-density regions accrete material earlier than halos of the same mass in lower-density regions. All but the most massive halos in high-density regions are losing mass (i.e., being stripped) at low redshifts, which causes artificially lowered NFW scale radii and increased concentrations. Tidal effects are also responsible for the decreasing spins of low mass halos in high...
I.A.K Bintang
1998-12-01
Full Text Available Three hundred day-old male ducklings were allocated randomly into 12 treatment combinations in 3 x 4 factorial design . Three levels of dietary density ration i.e : Low(12% /2,000 kcal, medium (16%/2,500 kcal and high (20%/3,000 kcal and 2 breeds of local ducks Tegal (TT and Mojosari (MM and their crossbreds (Tegal x Mojosari (TM and Mojosari x Tegal (MT were applied. Each treatment combination consisted of5 replicates, each of 5 birds. The experiment was carried out for 8 weeks and measurements were weekly feed intake, body weight, weight and/or percentage of carcass, internal organs and abdominal fat. Results indicated that no significant interaction was detected between dietary nutrient density and the breeds of ducks on all parameters measured . Breeds of duck, as well as their crosses did not affect growth performance and other parameters . On the other hand, nutrient density influenced growth performance significantly, except for percentage of carcass and internal organs . In general, feed intake, body weight gain, feed efficiency, carcass weight and abdominal fat of ducks fed low density ration were significantly lower than those fed medium density, which were also lower than those fed high nutrient density diet . Weghtand length of intestine and kidney weight, of ducks fed low density diet however, were higher than the two other treatments .
Final Project Report: Data Locality Enhancement of Dynamic Simulations for Exascale Computing
Shen, Xipeng [North Carolina State Univ., Raleigh, NC (United States)
2016-04-27
The goal of this project is to develop a set of techniques and software tools to enhance the matching between memory accesses in dynamic simulations and the prominent features of modern and future manycore systems, alleviating the memory performance issues for exascale computing. In the first three years, the PI and his group have achieves some significant progress towards the goal, producing a set of novel techniques for improving the memory performance and data locality in manycore systems, yielding 18 conference and workshop papers and 4 journal papers and graduating 6 Ph.Ds. This report summarizes the research results of this project through that period.
Combined effects of patch size and plant nutritional quality on local densities of insect herbivores
Bukovinszky, T.; Gols, R.; Kamp, A.; Oliveira-Domingues, de F.; Hamback, P.A.; Jongema, Y.; Bezemer, T.M.; Dicke, M.; Dam, N.; Harvey, J.A.
2010-01-01
Plant–insect interactions occur in spatially heterogeneous habitats. Understanding how such interactions shape density distributions of herbivores requires knowledge on how variation in plant traits (e.g. nutritional quality) affects herbivore abundance through, for example, affecting movement rates
National Aeronautics and Space Administration — FMI has developed graded density CBCF preforms for graded density phenolic impregnated carbon ablator (PICA) material to meet NASA's future exploration mission...
Shung Han Cho; Yuntai Kyong; Sangjin Hong; We-Duke Cho
2009-01-01
This paper presents a novel self localization method using parallel projection model for mobile sensor in navigation applications. The algorithm estimates the coordinate and the orientation of mobile sensor using projected on visual image. The proposed method considers the lens non-linearity of the camera and compensates the distortion by using a calibration table. The method determines the coordinates and orientations with iterative process, which is very accurate with low computational demand. We identify various sources of error on the coordinate and orientation estimations, and present both static sensitivity analysis of the algorithm and dynamic behavior of the mobile sensor. The algorithm can be utilized in mobile robot navigation as well as positioning application where accurate self localization is necessary.
Tong, H B; Lu, J; Zou, J M; Wang, Q; Shi, S R
2012-03-01
An experiment was conducted to evaluate the effect of stocking density on growth performance, carcass yield, and immune status of a local chicken breed. In total, 840 one-day-old male Suqin yellow chickens were placed into 4-m(2) cages in groups of 50 (low), 70 (medium), or 90 (high) birds. Each treatment was represented by 4 replicates (cages). The cages measured 2.84 × 1.42 m; half of the area of the cage (2 m(2)) was used from 1 to 28 d and the whole cage was used from 29 to 42 d. Stocking densities were 25, 35, and 45 birds/m(2) from 1 to 28 d and 12.5, 17.5, and 22.5 birds/m(2) from 29 to 42 d (low, medium, and high, respectively). Final production (live bird mass after fasting) per unit area was 14.46, 19.46, and 24.23 kg/m(2), respectively, at 42 d of age. Several immune parameters were evaluated, and the growth performance, carcass yield, and meat quality were determined. Body weight at 28 and 42 d of age was significantly reduced as the stocking density increased (P 0.05). The thigh yield of chickens in the medium-density group improved significantly (P 0.05) by the stocking density, but pH values increased slightly as density increased. No significant difference was noted in the immunological parameters, but the blood total protein and potassium were significantly affected by stocking density (P < 0.05). The findings of this study suggest that increasing the stocking density advantageously affected feed/gain and decreased the final BW, whereas no evidence was found that stocking density caused changes in any of the measured immune parameters.
Energy availabilities for state and local development: projected energy patterns for 1985 and 1990
Vogt, D. P.; Rice, P. L.; Corey, T. A.; Pai, V. P.
1979-11-01
This report (one of a series) presents projections of the energy supply, demand, and net imports of seven fuel types (gasoline, distillates, residual oil, crude, natural gas, coal, electricity) and four final consuming sectors. To facilitate detailed regional analysis these projections have been prepared for Bureau of Economic Analysis (BEA) areas, states, census regions, and the nation for 1985 and 1990. The data are formatted to present regional energy availability from primary extraction, as well as from energy-transformation processes. The tables depict energy balances between availability and use for each specific fuel. The objective of this series is to provide a consistent base of historic and projected energy information within a standard format. Such a framework should aid regional policymakers in their consideration of regional growth issues that may be influenced by the regional energy system. However, for analysis of specific regions, this basic data should be supplemented by additional information which only the local policy analyst can bring to bear in his or her assessment of the energy conditions that characterize the region. Earlier volumes in this series have proved useful for both specific and general analysis of this type, and it is hoped that the current volume will prove equally so. This volume presents an updated benchmark projection series, which captures recent developments in the business as usual projections of energy supply and consumption due to national policy developments since the 1976 National Energy Outlook projection series were prepared.
Baldwin, T. E.; Poetsch, R.
1977-08-01
All assessment of future domestic development projects assumes that the problems to be examined have been properly identified and defined before the application of a projection technique. An attempt is made to codify socio-cultural problems mentioned in literature and clarify how existing demographic projection techniques can be applied to assessing the problems. The relationship between changes in local population size and composition induced by in-migration and the potential for socio-cultural incompatibilities is described heuristically. For simplification, the problems expected to emerge from differences in demographic composition are classified into three categories: (1) service needs, such as those for housing, recreation, and education; (2) types of social organizations related to capacities for, or constraints on, reaping the benefits of rapid economic development and social changes (e.g., employment and income); and (3) attitudes, values, and cultural perspectives. These areas of concern are very broad, and quantitative projections of population size and composition are more easily related to the first than to the third. Although demographic projection provides a valuable tool for estimating future social change, the knowledge about cause and effect is not sufficient to support the quantification of socio-cultural impact. Therefore, the projections are used only as relative indicators and the assessments of socio-cultural impact based on them are qualitative only. Therefore, identification and assessment of socio-cultural impacts are a means of developing plans to overcome the expected problems.
Local-scale projections of coral reef futures and implications of the Paris Agreement
van Hooidonk, Ruben; Maynard, Jeffrey; Tamelander, Jerker; Gove, Jamison; Ahmadia, Gabby; Raymundo, Laurie; Williams, Gareth; Heron, Scott F.; Planes, Serge
2016-12-01
Increasingly frequent severe coral bleaching is among the greatest threats to coral reefs posed by climate change. Global climate models (GCMs) project great spatial variation in the timing of annual severe bleaching (ASB) conditions; a point at which reefs are certain to change and recovery will be limited. However, previous model-resolution projections (~1 × 1°) are too coarse to inform conservation planning. To meet the need for higher-resolution projections, we generated statistically downscaled projections (4-km resolution) for all coral reefs; these projections reveal high local-scale variation in ASB. Timing of ASB varies >10 years in 71 of the 87 countries and territories with >500 km2 of reef area. Emissions scenario RCP4.5 represents lower emissions mid-century than will eventuate if pledges made following the 2015 Paris Climate Change Conference (COP21) become reality. These pledges do little to provide reefs with more time to adapt and acclimate prior to severe bleaching conditions occurring annually. RCP4.5 adds 11 years to the global average ASB timing when compared to RCP8.5; however, >75% of reefs still experience ASB before 2070 under RCP4.5. Coral reef futures clearly vary greatly among and within countries, indicating the projections warrant consideration in most reef areas during conservation and management planning.
Local projects of the world psychiatric association programme to reduce stigma and discrimination.
Warner, Richard
2005-05-01
The World Psychiatric Association Programme to Reduce Stigma and Discrimination Because of Schizophrenia, which was launched in 1996, has established projects to fight stigma in 20 countries, using social-marketing techniques to enhance their effectiveness. This article describes some of the strategies used and the lessons learned in implementing two local antistigma projects. At each site the first steps were to establish an action committee and to conduct a local survey of perceived stigma. On the basis of the survey, the local action committee selected a few homogeneous and accessible target groups, such as students, employers, and criminal justice personnel. These smaller groups were targeted, because focusing on the general public is expensive and unlikely to have a measurable impact. Messages for the target groups and the media used to reach them were carefully selected, tested, and refined. The author gives examples of the work that was done with such target groups as high school students and the criminal justice system. Guidelines are provided for setting up a consumer speakers' bureau, which is valuable for addressing target groups. The bureau can be made up of people who have experienced mental illness, family members, and mental health professionals. Guidelines are also provided for establishing a media-watch organization, which can lobby news and entertainment media to exclude negative portrayals of people with mental illness. Organizers of local projects should be on the lookout for useful changes that can become permanent, such as changes in the curriculum for high school students or for police officers in training. Projects such as these can be effective in reducing stigma and can be relatively inexpensive.
Amandeep, K.; Suneel, K.
2017-09-01
The present theoretical calculations have been performed within the framework of IQMD model to study a particular set of mass symmetric and asymmetric reactions (keeping total mass fixed) over a wide range of incident energies and colliding geometries. It has been observed that global as well as local nuclear stopping is influenced by the mass asymmetry of the reaction strongly. Influence of density-dependent symmetry energy has been observed in local nuclear stopping. Global stopping decreases with the increase in colliding geometry. Effect of colliding geometry on nuclear stopping is more at higher energies.
Khemani, Vedika; Pollmann, Frank; Sondhi, S L
2016-06-17
The eigenstates of many-body localized (MBL) Hamiltonians exhibit low entanglement. We adapt the highly successful density-matrix renormalization group method, which is usually used to find modestly entangled ground states of local Hamiltonians, to find individual highly excited eigenstates of MBL Hamiltonians. The adaptation builds on the distinctive spatial structure of such eigenstates. We benchmark our method against the well-studied random field Heisenberg model in one dimension. At moderate to large disorder, the method successfully obtains excited eigenstates with high accuracy, thereby enabling a study of MBL systems at much larger system sizes than those accessible to exact-diagonalization methods.
Paired MEG data set source localization using recursively applied and projected (RAP) MUSIC.
Ermer, J J; Mosher, J C; Huang, M; Leahy, R M
2000-09-01
An important class of experiments in functional brain mapping involves collecting pairs of data corresponding to separate "Task" and "Control" conditions. The data are then analyzed to determine what activity occurs during the Task experiment but not in the Control. Here we describe a new method for processing paired magnetoencephalographic (MEG) data sets using our recursively applied and projected multiple signal classification (RAP-MUSIC) algorithm. In this method the signal subspace of the Task data is projected against the orthogonal complement of the Control data signal subspace to obtain a subspace which describes spatial activity unique to the Task. A RAP-MUSIC localization search is then performed on this projected data to localize the sources which are active in the Task but not in the Control data. In addition to dipolar sources, effective blocking of more complex sources, e.g., multiple synchronously activated dipoles or synchronously activated distributed source activity, is possible since these topographies are well-described by the Control data signal subspace. Unlike previously published methods, the proposed method is shown to be effective in situations where the time series associated with Control and Task activity possess significant cross correlation. The method also allows for straightforward determination of the estimated time series of the localized target sources. A multiepoch MEG simulation and a phantom experiment are presented to demonstrate the ability of this method to successfully identify sources and their time series in the Task data.
On the dominant uncertainty source of climate change projections at the local scale
Fatichi, Simone; Ivanov, Valeriy; Paschalis, Athanasios; Molnar, Peter; Rimkus, Stefan; Kim, Jongho; Peleg, Nadav; Burlando, Paolo; Caporali, Enrica
2016-04-01
Decision makers and stakeholders are usually concerned about climate change projections at local spatial scales and fine temporal resolutions. This contrasts with the reliability of climate models, which is typically higher at the global and regional scales, Therefore, there is a demand for advanced methodologies that offer the capability of transferring predictions of climate models and relative uncertainty to scales commensurate with practical applications and for higher order statistics (e.g., few square kilometres and sub-daily scale). A stochastic downscaling technique that makes use of an hourly weather generator (AWE-GEN) and of a Bayesian methodology to weight realizations from different climate models is used to generate local scale meteorological time series of plausible "futures". We computed factors of change from realizations of 32 climate models used in the Coupled Model Intercomparison Project Phase 5 (CMIP5) and for different emission scenarios (RCP 4.5 and RCP 8.5). Future climate projections for several meteorological variables (precipitation, air temperature, relative humidity, shortwave radiation) are simulated at three locations characterized by remarkably different climates, Zurich (Switzlerand), Miami and San Francisco (USA). The methodology is designed to partition three main sources of uncertainty: uncertainty due to climate models (model epistemic uncertainty), anthropogenic forcings (scenario uncertainty), and internal climate variability (stochastic uncertainty). The three types of uncertainty sources are considered as dependent, implicitly accounting for possible co-variances among the sources. For air temperature, the magnitude of the different uncertainty sources is comparable for mid-of-the-century projections, while scenario uncertainty dominates at large lead-times. The dominant source of uncertainty for changes in precipitation mean and extremes is internal climate variability, which is accounting for more than 80% of the total
Mandala, Suzanne; Mettler, Irvin J.; Taiz, Lincoln
1982-01-01
Previous studies characterizing an ATP-dependent proton pump in microsomal membrane vesicles of corn coleoptiles led to the conclusion that the proton pump was neither mitochondrial nor plasma membrane in origin (Mettler, Mandala, Taiz 1982 Plant Physiol 70: 1738-1742). To facilitate positive identification of the vesicles, corn coleoptile microsomal membranes were fractionated on linear sucrose and dextran gradients, with ATP-dependent [14C]methylamine uptake as a probe for proton pumping. On sucrose gradients, proton pumping activity exhibited a density of 1.11 grams/cubic centimeter and was coincident with the endoplasmic reticulum (ER). In the presence of high magnesium, the ER shifted to a heavier density, while proton pumping activity showed no density shift. On linear dextran gradients, proton pumping activity peaked at a lighter density than the ER. The proton pump appears to be electrogenic since both [14C]SCN− uptake and 36Cl− uptake activities coincided with [14C] methylamine uptake on dextran gradients. On the basis of density and transport properties, we conclude that the proton pumping vesicles are probably derived from the tonoplast. Nigericin-stimulated ATPase activity showed a broad distribution which did not coincide with any one membrane marker. PMID:16662755
Kajzer-Bonk, Joanna; Skórka, Piotr; Nowicki, Piotr; Bonk, Maciej; Król, Wiesław; Szpiłyk, Damian; Woyciechowski, Michal
2016-01-01
The type of matrix, the landscape surrounding habitat patches, may determine the distribution and function of local populations. However, the matrix is often heterogeneous, and its various components may differentially contribute to metapopulation processes at different spatial scales, a phenomenon that has rarely been investigated. The aim of this study was to estimate the relative importance of matrix composition and spatial scale, habitat quality, and management intensity on the occurrence and density of local populations of two endangered large blue butterflies: Phengaris teleius and P. nausithous. Presence and abundance data were assessed over two years, 2011-12, in 100 local patches within two heterogeneous regions (near Kraków and Tarnów, southern Poland). The matrix composition was analyzed at eight spatial scales. We observed high occupancy rates in both species, regions and years. With the exception of area and isolation, almost all of the matrix components contributed to Phengaris sp. densities. The different matrix components acted at different spatial scales (grassland cover within 4 and 3 km, field cover within 0.4 and 0.3 km and water cover within 4 km radii for P. teleius and P. nausithous, respectively) and provided the highest independent contribution to the butterfly densities. Additionally, the effects of a 0.4 km radius of forest cover and a food plant cover on P. teleius, and a 1 km radius of settlement cover and management intensity on P. nausithous densities were observed. Contrary to former studies we conclude that the matrix heterogeneity and spatial scale rather than general matrix type are of relevance for densities of butterflies. Conservation strategies for these umbrella species should concentrate on maintaining habitat quality and managing matrix composition at the most appropriate spatial scales.
Building a Universal Nuclear Energy Density Functional (UNEDF): SciDAC-2 Project
Carlson, Joe; Furnstahl, Dick; Lusk, Rusty; Nazarewicz, Witek; Ng, Esmond; Thompson, Ian; Vary, James
2012-06-30
An understanding of the properties of atomic nuclei is crucial for a complete nuclear theory, for element formation, for properties of stars, and for present and future energy and defense applications. During the period of Dec. 1, 2006 - Jun. 30, 2012, the UNEDF collaboration carried out a comprehensive study of all nuclei based on the most accurate knowledge of the strong nuclear interaction, the most reliable theoretical approaches, the most advanced algorithms, and extensive computational resources, with a view towards scaling to the petaflop platforms and beyond. The long-term vision initiated with UNEDF is to arrive at a comprehensive, quantitative, and unified description of nuclei and their reactions, grounded in the fundamental interactions between the constituent nucleons. We seek to replace current phenomenological models of nuclear structure and reactions with a well-founded microscopic theory that delivers maximum predictive power with well-quantified uncertainties. Specifically, the mission of this project has been three-fold: first, to find an optimal energy density functional (EDF) using all our knowledge of the nucleonic Hamiltonian and basic nuclear properties; second, to apply the EDF theory and its extensions to validate the functional using all the available relevant nuclear structure and reaction data; and third, to apply the validated theory to properties of interest that cannot be measured, in particular the properties needed for reaction theory.
Seizure onset zone localization from ictal high-density EEG in five patients
Staljanssens, Willeke; Strobbe, Gregor; Van Holen, Roel; Birot, Gwénaël; Michel, Christophe M; Seeck, Margitta; Vandenberghe, Stefaan; Vulliémoz, Serge; van Mierlo, Pieter
2015-01-01
Rationale Because epilepsy is a network disease, localization of the exact seizure onset zone (SOZ) is difficult because the epileptic activity can spread to other regions within milliseconds. Functional connectivity metrics quantify how the activity in different brain regions is interrelated. In the past, it has been shown that functional connectivity analysis of ictal intracranial EEG (icEEG) recordings can help with SOZ localization in patients with focal epilepsy (van Mierlo et al., 20...
Hansson, M.; Ekerfelt, H.; Aurand, B.; Gallardo Ganzalez, I.; Desforges, F. G.; Davoine, X.; Maitrallain, A.; Reymond, S.; Monot, P.; Persson, A.; Dobosz Dufrénoy S.; Wahlström C-G.; Cros, B.; Lundh, O.
2016-01-01
We report on a study on controlled trapping of electrons, by field ionization of nitrogen ions, in laser wakefield accelerators in variable length gas cells. In addition to ionization-induced trapping in the density plateau inside the cells, which results in wide, but stable, electron energy spectra, a regime of ionization-induced trapping localized in the density down-ramp at the exit of the gas cells, is found. The resulting electron energy spectra are peaked, with 10% shot-to-shot fluctuations in peak energy. Ionization-induced trapping of electrons in the density down-ramp is a way to trap and accelerate a large number of electrons, thus improving the efficiency of the laser-driven wakefield acceleration.
De Jong, R S; Jong, Roelof S. de; Lacey, Cedric
2000-01-01
We investigate the dependence of the local space density of spiral galaxies on luminosity, scalesize and surface brightness. We derive bivariate space density distributions in these quantities from a sample of about 1000 Sb-Sdm spiral galaxies, corrected for selection effects in luminosity and surface brightness. The structural parameters of the galaxies were corrected for internal extinction using a description depending on galaxy surface brightness. We find that the bivariate space density distribution of spiral galaxies in the (luminosity, scalesize)-plane is well described by a Schechter luminosity function in the luminosity dimension and a log-normal scale size distribution at a given luminosity. This parameterization of the scalesize distribution was motivated by a simple model for the formation of disks within dark matter halos, with halos acquiring their angular momenta through tidal torques from neighboring objects, and the disk specific angular momentum being proportional to that of the parent halo....
Simple models for complex systems: exploiting the relationship between local and global densities.
Pascual, Mercedes; Roy, Manojit; Laneri, Karina
2011-01-01
Simple temporal models that ignore the spatial nature of interactions and track only changes in mean quantities, such as global densities, are typically used under the unrealistic assumption that individuals are well mixed. These so-called mean-field models are often considered overly simplified, given the ample evidence for distributed interactions and spatial heterogeneity over broad ranges of scales. Here, we present one reason why such simple population models may work even when mass-action assumptions do not hold: spatial structure is present but it relates to global densities in a special way. With an individual-based predator-prey model that is spatial and stochastic, and whose mean-field counterpart is the classic Lotka-Volterra model, we show that the global densities and densities of pairs (or spatial covariances) establish a bi-power law at the stationary state and also in their transient approach to this state. This relationship implies that the dynamics of global densities can be written simply as a function of those densities alone without invoking pairs (or higher order moments). The exponents of the bi-power law for the predation rate exhibit a remarkable robustness to changes in model parameters. Evidence is presented for a connection of our findings to the existence of a critical phase transition in the dynamics of the spatial system. We discuss the application of similar modified mean-field equations to other ecological systems for which similar transitions have been described, both in models and empirical data.Electronic supplementary material The online version of this article (doi:10.1007/s12080-011-0116-2) contains supplementary material, which is available to authorized users.
Barrera-Ballesteros, Jorge K; Zhu, Guangtun B; Zakamska, Nadia L; Sánchez, Sebastian F; Law, David; Wake, David; Green, Jenny E; Bizyaev, Dmitry; Oravetz, Daniel; Simmons, Audrey; Malanushenko, Elena; Pan, Kaike; Lopes, Alexandre Roman; Lane, Richard R
2016-01-01
We present the stellar surface mass density {\\it vs.} gas metallicity ($\\Sigma_*-Z$) relation for more than 500,000 spatially-resolved star-forming resolution elements (spaxels) from a sample of 653 disk galaxies included in the SDSS IV MaNGA survey. We find a tight relation between these local properties, with higher metallicities as the surface density increases. This relation extends over three orders of magnitude in the surface mass density and a factor of four in metallicity. We show that this local relationship can simultaneously reproduce two well-known properties of disk galaxies: their global mass-metallicity relationship {\\it and} their radial metallicity gradients. We also find that the $\\Sigma_* - Z$ relation is largely independent of the galaxy's total stellar mass and specific star-formation rate (sSFR), except at low stellar mass and high sSFR. These results suggest that in the present-day universe local properties play a key role in determining the gas-phase metallicity in typical disk galaxie...
Sanyal, Tanmoy; Shell, M. Scott
2016-07-01
Bottom-up multiscale techniques are frequently used to develop coarse-grained (CG) models for simulations at extended length and time scales but are often limited by a compromise between computational efficiency and accuracy. The conventional approach to CG nonbonded interactions uses pair potentials which, while computationally efficient, can neglect the inherently multibody contributions of the local environment of a site to its energy, due to degrees of freedom that were coarse-grained out. This effect often causes the CG potential to depend strongly on the overall system density, composition, or other properties, which limits its transferability to states other than the one at which it was parameterized. Here, we propose to incorporate multibody effects into CG potentials through additional nonbonded terms, beyond pair interactions, that depend in a mean-field manner on local densities of different atomic species. This approach is analogous to embedded atom and bond-order models that seek to capture multibody electronic effects in metallic systems. We show that the relative entropy coarse-graining framework offers a systematic route to parameterizing such local density potentials. We then characterize this approach in the development of implicit solvation strategies for interactions between model hydrophobes in an aqueous environment.
Barrera-Ballesteros, Jorge K.; Heckman, Timothy M.; Zhu, Guangtun B.; Zakamska, Nadia L.; Sánchez, Sebastian F.; Law, David; Wake, David; Green, Jenny E.; Bizyaev, Dmitry; Oravetz, Daniel; Simmons, Audrey; Malanushenko, Elena; Pan, Kaike; Roman Lopes, Alexandre; Lane, Richard R.
2016-12-01
We present the stellar surface mass density versus gas metallicity (Σ*-Z) relation for more than 500 000 spatially resolved star-forming resolution elements (spaxels) from a sample of 653 disc galaxies included in the SDSS IV MaNGA survey. We find a tight relation between these local properties, with higher metallicities as the surface density increases. This relation extends over three orders of magnitude in the surface mass density and a factor of 4 in metallicity. We show that this local relationship can simultaneously reproduce two well-known properties of disc galaxies: their global mass-metallicity relationship and their radial metallicity gradients. We also find that the Σ*-Z relation is largely independent of the galaxy's total stellar mass and specific star formation rate (sSFR), except at low stellar mass and high sSFR. These results suggest that in the present-day universe local properties play a key role in determining the gas-phase metallicity in typical disc galaxies.
Innovative project development based on pure local financing: case Tychy in Poland
Oinonen, E. [Fortum Engineering Ltd. (Finland)
1999-07-01
A decision was made to construct a new coal fired cogeneration unit at the Tychy Heating plant (Poland). To pay for the new plant contracts were negotiated with local distribution companies for fuel, electric power and heat energy sales. These contracts were accepted by a local bank as a guarantee of future income and a credit agreement with a consortium of Polish banks signed. A contracts was signed in October 1997 with Fortum Engineering for turnkey delivery of the BC-35 cogeneration unit. The paper describes aspects of the project covering: local financing; combined heat and power generation; circulating fluidized bed technology; turnkey delivery; and business perspectives. Commercial electricity and heat production will begin in February 2000. 3 figs.
Face recognition algorithm based on Gabor wavelet and locality preserving projections
Liu, Xiaojie; Shen, Lin; Fan, Honghui
2017-07-01
In order to solve the effects of illumination changes and differences of personal features on the face recognition rate, this paper presents a new face recognition algorithm based on Gabor wavelet and Locality Preserving Projections (LPP). The problem of the Gabor filter banks with high dimensions was solved effectively, and also the shortcoming of the LPP on the light illumination changes was overcome. Firstly, the features of global image information were achieved, which used the good spatial locality and orientation selectivity of Gabor wavelet filters. Then the dimensions were reduced by utilizing the LPP, which well-preserved the local information of the image. The experimental results shown that this algorithm can effectively extract the features relating to facial expressions, attitude and other information. Besides, it can reduce influence of the illumination changes and the differences in personal features effectively, which improves the face recognition rate to 99.2%.
Neby, Simon; Sobolowski, Stefan
2017-04-01
How can users and stakeholders be actively involved with providing input to and using output from local-scale climate projections? How can the scientific community better understand the needs of local actors? And how should communication and cooperation efforts be organized? These are critical questions we aim to answer in a climate services project funded by the Norwegian Research Council (R3: Relevant, Reliable and Robust local-scale climate projections for Norway). The project takes into consideration not only the scientific issues in establishing useful local-scale climate projections, but also addresses the "usability gap" between climate information and decision-making. The lack of effective communication between scientists and user communities often result in outputs and products that are not matched with decision-relevant climate information. In the R3 project, the scientific participants actively engage with a range of users that have quite different information needs: municipalities, infrastructure developers, agriculture, energy producers, insurance companies, and more. In this particular presentation, we present our experiences concerning three specific issues that relate to the stakeholder-science interface: 1) Preferences are not clear-cut and pre-defined. In practice, this means that stakeholders often do not have precise information about their needs, nor precise information about how, where and whether their needs can be voiced. Similarly, science communities tend to presuppose that stakeholders are interested and have well-articulated needs, which is hardly the case. Collectively, that means that there is a need for an approach that guides the articulation and prioritization of preferences in a manner that integrates both scientific and stakeholder perspectives and takes the integrity of both perspectives seriously. 2) Technologies are unclear. Although information may be produced and used, past experiences, trial and error processes and pragmatic
The Stellar Number Density Distribution in the Local Solar Neighborhood is North-South Asymmetric
Yanny, Brian [Fermilab; Gardner, Susan [Kentucky U.
2013-10-17
We study the number density distribution of a sample of K and M dwarf stars, matched North and South of the Galactic plane within a distance of 2 kpc from the sun, using observations from the Ninth Data Release of the Sloan Digital Sky Survey. We determine distances using the photometric parallax method, and in this context systematic effects exist which could potentially impact the determination of the number density profile with height from the Galactic plane --- and ultimately affect a number density North-South asymmetry. They include: (i) the calibration of the various photometric parallax relations, (ii) the ability to separate dwarfs from giants in our sample, (iii) the role of stellar population differences such as age and metallicity, (iv) the ability to determine the offset of the sun from the Galactic plane, and (v) the correction for reddening from dust in the Galactic plane, though our stars are at high Galactic latitudes. We find the various analyzed systematic effects to have a negligible impact on our observed asymmetry, and using a new and larger sample of stars we confirm and refine the earlier discovery of Widrow et al. of a significant Galactic North-South asymmetry in the stellar number density distribution.
Autonomous Bacterial Localization and Gene Expression Based on Nearby Cell Receptor Density
2013-01-22
Upon detection of B1–5 mM AI-2, these cells express T7 polymerase that amplifies the native lsr operon response by overexpressing DsRed (see...2 for initiating gene expression (lsr operon ). (B) Indicated densities of PCI-15B or HEK293 cells were seeded to wells followed by mouse anti-EGFR
Performance of a local electron density trigger to select extensive air showers at sea level
Abbas, T.; Madani, J.; Ashton, F.
1985-01-01
Time coincident voltage pulses in the two closely space (1.6m) plastic scintillators were recorded. Most of the recorded events are expeted to be due to electrons in cosmic ray showers whose core fall at some distance from the detectors. This result is confirmed from a measurement of the frequency distribution of the recorded density ratios of the two scintillators.
Maximization of ICRF power by SOL density tailoring with local gas injection
Jacquet, P.; Goniche, M.; Bobkov, V.; Lerche, E.; Pinsker, R. I.; Pitts, R. A.; Zhang, W.; Colas, L.; Hosea, J.; Moriyama, S.; Wang, S.-J.; Wukitch, S.; Zhang, X.; Bilato, R.; Bufferand, H.; Guimarais, L.; Faugel, H.; Hanson, G. R.; Kocan, M.; Monakhov, I.; Noterdaeme, J.-M.; Petrzilka, V.; Shaw, A.; Stepanov, I.; Sips, A. C. C.; Van Eester, D.; Wauters, T.; JET contributors, the; the ASDEX Upgrade Team; the DIII-D Team; ITPA ‘Integrated Operation Scenarios' members, the; experts
2016-04-01
Experiments have been performed under the coordination of the International Tokamak Physics Activity (ITPA) on several tokamaks, including ASDEX Upgrade (AUG), JET and DIII-D, to characterize the increased Ion cyclotron range of frequency (ICRF) antenna loading achieved by optimizing the position of gas injection relative to the RF antennas. On DIII-D, AUG and JET (with the ITER-Like Wall) a 50% increase in the antenna loading was observed when injecting deuterium in ELMy H-mode plasmas using mid-plane inlets close to the powered antennas instead of divertor injection and, with smaller improvement when using gas inlets located at the top of the machine. The gas injection rate required for such improvements (~0.7 × 1022 el s-1 in AUG, ~1.0 × 1022 el s-1 in JET) is compatible with the use of this technique to optimize ICRF heating during the development of plasma scenarios and no degradation of confinement was observed when using the mid-plane or top inlets compared with divertor valves. An increase in the scrape-off layer (SOL) density was measured when switching gas injection from divertor to outer mid-plane or top. On JET and DIII-D, the measured SOL density increase when using main chamber puffing is consistent with the antenna coupling resistance increase provided that the distance between the measurement lines of sight and the injection location is taken into account. Optimized gas injection was also found to be beneficial for reducing tungsten (W) sputtering at the AUG antenna limiters, and also to reduce slightly the W and nickel (Ni) content in JET plasmas. Modeling the specific effects of divertor/top/mid-plane injection on the outer mid-plane density was carried out using both the EDGE2D-EIRENE and EMC3-EIRENE plasma boundary code packages; simulations indeed indicate that outer mid-plane gas injection maximizes the density in the mid-plane close to the injection point with qualitative agreement with the AUG SOL density measurements
Weiss, S. B.; Micheli, L.; Flint, L. E.; Flint, A. L.; Thorne, J. H.
2014-12-01
Assessment of climate change resilience, vulnerability, and adaptation options require downscaling of GCM outputs to local scales, and conversion of temperature and precipitation forcings into hydrologic and ecological responses. Recent work in the San Francisco Bay Area, and California demonstrate a practical approach to this process. First, climate futures (GCM x Emissions Scenario) are screened using cluster analysis for seasonal precipitation and temperature, to select a tractable subset of projections that still represent the range of climate projections. Second, monthly climate projections are downscaled to 270m and the Basin Characterization Model (BCM) applied, to generate fine-scale recharge, runoff, actual evapotranspiration (AET), and climatic water deficit (CWD) accounting for soils, bedrock geology, topography, and local climate. Third, annual time-series are used to derive 30-year climatologies and recurrence intervals of extreme events (including multi-year droughts) at the scale of small watersheds and conservation parcels/networks. We take a "scenario-neutral" approach where thresholds are defined for system "failure," such as water supply shortfalls or drought mortality/vegetation transitions, and the time-window for hitting those thresholds is evaluated across all selected climate projections. San Francisco Bay Area examples include drought thresholds (CWD) for specific vegetation-types that identify leading/trailing edges and local refugia, evaluation of hydrologic resources (recharge and runoff) provided by conservation lands, and productivity of rangelands (AET). BCM outputs for multiple futures are becoming available to resource managers through on-line data extraction tools. This approach has wide applicability to numerous resource management issues.
Ken K. Chin
2011-01-01
For semiconductors with localized intrinsic/impurity defects,intentionally doped or unintentionally incorporated,that have multiple transition energy levels among charge states,the general formulation of the local charge neutrality condition is given for the determination of the Fermi level and the majority carrier density.A graphical method is used to illustrate the solution of the problem.Relations among the transition energy levels of the multi-level defect are derived using the graphical method.Numerical examples are given for p-doping of the CdTe thin film used in solar panels and semi-insulating Si to illustrate the relevance and importance of the issues discussed in this work.
Gulyás, A I; Hájos, N; Katona, I; Freund, T F
2003-05-01
A subset of GABAergic neurons projecting to the medial septum has long been described in the hippocampus. However, the lack of information about their local connectivity pattern or their correspondence with any of the well-established hippocampal interneuron types has hampered the understanding of their functional role. Retrograde tracing combined with immunostaining for neurochemical markers in the adult rat hippocampus showed that nearly all hippocampo-septal (HS) neurons express somatostatin (>95%) and, in the hilus and CA3 stratum lucidum, many contain calretinin (>45%). In contrast, in stratum oriens of the CA1 and CA3 subfields, the majority of HS neurons contain somatostatin (>86%) and calbindin (>73%), but not calretinin. Because somatostatin-positive hippocampal interneurons have been most extensively characterized in the stratum oriens of CA1, we focused our further analysis on HS cells found in this region. In 18-20-day-old rats, intracellularly filled CA1-HS cells had extensive local axon collaterals crossing subfield boundaries and innervating the CA3 region and the dentate gyrus. Electron microscopic analysis provided evidence that the axon terminals of CA1-HS cells form symmetrical synapses selectively on GABAergic interneurons, both locally and in the CA3 region. In addition, double retrograde labelling experiments revealed that many CA1-HS neurons of the dorsal hippocampus also have collateral projections to the ventral hippocampus. Thus, CA1-HS cells innervate inhibitory interneurons locally and in remote hippocampal regions, in addition to targeting mostly GABAergic neurons in the medial septum. This dual projection with striking target selectivity for GABAergic neurons may be ideally suited to synchronize neuronal activity along the septo-hippocampal axis.
Xu, Jian-Ying; Chen, Li-Ding; Lu, Yi-He; Fu, Bo-Jie
2007-07-01
This article examines the sustainability of the Grain for Green Project in the Wolong Nature Reserve. Pertinent data were collected through a questionnaire survey and a spatial analysis of reforested lands. The study results identified four critical issues that may influence the sustainability of the project in the study area. The first issue is concerned with the project’s impacts on local sustenance. Because local grain consumption depends greatly on compensation awarded by the project, the potential for sustainability of the project is compromised. The second issue is that the project causes negative effects on local incomes in the Wolong Nature Reserve, which may undermine local economic prospects. The third issue is that the project failed to deliver suitable habitat for the giant panda, although two of the suitability requirements that deal with landform features were met. Lastly, the project neglects great differences among geographical areas in the country, providing the same compensation and length of compensation period to all participants. Appropriate compensation mechanisms should be established and adapted to local economic, environmental, and social conditions. In managing nature reserves and moving toward sustainability, ensuring all aspects of local socioeconomic and ecological/environmental issues are properly addressed is a real challenge. Based on our study, some recommendations for improving sustainability of the project are given.
High Energy Density Li-Ion Batteries Designed for Low Temperature Applications Project
National Aeronautics and Space Administration — The state-of-the-art Li-ion batteries do not fully meet the energy density, power density and safety requirements specified by NASA for future exploration missions....
孙英杰; 曹其新; 洪炳熔
2004-01-01
We present an omnidirectional vision system we have implemented to provide our mobile robot with a fast tracking and robust localization capability. An algorithm is proposed to do reconstruction of the environmentfrom the omnidirectional image and global localization of the robot in the context of the Middle Size League RoboCup field. This is accomplished by learning a set of visual landmarks such as the goals and the corner posts. Due to the dynamic changing environment and the partially observable landmarks, four localization cases are discussed in order to get robust localization performance. Localization is performed using a method that matches the observed landmarks, i.e. color blobs, which are extracted from the environment. The advantages of the cylindrical projection are discussed giving special consideration to the characteristics of the visual landmark and the meaning of the blob extraction. The analysis is established based on real time experiments with our omnidirectional vision system and the actual mobile robot. The comparative studies are presented and the feasibility of the method is shown.
Lorenz, Susanne; Dessai, Suraje; Forster, Piers M; Paavola, Jouni
2015-11-28
Visualizations are widely used in the communication of climate projections. However, their effectiveness has rarely been assessed among their target audience. Given recent calls to increase the usability of climate information through the tailoring of climate projections, it is imperative to assess the effectiveness of different visualizations. This paper explores the complexities of tailoring through an online survey conducted with 162 local adaptation practitioners in Germany and the UK. The survey examined respondents' assessed and perceived comprehension (PC) of visual representations of climate projections as well as preferences for using different visualizations in communicating and planning for a changing climate. Comprehension and use are tested using four different graph formats, which are split into two pairs. Within each pair the information content is the same but is visualized differently. We show that even within a fairly homogeneous user group, such as local adaptation practitioners, there are clear differences in respondents' comprehension of and preference for visualizations. We do not find a consistent association between assessed comprehension and PC or use within the two pairs of visualizations that we analysed. There is, however, a clear link between PC and use of graph format. This suggests that respondents use what they think they understand the best, rather than what they actually understand the best. These findings highlight that audience-specific targeted communication may be more complex and challenging than previously recognized.
Eres, Robert; Decety, Jean; Louis, Winnifred R; Molenberghs, Pascal
2015-08-15
The understanding of empathy from a neuroscientific perspective has recently developed quickly, with numerous functional MRI studies associating different brain regions with different components of empathy. A recent meta-analysis across 40 fMRI studies revealed that affective empathy is most often associated with increased activity in the insula, whereas cognitive empathy is most often associated with activity in the midcingulate cortex and adjacent dorsomedial prefrontal cortex (MCC/dmPFC). To date, however, it remains unclear whether individual differences in brain morphometry in these regions underlie different dispositions in affective and cognitive empathy. In order to test this hypothesis, voxel-based morphometry (VBM) was used to examine the extent to which gray matter density predicts scores from an established empathy measure (Questionnaire of Cognitive and Affective Empathy; QCAE). One hundred and seventy-six participants completed the QCAE and underwent MRI in order to acquire a high-resolution, three-dimensional T1-weighted structural scans. A factor analysis of the questionnaire scores revealed two distinct factors of empathy, affective and cognitive, which confirmed the validity of the QCAE. VBM results revealed gray matter density differences associated with the distinct components of empathy. Higher scores on affective empathy were associated with greater gray matter density in the insula cortex and higher scores of cognitive empathy were associated with greater gray matter density in the MCC/dmPFC. Taken together, these results provide validation for empathy being a multi-component construct, suggesting that affective and cognitive empathy are differentially represented in brain morphometry as well as providing convergent evidence for empathy being represented by different neural and structural correlates. Copyright © 2015 Elsevier Inc. All rights reserved.
van Rooij, J.M.; Kok, J.P; Videler, J.J
We compare the (relative) abundance of life phases [juveniles (JU), initial phase (IF) and terminal phase (TP) fish], social categories (territorial and group adults), and fish following alternative mating styles, in three local populations of the protogynous reef herbivore, Sparisoma viride, on the
van Rooij, J.M.; Kok, J.P; Videler, J.J
1996-01-01
We compare the (relative) abundance of life phases [juveniles (JU), initial phase (IF) and terminal phase (TP) fish], social categories (territorial and group adults), and fish following alternative mating styles, in three local populations of the protogynous reef herbivore, Sparisoma viride, on the
Ni, Ming-Jiu
2009-10-01
Two consistent projection methods of second-order temporal and spatial accuracy have been developed on a rectangular collocated mesh for variable density Navier-Stokes equations with a continuous surface force. Instead of the original projection methods (denoted as algorithms I and II in this paper), in which the updated cell center velocity from the intermediate velocity and the pressure gradient is not guaranteed solenoidal, the consistent projection methods (denoted as algorithms III and IV) obtain the cell center velocity based on an interpolation from a conservative fluxes with velocity unit on surrounding cell faces. Dependent on treatment of the continuous surface force, the pressure gradient in algorithm III or the sum of the pressure gradient and the surface force in algorithm IV at a cell center is then conducted from the difference between the updated velocity and the intermediate velocity in a consistent projection method. A non-viscous 3D static drop with serials of density ratios is numerically simulated. Using the consistent projection methods, the spurious currents can be greatly reduced and the pressure jump across the interface can be accurately captured without oscillations. The developed consistent projection method are also applied for simulation of interface evolution of an initial ellipse driven by the surface tension and of an initial sphere bubble driven by the buoyancy with good accuracy and good resolution.
Herter, Barbara; Wolf, Sebastian; Fischer, Stefan; Gutmann, Johannes; Bläsi, Benedikt; Goldschmidt, Jan Christoph
2013-09-09
In upconversion processes, two or more low-energy photons are converted into one higher-energy photon. Besides other applications, upconversion has the potential to decrease sub-band-gap losses in silicon solar cells. Unfortunately, upconverting materials known today show quantum yields, which are too low for this application. In order to improve the upconversion quantum yield, two parameters can be tuned using photonic structures: first, the irradiance can be increased within the structure. This is beneficial, as upconversion is a non-linear process. Second, the rates of the radiative transitions between ionic states within the upconverter material can be altered due to a varied local density of photonic states. In this paper, we present a theoretical model of the impact of a photonic structure on upconversion and test this model in a simulation based analysis of the upconverter material β -NaYF(4):20% Er(3+) within a dielectric waveguide structure. The simulation combines a finite-difference time-domain simulation model that describes the variations of the irradiance and the change of the local density of photonic states within a photonic structure, with a rate equation model of the upconversion processes. We find that averaged over the investigated structure the upconversion luminescence is increased by a factor of 3.3, and the upconversion quantum yield can be improved in average by a factor of 1.8 compared to the case without the structure for an initial irradiance of 200 Wm(-2).
He, Shenglai; Russakoff, Arthur; Li, Yonghui; Varga, Kálmán
2016-07-01
The spatial current distribution in H-terminated zigzag graphene nanoribbons (ZGNRs) under electrical bias is investigated using time-dependent density-functional theory solved on a real-space grid. A projected complex absorbing potential is used to minimize the effect of reflection at simulation cell boundary. The calculations show that the current flows mainly along the edge atoms in the hydrogen terminated pristine ZGNRs. When a vacancy is introduced to the ZGNRs, loop currents emerge at the ribbon edge due to electrons hopping between carbon atoms of the same sublattice. The loop currents hinder the flow of the edge current, explaining the poor electric conductance observed in recent experiments.
The luminosity-specific Planetary Nebulae density in Local Group galaxies
Corradi, R. L. M.; Buzzoni, A.; Arnaboldi, M.
The value of the α ratio, the number of PNe per unit bolometric luminosity in a galaxy, is computed using stellar population synthesis models covering the whole range of Hubble types of galaxies.Model predictions are compared with the PNe counts in the Local Group, which indicate a fairly constant value of α - between 1 and 6 PNe per 10^7 solar luminosities - along the Hubble sequence.
Pyon, Sunseng, E-mail: pyon@ap.t.u-tokyo.ac.jp; Mine, Akinori; Suwa, Takahiro; Tamegai, Tsuyoshi
2016-11-15
Highlights: • (Ba,K)Fe{sub 2}As{sub 2} superconducting pressed tapes are fabricated. • We found an intriguing anisotropy in J{sub c} determined by magnetic measurements, which is related to microcrack structures affecting the local J{sub c}. • Microcrack structures are directly observed by magneto-optical imaging technique. - Abstract: We demonstrate the fabrication of (Ba,K)Fe{sub 2}As{sub 2} superconducting pressed tapes through a powder-in-tube method using uniaxial cold pressing technique, and evaluate global and local J{sub c} by several physical measurements. We found an intriguing anisotropy in J{sub c} determined by magnetic measurements, which is related to microcrack structures affecting the local J{sub c}. The maximum J{sub c} estimated from magnetization measurements has reached ∼1.9 × 10{sup 5} A/cm{sup 2} under self-field at 4.2 K. Furthermore, microcrack structures are directly observed by magneto-optical imaging technique.
Arnold, Thorsten; Siegmund, Marc; Pankratov, Oleg, E-mail: thorsten.arnold@physik.uni-erlangen.de, E-mail: marc.siegmund@physik.uni-erlangen.de [Lehrstuhl fuer Theoretische Festkoerperphysik, Universitaet Erlangen-Nuernberg, Staudtstrasse 7 B2, D-91058 Erlangen (Germany)
2011-08-24
We apply exact-exchange spin-density functional theory in the Krieger-Li-Iafrate approximation to interacting electrons in quantum rings of different widths. The rings are threaded by a magnetic flux that induces a persistent current. A weak space and spin symmetry breaking potential is introduced to allow for localized solutions. As the electron-electron interaction strength described by the dimensionless parameter r{sub S} is increased, we observe-at a fixed spin magnetic moment-the subsequent transition of both spin sub-systems from the Fermi liquid to the Wigner crystal state. A dramatic signature of Wigner crystallization is that the persistent current drops sharply with increasing r{sub S}. We observe simultaneously the emergence of pronounced oscillations in the spin-resolved densities and in the electron localization functions indicating a spatial electron localization showing ferrimagnetic order after both spin sub-systems have undergone the Wigner crystallization. The critical r{sub S}{sup c} at the transition point is substantially smaller than in a fully spin-polarized system and decreases further with decreasing ring width. Relaxing the constraint of a fixed spin magnetic moment, we find that on increasing r{sub S} the stable phase changes from an unpolarized Fermi liquid to an antiferromagnetic Wigner crystal and finally to a fully polarized Fermi liquid.
Arnold, Thorsten; Siegmund, Marc; Pankratov, Oleg
2011-08-24
We apply exact-exchange spin-density functional theory in the Krieger-Li-Iafrate approximation to interacting electrons in quantum rings of different widths. The rings are threaded by a magnetic flux that induces a persistent current. A weak space and spin symmetry breaking potential is introduced to allow for localized solutions. As the electron-electron interaction strength described by the dimensionless parameter r(S) is increased, we observe-at a fixed spin magnetic moment-the subsequent transition of both spin sub-systems from the Fermi liquid to the Wigner crystal state. A dramatic signature of Wigner crystallization is that the persistent current drops sharply with increasing r(S). We observe simultaneously the emergence of pronounced oscillations in the spin-resolved densities and in the electron localization functions indicating a spatial electron localization showing ferrimagnetic order after both spin sub-systems have undergone the Wigner crystallization. The critical r(S)(c) at the transition point is substantially smaller than in a fully spin-polarized system and decreases further with decreasing ring width. Relaxing the constraint of a fixed spin magnetic moment, we find that on increasing r(S) the stable phase changes from an unpolarized Fermi liquid to an antiferromagnetic Wigner crystal and finally to a fully polarized Fermi liquid.
Highly accurate local pseudopotentials of Li, Na, and Mg for orbital free density functional theory
Legrain, Fleur; Manzhos, Sergei
2015-02-01
We present a method to make highly accurate pseudopotentials for use with orbital-free density functional theory (OF-DFT) with given exchange-correlation and kinetic energy functionals, which avoids the compounding of errors of Kohn-Sham DFT and OF-DFT. The pseudopotentials are fitted to reference (experimental or highly accurate quantum chemistry) values of interaction energies, geometries, and mechanical properties, using a genetic algorithm. This can enable routine large-scale ab initio simulations of many practically relevant materials. Pseudopotentials for Li, Na, and Mg resulting in accurate geometries and energies of different phases as well as of vacancy formation and bulk moduli are presented as examples.
Multimode Process Monitoring Based on Fuzzy C-means in Locality Preserving Projection Subspace
解翔; 侍洪波
2012-01-01
For complex industrial processes with multiple operational conditions, it is important to develop effective monitoring algorithms to ensure the safety of production processes. This paper proposes a novel monitoring strategy based on fuzzy C-means. The high dimensional historical data are transferred to a low dimensional subspace spanned by locality preserving projection. Then the scores in the novel subspace are classified into several overlapped clusters, each representing an operational mode. The distance statistics of each cluster are integrated though the membership values into a novel BID (Bayesian inference distance) monitoring index. The efficiency and effectiveness of the proposed method are validated though the Tennessee Eastman benchmark process.
A.Muthukumaravel
2011-08-01
Full Text Available This paper presents implementation of locally weighted projection regression (LWPR network method for concurrency control while developing dial of a fork using Autodesk inventor 2008. The LWPR learns the objects and the type of transactions to be done based on which node in the output layer of the network exceeds a threshold value. Learning stops once all the objects are exposed to LWPR. During testing performance, metrics are analyzed. We have attempted to use LWPR for storing lock information when multi users are working on computer Aided Design (CAD. The memory requirements of the proposed method are minimal in processing locks during transaction.
De Marco, Stefano
2011-01-01
We study smoothness of densities for the solutions of SDEs whose coefficients are smooth and nondegenerate only on an open domain $D$. We prove that a smooth density exists on $D$ and give upper bounds for this density. Under some additional conditions (mainly dealing with the growth of the coefficients and their derivatives), we formulate upper bounds that are suitable to obtain asymptotic estimates of the density for large values of the state variable ("tail" estimates). These results specify and extend some results by Kusuoka and Stroock [J. Fac. Sci. Univ. Tokyo Sect. IA Math. 32 (1985) 1--76], but our approach is substantially different and based on a technique to estimate the Fourier transform inspired from Fournier [Electron. J. Probab. 13 (2008) 135--156] and Bally [Integration by parts formula for locally smooth laws and applications to equations with jumps I (2007) The Royal Swedish Academy of Sciences]. This study is motivated by existing models for financial securities which rely on SDEs with non-...
Physical Modeling of Localized Scour for the Yangtze Estuary Waterway Improvement Project, Phase Ⅰ
JlA Jianjun; LU Wujiang; QIAN Yadong
2000-01-01
In order to examine the effectiveness of engineering protection against localized scour in front of the south groin-group of the Yangtze Estuary Waterway Improvement Project, Phase Ⅰ , an undistorted physical model on a geometric scale of 1:250 is built in this study, covering two groins and their adacent estuarine areas. By use of rinsing fix-bed model as well as localized mobile-bed model, the experiment is undertaken under bi-directional steady flow. According to the experimental results, waterway dredging leads to the increase in steram velocity, the increase being larger during the ebb than during the flood. Construction of the upstream groin has some influence on the flow patterns near the downstream groin. Localized scour in front of the groin-heads is controlled mainly by ebb flow. In the case of a riverbed composed entirely of silt, the depths of localized scour in front of the two groin-heads are 27 m and 29 m,respectively. In reality, the underneath sediment of the prototype riverbed is clay whose threshold velocity is much higher than the stream velocity in the Yangtze Estuary; therefore, the depths of localized scour will not be much larger than the thickness of the silt layer, i. e. 7.4 m and 4.7 m, respectively. The designed aprons covering the riverbed in fron of the groin-heads are very effective in scour control. Aprons of slightly smaller size can also fulfill the task of protection, but the area of localized scour increases significantly.
The power spectra of CMB and density fluctuations seeded by local cosmic strings
Contaldi, C; Magueijo, J; Contaldi, Carlo; Hindmarsh, Mark; Magueijo, Joao
1999-01-01
We compute the power spectra in the cosmic microwave background and cold dark matter (CDM) fluctuations seeded by strings, using the largest string simulations performed so far to evaluate the two-point functions of their stress energy tensor. We find that local strings differ from global defects in that the scalar components of the stress-energy tensor dominate over vector and tensor components. This result has far reaching consequences. We find that cosmic strings exhibit a single Doppler peak of acceptable height at high although the CDM power spectrum in the ``standard'' cosmology (flat geometry, zero cosmological constant, 5% baryonic component) is the wrong shape to fit large scale structure data.
Curchod, Basile F E; Penfold, Thomas J; Rothlisberger, Ursula; Tavernelli, Ivano
2013-01-01
The implementation of local control theory using nonadiabatic molecular dynamics within the framework of linear-response time-dependent density functional theory is discussed. The method is applied to study the photoexcitation of lithium fluoride, for which we demonstrate that this approach can efficiently generate a pulse, on-the-fly, able to control the population transfer between two selected electronic states. Analysis of the computed control pulse yields insights into the photophysics of the process identifying the relevant frequencies associated to the curvature of the initial and final state potential energy curves and their energy differences. The limitations inherent to the use of the trajectory surface hopping approach are also discussed.
Julsgaard, Brian; Johansen, Jeppe; Stobbe, Søren
2008-01-01
We have performed time-resolved spectroscopy on InAs quantum dot ensembles in photonic crystal membranes. The influence of the photonic crystal is investigated by varying the lattice constant systematically. We observe a strong slow down of the quantum dots’ spontaneous emission rates as the two-...... the bandgap in good agreement with local density of states calculations.......We have performed time-resolved spectroscopy on InAs quantum dot ensembles in photonic crystal membranes. The influence of the photonic crystal is investigated by varying the lattice constant systematically. We observe a strong slow down of the quantum dots’ spontaneous emission rates as the two...
Lattice specific heat and local density of states of Ni-based dilute alloys at low temperature
P D Semlaty; Kapil Dev; P N Ram
2006-06-01
A detailed theoretical study of the low-temperature lattice specific heat of Ni-based dilute alloys has been carried out. Lattice Green's function method has been used to calculate the local density of states of substitutional impurities and lattice specific heat in different alloys. The resonance condition has been investigated for possible occurrence of resonance modes. Except in NiCr and NiMn, low-frequency resonance modes have been obtained in all the alloys. However, no localized mode was obtained. The impurity-induced increase in lattice specific heat is explained on the basis of the obtained resonance modes. The calculation shows an excellent agreement with the measured lattice specific heat in these alloys
Liao, Sheng-Lun; Ho, Tak-San; Rabitz, Herschel; Chu, Shih-I.
2017-06-01
A long-standing challenge in the time-dependent density functional theory is to efficiently solve the exact time-dependent optimized effective potential (TDOEP) integral equation derived from orbital-dependent functionals, especially for the study of nonadiabatic dynamics in time-dependent external fields. In this Letter, we formulate a completely equivalent time-local TDOEP equation that admits a unique real-time solution in terms of time-dependent Kohn-Sham and effective memory orbitals. The time-local formulation is numerically implemented, with the incorporation of exponential memory loss to address the unaccounted for correlation component in the exact-exchange-only functional, to enable the study of the many-electron dynamics of a one-dimensional hydrogen chain. It is shown that the long time behavior of the electric dipole converges correctly and the zero-force theorem is fulfilled in the current implementation.
Gritsenko, O. V.; Rubio, A.; Balbás, L. C.; Alonso, J. A.
1993-03-01
The model Coulomb pair-correlation functions proposed several years ago by Gritsenko, Bagaturyants, Kazansky, and Zhidomirov are incorporated into the self-consistent local-density approximation (LDA) scheme for electronic systems. Different correlation functions satisfying well-established local boundary conditions and integral conditions have been tested by performing LDA calculations for closed-shell atoms. Those correlation functions contain a single parameter which can be optimized by fitting the atomic correlation energies to empirical data. In this way, a single (universal) value of the parameter is found to give a very good fit for all the atoms studied. The results provide a substantial improvement of calculated correlation energies as compared to the usual LDA functionals and the scheme should be useful for molecular and cluster calculations.
Signature of a Fano-resonance in a plasmonic meta-molecule's local density of optical states
Frimmer, Martin; Koenderink, A Femius
2011-01-01
We present measurements on plasmonic meta-molecules under local excitation using cathodoluminescence which show a spatial redistribution of the local density of optical states (LDOS) at the same frequency where a sharp spectral Fano-feature in the extinction cross section has been observed. Our analytical model shows that both near- and far-field effects arise due to interference of the same two eigenmodes of the system. We present quantitative insights both in a bare state, and in a dressed state picture that describe plasmonic Fano interference either as near-field amplitude transfer between three coupled bare states, or as interference of two uncoupled eigenmodes in the far field. We identify the same eigenmode causing a dip in extinction to strongly enhance the radiative LDOS, making it a promising candidate for spontaneous emission control.
Fanack, C.; Boucher, I.; Heuraux, S.; Leclert, G. [Centre National de la Recherche Scientifique (CNRS), 54 - Nancy (France). Lab. de Physique du Solide; Clairet, F.; Zou, X.L. [Association Euratom-CEA, Centre d`Etudes de Cadarache, 13 - Saint-Paul-lez-Durance (France). Dept. de Recherches sur la Fusion Controlee
1996-01-01
Ordinary wave reflectometry in a plasma containing a localized density perturbation is studied with a 1-D model. The phase response is studied as a function of the wavenumber and position of the perturbation. It is shown that it strongly depends upon the perturbation shape and size. For a small perturbation wavenumber, the response is due to the oscillation of the cut-off layer. For larger wavenumbers, two regimes are found: for a broad perturbation, the phase response is an image of the perturbation itself; for a narrow perturbation, it is rather an image of the Fourier transform. For tokamak plasmas it turns out that, for the fluctuation spectra usually observed, the phase response comes primarily from those fluctuations that are localized at the cut-off. Results of a 2-D numerical model show that geometry effects are negligible for the scattering by radial fluctuations. (author). 18 refs.
Stolyarov, Maxim; Aytan, Ece; Bloodgood, Matthew; Salguero, Tina T.; Balandin, Alexander A.
2016-09-01
The continuous downscaling of interconnect dimensions in combination with the introduction of low-k dielectrics has increased the number of heat dissipation, integration and reliability challenges in modern electronics. As a result, there is a strong need for new materials that have high current-carrying capacity for applications as nanoscale interconnects. In this presentation, we show that quasi-one-dimensional (1D) van der Waals metals such as TaSe3 have excellent breakdown current density exceeding that of 5 MA/cm2. This value is above that currently achievable in conventional copper or aluminum wires. The quasi-1D van der Waals materials are characterized by strong bonds along one dimension and weak van der Waals bonds along two other dimensions. The material for this study was grown by the chemical vapor transport (CVT) method. Both mechanical and chemical exfoliation methods were used to fabricate nanowires with lateral dimensions below 100 nm. The dimensions of the quasi-1D nanowires were verified with scanning electron microscopy (SEM) and atomic force microscopy (AFM). The metal (Ti/Au) contacts for the electrical characterization were deposited using electron beam evaporation (EBE). The measurements were conducted on a number of prototype interconnects with multiple electric contacts to ensure reproducibility. The obtained results suggest that quasi-1D van der Waals metals present a feasible alternative to conventional copper interconnects in terms of the current-carrying capacity and the breakdown current-density. This work was supported, in part, by the SRC and DARPA through STARnet Center for Function Accelerated nanoMaterial Engineering (FAME).
Shaowei Sang
Full Text Available Each year there are approximately 390 million dengue infections worldwide. Weather variables have a significant impact on the transmission of Dengue Fever (DF, a mosquito borne viral disease. DF in mainland China is characterized as an imported disease. Hence it is necessary to explore the roles of imported cases, mosquito density and climate variability in dengue transmission in China. The study was to identify the relationship between dengue occurrence and possible risk factors and to develop a predicting model for dengue's control and prevention purpose.Three traditional suburbs and one district with an international airport in Guangzhou city were selected as the study areas. Autocorrelation and cross-correlation analysis were used to perform univariate analysis to identify possible risk factors, with relevant lagged effects, associated with local dengue cases. Principal component analysis (PCA was applied to extract principal components and PCA score was used to represent the original variables to reduce multi-collinearity. Combining the univariate analysis and prior knowledge, time-series Poisson regression analysis was conducted to quantify the relationship between weather variables, Breteau Index, imported DF cases and the local dengue transmission in Guangzhou, China. The goodness-of-fit of the constructed model was determined by pseudo-R2, Akaike information criterion (AIC and residual test. There were a total of 707 notified local DF cases from March 2006 to December 2012, with a seasonal distribution from August to November. There were a total of 65 notified imported DF cases from 20 countries, with forty-six cases (70.8% imported from Southeast Asia. The model showed that local DF cases were positively associated with mosquito density, imported cases, temperature, precipitation, vapour pressure and minimum relative humidity, whilst being negatively associated with air pressure, with different time lags.Imported DF cases and mosquito
Mulik, Rohit S; Bing, Chenchen; Ladouceur-Wodzak, Michelle; Munaweera, Imalka; Chopra, Rajiv; Corbin, Ian R
2016-03-01
Focused ultrasound exposures in the presence of microbubbles can achieve transient, non-invasive, and localized blood-brain barrier (BBB) opening, offering a method for targeted delivery of therapeutic agents into the brain. Low-density lipoprotein (LDL) nanoparticles reconstituted with docosahexaenoic acid (DHA) could have significant therapeutic value in the brain, since DHA is known to be neuroprotective. BBB opening was achieved using pulsed ultrasound exposures in a localized brain region in normal rats, after which LDL nanoparticles containing the fluorescent probe DiR (1,1'-Dioctadecyl-3,3,3',3'-Tetramethylindotricarbocyanine Iodide) or DHA were administered intravenously. Fluorescent imaging of brain tissue from rats administered LDL-DiR demonstrated strong localization of fluorescence signal in the exposed hemisphere. LDL-DHA administration produced 2 × more DHA in the exposed region of the brain, with a corresponding increase in Resolvin D1 levels, indicating DHA was incorporated into cells and metabolized. Histological evaluation did not indicate any evidence of increased tissue damage in exposed brain regions compared to normal brain. This work demonstrates that localized delivery of DHA to the brain is possible using systemically-administered LDL nanoparticles combined with pulsed focused ultrasound exposures in the brain. This technology could be used in regions of acute brain injury or as a means to target infiltrating tumor cells in the brain.
Gry, C; Gry, Cecile; Jenkins, Edward B.
2001-01-01
The composition and physical properties of several local clouds, including the Local Interstellar Cloud (LIC) in which the Sun is embedded, are derived from absorption features in the UV spectrum of the star epsilon CMa. We derive temperatures and densities for three components by combining our interpretations of the ionization balance of magnesium and the relative population of C II in an excited fine-structure level. We find that for the LIC n(e) = 0.12 +/-0.05 cm-3 and T = 7000 +/-1200 K. We derive the ionization fractions of hydrogen and discuss the ionizing processes. In particular the hydrogen and helium ionizations in the LIC are compatible with photoionization by the local EUV radiation fields from the hot stars and the cloud interface with the hot gas. We confirm the detection of high ionization species : Si III is detected in all clouds and C IV in two of them, including the LIC, suggesting the presence of ionized interfaces around the local clouds.
The APOSTLE project: Local Group kinematic mass constraints and simulation candidate selection
Fattahi, Azadeh; Sawala, Till; Frenk, Carlos S; Oman, Kyle A; Crain, Robert A; Furlong, Michelle; Schaller, Matthieu; Schaye, Joop; Theuns, Tom; Jenkins, Adrian
2015-01-01
We use a large sample of isolated dark matter halo pairs drawn from cosmological N-body simulations to identify candidate systems whose kinematics match that of the Local Group of Galaxies (LG). We find, in agreement with the "timing argument" and earlier work, that the separation and approach velocity of the Milky Way (MW) and Andromeda (M31) galaxies favour a total mass for the pair of ~ 5*10^12 M_sun. A mass this large, however, is difficult to reconcile with the small relative tangential velocity of the pair, as well as with the small deceleration from the Hubble flow observed for the most distant LG members. Halo pairs that match these three criteria have average masses a factor of ~2 times smaller than suggested by the timing argument, but with large dispersion, spanning more than a decade in mass. Guided by these results, we have selected 12 halo pairs with total mass in the range 1.6-3.6 *10^12 M_sun for the APOSTLE project (A Project Of Simulations of The Local Environment), a suite of resimulations ...
Bailey, Mandy; Farhang, Amin; Javadi, Atefeh; Khosroshahi, Habib G; Sarre, Peter J; Smith, Keith T
2016-01-01
We have conducted a high signal-to-noise spectroscopic survey of 670 nearby early-type stars, to map Diffuse Interstellar Band (DIB) absorption in and around the Local Bubble. The project started with a Southern hemisphere survey conducted at the European Southern Observatory's New Technology Telescope and has since been extended to an all-sky survey using the Isaac Newton Telescope. In this first paper in the series, we introduce the overall project and present the results from the Southern hemisphere survey. We make available a catalogue of equivalent-width measurements of the DIBs at 5780, 5797, 5850, 6196, 6203, 6270, 6283 \\& 6614 \\AA, the interstellar Na\\,{\\sc i} D lines at 5890 \\& 5896 \\AA, and the stellar He\\,{\\sc i} line at 5876 \\AA. We find that the 5780 \\AA\\ DIB is relatively strong throughout, as compared to the 5797 \\AA\\ DIB, but especially within the Local Bubble and at the interface with more neutral medium. The 6203 \\AA\\ DIB shows a similar behaviour, but with respect to the 6196 \\AA\\ D...
The HI Content of Galaxies as a Function of Local Density and Large-Scale Environment
Thoreen, Henry; Cantwell, Kelly; Maloney, Erin; Cane, Thomas; Brough Morris, Theodore; Flory, Oscar; Raskin, Mark; Crone-Odekon, Mary; ALFALFA Team
2017-01-01
We examine the HI content of galaxies as a function of environment, based on a catalogue of 41527 galaxies that are part of the 70% complete Arecibo Legacy Fast-ALFA (ALFALFA) survey. We use nearest-neighbor methods to characterize local environment, and a modified version of the algorithm developed for the Galaxy and Mass Assembly (GAMA) survey to classify large-scale environment as group, filament, tendril, or void. We compare the HI content in these environments using statistics that include both HI detections and the upper limits on detections from ALFALFA. The large size of the sample allows to statistically compare the HI content in different environments for early-type galaxies as well as late-type galaxies. This work is supported by NSF grants AST-1211005 and AST-1637339, the Skidmore Faculty-Student Summer Research program, and the Schupf Scholars program.
Nakano, Masayoshi, E-mail: mnaka@cheng.es.osaka-u.ac.jp; Minami, Takuya, E-mail: mnaka@cheng.es.osaka-u.ac.jp; Fukui, Hitoshi, E-mail: mnaka@cheng.es.osaka-u.ac.jp; Yoneda, Kyohei, E-mail: mnaka@cheng.es.osaka-u.ac.jp; Shigeta, Yasuteru, E-mail: mnaka@cheng.es.osaka-u.ac.jp; Kishi, Ryohei, E-mail: mnaka@cheng.es.osaka-u.ac.jp [Department of Materials Engineering Science, Graduate School of Engineering Science, Osaka University, Toyonaka, Osaka 560-8531 (Japan); Champagne, Benoît; Botek, Edith [Laboratoire de Chimie Théorique, Facultés Universitaires Notre-Dame de la Paix (FUNDP), rue de Bruxelles, 61, 5000 Namur (Belgium)
2015-01-22
We develop a novel method for the calculation and the analysis of the one-electron reduced densities in open-shell molecular systems using the natural orbitals and approximate spin projected occupation numbers obtained from broken symmetry (BS), i.e., spin-unrestricted (U), density functional theory (DFT) calculations. The performance of this approximate spin projection (ASP) scheme is examined for the diradical character dependence of the second hyperpolarizability (γ) using several exchange-correlation functionals, i.e., hybrid and long-range corrected UDFT schemes. It is found that the ASP-LC-UBLYP method with a range separating parameter μ = 0.47 reproduces semi-quantitatively the strongly-correlated [UCCSD(T)] result for p-quinodimethane, i.e., the γ variation as a function of the diradical character.
Demare, Patricia; Regla, Ignacio
2012-01-01
This article describes one of the projects in the advanced undergraduate organic chemistry laboratory course concerning the synthesis of two local anesthetic drugs, prilocaine and benzocaine, with a common three-step sequence starting from toluene. Students undertake, in a several-week independent project, the multistep synthesis of a…
Demare, Patricia; Regla, Ignacio
2012-01-01
This article describes one of the projects in the advanced undergraduate organic chemistry laboratory course concerning the synthesis of two local anesthetic drugs, prilocaine and benzocaine, with a common three-step sequence starting from toluene. Students undertake, in a several-week independent project, the multistep synthesis of a…
3D localization of electrophysiology catheters from a single x-ray cone-beam projection
Robert, Normand, E-mail: normand.robert@sri.utoronto.ca; Polack, George G.; Sethi, Benu; Rowlands, John A. [Physical Sciences, Sunnybrook Research Institute, 2075 Bayview Avenue, Toronto, Ontario M4N 3M5 (Canada); Crystal, Eugene [Division of Cardiology, Sunnybrook Health Sciences Centre, 2075 Bayview Avenue, Toronto, Ontario M4N 3M5 (Canada)
2015-10-15
Purpose: X-ray images allow the visualization of percutaneous devices such as catheters in real time but inherently lack depth information. The provision of 3D localization of these devices from cone beam x-ray projections would be advantageous for interventions such as electrophysiology (EP), whereby the operator needs to return a device to the same anatomical locations during the procedure. A method to achieve real-time 3D single view localization (SVL) of an object of known geometry from a single x-ray image is presented. SVL exploits the change in the magnification of an object as its distance from the x-ray source is varied. The x-ray projection of an object of interest is compared to a synthetic x-ray projection of a model of said object as its pose is varied. Methods: SVL was tested with a 3 mm spherical marker and an electrophysiology catheter. The effect of x-ray acquisition parameters on SVL was investigated. An independent reference localization method was developed to compare results when imaging a catheter translated via a computer controlled three-axes stage. SVL was also performed on clinical fluoroscopy image sequences. A commercial navigation system was used in some clinical image sequences for comparison. Results: SVL estimates exhibited little change as x-ray acquisition parameters were varied. The reproducibility of catheter position estimates in phantoms denoted by the standard deviations, (σ{sub x}, σ{sub y}, σ{sub z}) = (0.099 mm, 0.093 mm, 2.2 mm), where x and y are parallel to the detector plane and z is the distance from the x-ray source. Position estimates (x, y, z) exhibited a 4% systematic error (underestimation) when compared to the reference method. The authors demonstrated that EP catheters can be tracked in clinical fluoroscopic images. Conclusions: It has been shown that EP catheters can be localized in real time in phantoms and clinical images at fluoroscopic exposure rates. Further work is required to characterize
Jacobi, Johanna; Mathez-Stiefel, Sarah-Lan; Gambon, Helen; Rist, Stephan; Altieri, Miguel
2017-03-01
Agroforestry often relies on local knowledge, which is gaining recognition in development projects. However, how local knowledge can articulate with external and scientific knowledge is little known. Our study explored the use and integration of local and external knowledge in agroforestry projects in Bolivia. In 42 field visits and 62 interviews with agroforestry farmers, civil society representatives, and policymakers, we found a diverse knowledge base. We examined how local and external knowledge contribute to livelihood assets and tree and crop diversity. Projects based predominantly on external knowledge tended to promote a single combination of tree and crop species and targeted mainly financial capital, whereas projects with a local or mixed knowledge base tended to focus on food security and increased natural capital (e.g., soil restoration) and used a higher diversity of trees and crops than those with an external knowledge base. The integration of different forms of knowledge can enable farmers to better cope with new challenges emerging as a result of climate change, fluctuating market prices for cash crops, and surrounding destructive land use strategies such as uncontrolled fires and aerial fumigation with herbicides. However, many projects still tended to prioritize external knowledge and undervalue local knowledge—a tendency that has long been institutionalized in the formal educational system and in extension services. More dialogue is needed between different forms of knowledge, which can be promoted by strengthening local organizations and their networks, reforming agricultural educational institutions, and working in close interaction with policymakers.
Emilio M. Bruna
2004-09-01
Full Text Available Reproductive plants in tropical forests are patchily distributed, with some in large aggregations of reproductive consepecifics while others are relatively isolated. This variation in floral density is hypothesized to have a major effect on plant reproductive success, since individuals in higher density neighborhoods can attract more or higher quality pollinators. We experimentally tested this hypothesis with populations of the understory herb Heliconia acuminata in central Amazonia. We created replicated plots in which reproductive plant density spanned the range of naturally occurring floral neighborhood size, then measured three surrogates of plant fitness in focal plants in each array. There was no significant difference between any of the three floral neighborhood treatments in total seed production, fruit set, or the number of seeds produced per fruit. Pollinator visitation rates to plants in all treatments were extremely low, with many plants not visited at all during the observation period. This could be because H. acuminata's hummingbird pollinators are unable to find the widely scattered reproductive plants, however this hypothesis appears unlikely. Instead, natural flowering plant densities may simply be below the threshold value at which neighborhood effects become important, even in "high-density" aggregations. Nutrient limitation, selective fruit abortion, and reproduction via male rather than female function may also be playing a role. We argue the absence of neighborhood effects may be a general phenomenon in central Amazonian forests, though additional experiments with other plant-pollinator systems are needed to determine the extent to which this hypothesis is supported.Plantas reprodutivas em florestas tropicas são distribuidas em manchas, com algumas em grandes agregações coespecíficas e outras relativamente isoladas. A hipótese é que esta variação na densidade de flores em um local tem um grande efeito no sucesso
[Building local citizen participation among older adults : A participatory project].
Douma, Linden; Bouwman, Ruben; Hutter, Inge; Meijering, Louise
2017-02-01
Dutch municipalities are looking for ways to promote citizen participation, among which older adults. This paper discusses older adults' experiences regarding favoring and inhibiting factors for lasting and independent citizen participation around the themes of housing, wellbeing and health care. The participatory research project lasted from April 2014 to March 2016. The organizational structure consisted of a working group, a group of 21 participants (aged 65+) and the research team. Interviews and focus-group discussions were used. The project did not result in lasting and independent citizen participation of older adults, as was intended beforehand. When we examined the experiences of the participants, we found that their participation was favored and inhibited by the factors Can do, Like to, Enabled to, Asked to, and Responded to. In order for citizen participation to be successful, all five identified factors should be met by the stakeholders involved. To achieve this we recommend to fine-tune the mutual expectations of the stakeholders, using the CLEAR model. The empirically grounded knowledge, generated throughout the project, strengthens the existing evidence-base about participation of older adults and helps to shape local participation programs.
Valor, A; Robledo, L M
2000-01-01
We derive the equations for approximate particle number projection based on mean field wave functions with finite range density dependent forces. As an application ground bands of even-A superdeformed nuclei in the A=150 and A=190 regions are calculated with the Gogny force. We discuss nuclear properties such as quadrupole moments, moments of inertia and quasiparticle spectra, among others, as a function of the angular momentum. We obtain a good overall description.
Evaluation of localized muscle fatigue using power spectral density analysis of the electromyogram
Lafevers, E. V.
1974-01-01
Surface electromyograms (EMGs) taken from three upper torso muscles during a push-pull task were analyzed by a power spectral density technique to determine the operational feasibility of the technique for identifying changes in the EMGs resulting from muscular fatigue. The EMGs were taken from four subjects under two conditions (1) in shirtsleeves and (2) in a pressurized space suit. This study confirmed that frequency analysis of dynamic muscle activity is capable of providing reliable data for many industrial applications where fatigue may be of practical interest. The results showed significant effects of the pressurized space suit on the pattern of shirtsleeve fatigue responses of the muscles. The data also revealed (1) reliable differences between muscles in fatigue-induced responses to various locations in the reach envelope at which the subjects were required to perform the push-pull exercise and (2) the differential sensitivity of muscles to the various reach positions in terms of fatigue-related shifts in EMG power.
Genova, Alessandro; Pavanello, Michele
2015-12-01
In order to approximately satisfy the Bloch theorem, simulations of complex materials involving periodic systems are made {{n}\\text{k}} times more complex by the need to sample the first Brillouin zone at {{n}\\text{k}} points. By combining ideas from Kohn-Sham density-functional theory (DFT) and orbital-free DFT, for which no sampling is needed due to the absence of waves, subsystem DFT offers an interesting middle ground capable of sizable theoretical speedups against Kohn-Sham DFT. By splitting the supersystem into interacting subsystems, and mapping their quantum problem onto separate auxiliary Kohn-Sham systems, subsystem DFT allows an optimal topical sampling of the Brillouin zone. We elucidate this concept with two proof of principle simulations: a water bilayer on Pt[1 1 1]; and a complex system relevant to catalysis—a thiophene molecule physisorbed on a molybdenum sulfide monolayer deposited on top of an α-alumina support. For the latter system, a speedup of 300% is achieved against the subsystem DTF reference by using an optimized Brillouin zone sampling (600% against KS-DFT).
mBEEF: An accurate semi-local Bayesian error estimation density functional
Wellendorff, Jess; Lundgaard, Keld T.; Jacobsen, Karsten W.; Bligaard, Thomas
2014-04-01
We present a general-purpose meta-generalized gradient approximation (MGGA) exchange-correlation functional generated within the Bayesian error estimation functional framework [J. Wellendorff, K. T. Lundgaard, A. Møgelhøj, V. Petzold, D. D. Landis, J. K. Nørskov, T. Bligaard, and K. W. Jacobsen, Phys. Rev. B 85, 235149 (2012)]. The functional is designed to give reasonably accurate density functional theory (DFT) predictions of a broad range of properties in materials physics and chemistry, while exhibiting a high degree of transferability. Particularly, it improves upon solid cohesive energies and lattice constants over the BEEF-vdW functional without compromising high performance on adsorption and reaction energies. We thus expect it to be particularly well-suited for studies in surface science and catalysis. An ensemble of functionals for error estimation in DFT is an intrinsic feature of exchange-correlation models designed this way, and we show how the Bayesian ensemble may provide a systematic analysis of the reliability of DFT based simulations.
Local strain energy density to assess the multiaxial fatigue strength of titanium alloys
Filippo Berto
2016-07-01
Full Text Available The present paper investigates the multiaxial fatigue strength of sharp V-notched components made of titanium grade 5 alloy (Ti-6Al-4V. Axisymmetric notched specimens have been tested under combined tension and torsion fatigue loadings, both proportional and non-proportional, taking into account different nominal load ratios (R = -1 and 0. All tested samples have a notch root radius about equal to 0.1 mm, a notch depth of 6 mm and an opening angle of 90 degrees. The fatigue results obtained by applying multiaxial loadings are discussed together with those related to pure tension and pure torsion experimental fatigue tests, carried out on both smooth and notched specimens at load ratios R ranging between -3 and 0.5. Altogether, more than 250 fatigue results (19 S-N curves are examined, first on the basis of nominal stress amplitudes referred to the net area and secondly by means of the strain energy density averaged over a control volume embracing the V-notch tip. The effect of the loading mode on the control volume size has been analysed, highlighting a wide difference in the notch sensitivity of the considered material under tension and torsion loadings. Accordingly, the control radius of the considered titanium alloy (Ti-6Al-4V is found to be strongly affected by the loading mode.
Sun, Y Y; Kim, Yong-Hyun; Lee, Kyuho; Zhang, S B
2008-10-21
Density functional theory (DFT) in the commonly used local density or generalized gradient approximation fails to describe van der Waals (vdW) interactions that are vital to organic, biological, and other molecular systems. Here, we propose a simple, efficient, yet accurate local atomic potential (LAP) approach, named DFT+LAP, for including vdW interactions in the framework of DFT. The LAPs for H, C, N, and O are generated by fitting the DFT+LAP potential energy curves of small molecule dimers to those obtained from coupled cluster calculations with single, double, and perturbatively treated triple excitations, CCSD(T). Excellent transferability of the LAPs is demonstrated by remarkable agreement with the JSCH-2005 benchmark database [P. Jurecka et al. Phys. Chem. Chem. Phys. 8, 1985 (2006)], which provides the interaction energies of CCSD(T) quality for 165 vdW and hydrogen-bonded complexes. For over 100 vdW dominant complexes in this database, our DFT+LAP calculations give a mean absolute deviation from the benchmark results less than 0.5 kcal/mol. The DFT+LAP approach involves no extra computational cost other than standard DFT calculations and no modification of existing DFT codes, which enables straightforward quantum simulations, such as ab initio molecular dynamics, on biomolecular systems, as well as on other organic systems.
Miyo Takahiro
2004-11-01
Full Text Available Abstract Background Seasonal fluctuations in susceptibility to organophosphate insecticides were observed in the Katsunuma population of Drosophila melanogaster for two consecutive years; susceptibility to three organophosphates tended to increase in the fall. To examine the hypothesis that variation in fitness among resistant and susceptible genotypes could trigger the change of genetic constitution within the fall population, we investigated density-independent population projection trajectories starting from single adult females with characteristics of chromosome-substituted lines resistant and susceptible to the three organophosphates. Results Density-independent population projection trajectories, expressed as the ratios of the number of each chromosome-substituted line to that of line SSS, for which all chromosomes were derived from the susceptible line, showed significant declines in numbers with time for all the resistant chromosome-substituted lines. Conclusion The declining tendency in the density-independent population projection trajectories of the resistant chromosome-substituted lines could explain the simultaneous decline in the levels of resistance to the three organophosphates, observed in the Katsunuma population in the fall.
Assessment of Local Biodiversity Loss in Uranium Mining-Tales And Its Projections On Global Scale
Sharshenova, D.; Zhamangulova, N.
2015-12-01
In Min-Kush, northern Kyrgyzstan there are 8 mining tales with an estimate of 1 961 000 tones of industrial Uranium. Local ecosystem services have declined rapidly. We analyzed a terrestrial assemblage database of Uranium mine-tale to quantify local biodiversity responses to land use and environmental changes. In the worst-affected habitats species richness reduced by 95.7%, total abundance by 60.9% and rarefaction-based richness by 72.5%. We estimate that, regional mountain ecosystem affected by this pressure reduced average within-sample richness (by 17.01%), total abundance (16.5%) and rarefaction-based richness (14.5%). Business-as-usual scenarios are the widely practiced in the region and moreover, due to economic constraints country can not afford any mitigation scenarios. We project that biodiversity loss and ecosystem service impairment will spread in the region through ground water, soil, plants, animals and microorganisms at the rate of 1km/year. Entire Tian-Shan mountain chain will be in danger within next 5-10 years. Our preliminary data shows that local people live in this area developed various forms of cancer, and the rate of premature death is as high as 40%. Strong international scientific and socio-economic partnership is needed to develop models and predictions.
Fermionic Projected Entangled Pair States and Local U(1) Gauge Theories
Zohar, Erez; Wahl, Thorsten; Cirac, J Ignacio
2015-01-01
Tensor networks, and in particular Projected Entangled Pair States (PEPS), are a powerful tool for the study of quantum many body physics, thanks to both their built-in ability of classifying and studying symmetries, and the efficient numerical calculations they allow. In this work, we introduce a way to extend the set of symmetric PEPS in order to include local gauge invariance and investigate lattice gauge theories with fermionic matter. To this purpose, we provide as a case study and first example, the construction of a fermionic PEPS, based on Gaussian schemes, invariant under both global and local U(1) gauge transformations. The obtained states correspond to a truncated U(1) lattice gauge theory in 2 + 1 dimensions, involving both the gauge field and fermionic matter. For the global symmetry (pure fermionic) case, these PEPS can be studied in terms of spinless fermions subject to a p-wave superconducting pairing. For the local symmetry (fermions and gauge fields) case, we find confined and deconfined pha...
Cinner, Joshua E; Graham, Nicholas A J; Huchery, Cindy; Macneil, M Aaron
2013-06-01
Coral reef fisheries support the livelihoods of millions of people but have been severely and negatively affected by anthropogenic activities. We conducted a systematic review of published data on the biomass of coral reef fishes to explore how the condition of reef fisheries is related to the density of local human populations, proximity of the reef to markets, and key environmental variables (including broad geomorphologic reef type, reef area, and net productivity). When only population density and environmental covariates were considered, high variability in fisheries conditions at low human population densities resulted in relatively weak explanatory models. The presence or absence of human settlements, habitat type, and distance to fish markets provided a much stronger explanatory model for the condition of reef fisheries. Fish biomass remained relatively low within 14 km of markets, then biomass increased exponentially as distance from reefs to markets increased. Our results suggest the need for an increased science and policy focus on markets as both a key driver of the condition of reef fisheries and a potential source of solutions.
Xu, X. Q., E-mail: xxu@llnl.gov [Lawrence Livermore National Laboratory, Livermore, California 94551 (United States); Ma, J. F. [Lawrence Livermore National Laboratory, Livermore, California 94551 (United States); Institute for Fusion Studies, University of Texas, Austin, Texas 78712 (United States); Li, G. Q. [Lawrence Livermore National Laboratory, Livermore, California 94551 (United States); Institute of Plasma Physics, Chinese Academy of Sciences, Hefei (China)
2014-12-15
The latest BOUT++ studies show an emerging understanding of dynamics of edge localized mode (ELM) crashes and the consistent collisionality scaling of ELM energy losses with the world multi-tokamak database. A series of BOUT++ simulations are conducted to investigate the scaling characteristics of the ELM energy losses vs collisionality via a density scan. Linear results demonstrate that as the pedestal collisionality decreases, the growth rate of the peeling-ballooning modes decreases for high n but increases for low n (1 < n < 5), therefore the width of the growth rate spectrum γ(n) becomes narrower and the peak growth shifts to lower n. Nonlinear BOUT++ simulations show a two-stage process of ELM crash evolution of (i) initial bursts of pressure blob and void creation and (ii) inward void propagation. The inward void propagation stirs the top of pedestal plasma and yields an increasing ELM size with decreasing collisionality after a series of micro-bursts. The pedestal plasma density plays a major role in determining the ELM energy loss through its effect on the edge bootstrap current and ion diamagnetic stabilization. The critical trend emerges as a transition (1) linearly from ballooning-dominated states at high collisionality to peeling-dominated states at low collisionality with decreasing density and (2) nonlinearly from turbulence spreading dynamics at high collisionality into avalanche-like dynamics at low collisionality.
Zhang, Jie; Han, Guangjie; Qian, Yujie
2016-01-01
Increased co-channel interference (CCI) in wireless local area networks (WLANs) is bringing serious resource constraints to today’s high-density wireless environments. CCI in IEEE 802.11-based networks is inevitable due to the nature of the carrier sensing mechanism however can be reduced by resource optimization approaches. That means the CCI analysis is basic, but also crucial for an efficient resource management. In this article, we present a novel CCI analysis approach based on the queuing theory, which considers the randomness of end users’ behavior and the irregularity and complexity of network traffic in high-density WLANs that adopts the M/M/c queuing model for CCI analysis. Most of the CCIs occur when multiple networks overlap and trigger channel contentions; therefore, we use the ratio of signal-overlapped areas to signal coverage as a probabilistic factor to the queuing model to analyze the CCI impacts in highly overlapped WLANs. With the queuing model, we perform simulations to see how the CCI influences the quality of service (QoS) in high-density WLANs. PMID:27563896
Zhang, Jie; Han, Guangjie; Qian, Yujie
2016-08-23
Increased co-channel interference (CCI) in wireless local area networks (WLANs) is bringing serious resource constraints to today's high-density wireless environments. CCI in IEEE 802.11-based networks is inevitable due to the nature of the carrier sensing mechanism however can be reduced by resource optimization approaches. That means the CCI analysis is basic, but also crucial for an efficient resource management. In this article, we present a novel CCI analysis approach based on the queuing theory, which considers the randomness of end users' behavior and the irregularity and complexity of network traffic in high-density WLANs that adopts the M/M/c queuing model for CCI analysis. Most of the CCIs occur when multiple networks overlap and trigger channel contentions; therefore, we use the ratio of signal-overlapped areas to signal coverage as a probabilistic factor to the queuing model to analyze the CCI impacts in highly overlapped WLANs. With the queuing model, we perform simulations to see how the CCI influences the quality of service (QoS) in high-density WLANs.
High Energy Density Solid State Li-ion Battery with Enhanced Safety Project
National Aeronautics and Space Administration — We propose to develop an all solid state Li-ion battery which is capable of delivering high energy density, combined with high safety over a wide operating...
Single Crystal Piezoelectric Deformable Mirrors with High Actuator Density and Large Stroke Project
National Aeronautics and Space Administration — Single crystal piezoelectric deformable mirrors with high actuator density, fine pitch, large stroke and no floating wires will be developed for future NASA science...
Nanomaterials Enabled High Energy and Power Density Li-ion Batteries Project
National Aeronautics and Space Administration — There is a need for high energy (~ 200 Wh/kg) and high power (> 500 W/kg) density rechargeable Li-ion batteries that are safe and reliable for several space and...
Low-Density Parity-Check Codes for High Data Rate Receivers Project
National Aeronautics and Space Administration — Low-Density Parity-Check (LDPC) Forward Error Correction (FEC) schemes are excellent tools in optimizing telemetry data integrity within the limited space to ground...
Infiltration of Carbon Foam for Mid-Density Ablative Thermal Protection Systems Project
National Aeronautics and Space Administration — This proposal addresses NASA's need for improved TPS materials. The incumbent CEV heatshield TPS for Orion's Block II lunar return is PICA, a low-density carbon...
Advanced Cathode Material For High Energy Density Lithium-Batteries Project
National Aeronautics and Space Administration — Advanced cathode materials having high red-ox potential and high specific capacity offer great promise to the development of high energy density lithium-based...
High Energy Density Li-ion Batteries Designed for Low Temperature Applications Project
National Aeronautics and Space Administration — NEI Corporation proposes to develop a mixed metal oxide nanocomposite cathode that is designed for delivering high energy density with good rate performance at low...
Hydroclimatic modelling of local sea level rise and its projection in future
Naren, A.; Maity, Rajib
2016-09-01
Studies on sea level rise (SLR) in the context of climate change are gaining importance in the recent past. Whereas there is some clear evidence of SLR at global scale, its trend varies significantly from location to location. The role of different meteorological variables on sea level change (SLC) is explored. We hypothesise that the role of such variables varies from location to location and modelling of local SLC requires a proper identification of specific role of individual factors. After identifying a group of various local meteorological variables, Supervised Principal Component Analysis (SPCA) is used to develop a location specific Combined Index (CI). The SPCA ensures that the developed CI possesses highest possible association with the historical SLC at that location. Further, using the developed CI, an attempt is made to model the local sea level (LSL) variation in synchronous with the changing climate. The developed approach, termed as hydroclimatic semi-empirical approach, is found to be potential for local SLC at different coastal locations. The validated hydroclimatic approach is used for future projection of SLC at those coastal locations till 2100 for different climate change scenarios, i.e. different Representative Concentration Pathways (RCPs). Future hydrometeorological variables are obtained from Global Climate Models (GCMs) for different such scenarios, i.e. RCP2.6, RCP4.5 and RCP8.5. Effect of glacial isostatic readjustment (GIA) is not included in this study. However, if the reliable information on GIA is available for a location, the same can be arithmetically added to the final outcome of the proposed hydrometeorological approach.
Shimosako, N., E-mail: n-shimosako@sophia.jp; Inose, Y.; Satoh, H.; Kinjo, K.; Nakaoka, T.; Oto, T. [Department of Engineering and Applied Sciences, Sophia University, 7-1 Kioi-cho, Chiyoda-ku, Tokyo 102-8554 (Japan); Kishino, K.; Ema, K. [Department of Engineering and Applied Sciences, Sophia University, 7-1 Kioi-cho, Chiyoda-ku, Tokyo 102-8554 (Japan); Sophia Nanotechnology Research Center, Sophia University, 7-1 Kioi-cho, Chiyoda-ku, Tokyo 102-8554 (Japan)
2015-11-07
We have measured and analyzed the carrier-density dependence of photoluminescence (PL) spectra and the PL efficiency of InGaN/GaN multiple quantum wells in nanocolumns and in a thin film over a wide excitation range. The localized states parameters, such as the tailing parameter, density and size of the localized states, and the mobility edge density are estimated. The spectral change and reduction of PL efficiency are explained by filling of the localized states and population into the extended states around the mobility edge density. We have also found that the nanocolumns have a narrower distribution of the localized states and a higher PL efficiency than those of the film sample although the In composition of the nanocolumns is higher than that of the film.
SiLix-C Nanocomposites for High Energy Density Li-ion Battery Anodes Project
National Aeronautics and Space Administration — For this project Superior Graphite Co. (Chicago, IL, USA), the leading worldwide industrial carbon manufacturer and the only large scale battery grade graphitic...
SiLix-C Nanocomposites for High Energy Density Li-ion Battery Anodes Project
National Aeronautics and Space Administration — For this project Superior Graphite Co. (Chicago, IL, USA), the leading worldwide industrial carbon manufacturer and the only large scale battery grade graphitic...
Local Projection-Based Stabilized Mixed Finite Element Methods for Kirchhoff Plate Bending Problems
Xuehai Huang
2013-01-01
Full Text Available Based on stress-deflection variational formulation, we propose a family of local projection-based stabilized mixed finite element methods for Kirchhoff plate bending problems. According to the error equations, we obtain the error estimates of the approximation to stress tensor in energy norm. And by duality argument, error estimates of the approximation to deflection in H1-norm are achieved. Then we design an a posteriori error estimator which is closely related to the equilibrium equation, constitutive equation, and nonconformity of the finite element spaces. With the help of Zienkiewicz-Guzmán-Neilan element spaces, we prove the reliability of the a posteriori error estimator. And the efficiency of the a posteriori error estimator is proved by standard bubble function argument.
Hechter, Rulin C; Qian, Lei; Sy, Lina S; Greene, Sharon K; Weintraub, Eric S; Naleway, Allison L; Rowhani-Rahbar, Ali; Donahue, James G; Daley, Matthew F; Vazquez-Benitez, Gabriela; Lugg, Marlene M; Jacobsen, Steven J
2013-02-04
Large observational vaccine safety studies often use automated diagnoses extracted from medical care databases to identify pre-specified potential adverse events following immunization (AEFI). We assessed the secular trends and variability in the number of diagnoses per encounter regardless of immunization status referred as diagnostic code density, by healthcare setting, age, and pre-specified condition in eight large health care systems of the Vaccine Safety Datalink project during 2001-2009. An increasing trend in diagnostic code density was observed in all healthcare settings and age groups, with variations across the sites. Sudden increases in diagnostic code density were observed at certain sites when changes in coding policies or data inclusion criteria took place. When vaccine safety studies use an historical comparator, the increased diagnostic code density over time may generate low expected rates (based on historical data) and high observed rates (based on current data), suggesting a false positive association between a vaccine and AEFI. The ongoing monitoring of the diagnostic code density can provide guidance on study design and choice of appropriate comparison groups. It can also be used to ensure data quality and allow timely correction of errors in an active safety surveillance system. Copyright © 2012 Elsevier Ltd. All rights reserved.
McMahan, A K
2005-03-30
This paper reports calculations for compressed Ce (4f{sup 1}), Pr (4f{sup 2}), and Nd (4f{sup 3}) using a combination of the local-density approximation (LDA) and dynamical mean field theory (DMFT), or LDA+DMFT. The 4f moment, spectra, and the total energy among other properties are examined as functions of volume and atomic number for an assumed face-centered cubic (fcc) structure. These materials are seen to be strongly localized at ambient pressure and for compressions up through the experimentally observed fcc phases ({gamma} phase for Ce), in the sense of having fully formed Hund's rules moments and little 4f spectral weight at the Fermi level. Subsequent compression for all three lanthanides brings about significant deviation of the moments from their Hund's rules values, a growing Kondo resonance at the fermi level, an associated softening in the total energy, and quenching of the spin orbit since the Kondo resonance is of mixed spin-orbit character while the lower Hubbard band is predominantly j = 5/2. while the most dramatic changes for Ce occur within the two-phase region of the {gamma}-{alpha} volume collapse transition, as found in earlier work, those for Pr and Nd occur within the volume range of the experimentally observed distorted fcc (dfcc) phase, which is therefore seen here as transitional and not part of the localized trivalent lanthanide sequence. The experimentally observed collapse to the {alpha}-U structure in Pr occurs only on further compression, and no such collapse is found in Nd. These lanthanides start closer to the localized limit for increasing atomic number, and so the theoretical signatures noted above are also offset to smaller volume as well, which is possibly related to the measured systematics of the size of the volume collapse being 15%, 9%, and none for Ce, Pr, and Nd, respectively.
LOCAL-DENSITY FUNCTIONAL AND ON-SITE CORRELATIONS - THE ELECTRONIC-STRUCTURE OF LA2CUO4 AND LACUO3
CZYZYK, MT; SAWATZKY, GA
1994-01-01
State-of-the-art electronic-structure calculations based on the local-density approximation (LDA) to the density functional fail to reproduce the insulating antiferromagnetic ground state in the parent compounds of the high-temperature oxide superconductors. Similar problems have been observed earli
Nicolaus, Marion; Both, Christiaan; Ubels, Richard; Edelaar, Pim; Tinbergen, Joost M.; Butler, Simon
2009-01-01
In birds, local competition for food between pairs during the nestling phase may affect nestling growth and survival. A decrease in clutch size with an increase in breeding density could be an adaptive response to this competition. To investigate whether breeding density causally affected the clutch
Wang, Haifeng; Popov, Pavel; Hiremath, Varun; Lantz, Steven; Viswanathan, Sharadha; Pope, Stephen
2010-11-01
A large-eddy simulation (LES)/probability density function (PDF) code is developed and applied to the study of local extinction and re-ignition in Sandia Flame E. The modified Curl mixing model is used to account for the sub-filter scalar mixing; the ARM1 mechanism is used for the chemical reaction; and the in- situ adaptive tabulation (ISAT) algorithm is used to accelerate the chemistry calculations. Calculations are performed on different grids to study the resolution requirement for this flame. Then, with sufficient grid resolution, full-scale LES/PDF calculations are performed to study the flame characteristics and the turbulence-chemistry interactions. Sensitivity to the mixing frequency model is explored in order to understand the behavior of sub-filter scalar mixing in the context of LES. The simulation results are compared to the experimental data to demonstrate the capability of the code. Comparison is also made to previous RANS/PDF simulations.
Lehtola, Susi; Head-Gordon, Martin; Jónsson, Hannes
2016-07-12
Implentation of seminumerical stability analysis for calculations using the Perdew-Zunger self-interaction correction is described. It is shown that real-valued solutions of the Perdew-Zunger equations for gas phase atoms are unstable with respect to imaginary orbital rotations, confirming that a proper implementation of the correction requires complex-valued orbitals. The orbital density dependence of the self-interaction corrected functional is found to lead to multiple local minima in the case of the acrylic acid, H6, and benzene molecules. In the case of benzene, symmetry breaking that results in incorrect ground state geometry is found to occur, erroneously leading to alternating bond lengths in the molecule.
Yüce, Emre; Claudon, Julien; Gérard, Jean-Michel; Vos, Willem L
2014-01-01
We have reversibly switched the resonance of a GaAs-AlAs microcavity in the near-infrared near $\\lambda =1300$ nm within 300 fs by the electronic Kerr effect. We reveal by pump-probe spectroscopy a remarkable red shift or blue shift of the light confined inside the cavity for small pulse delays, depending on their temporal ordering. The color-converted light is efficiently generated in a broad frequency continuum that differs markedly from the instantaneous cavity resonance in terms of the central frequency and bandwidth. From observations on cavities with different quality factors, we identify the role of the local density of optical states (LDOS) available to the newly generated light frequencies. In particular, we distinguish the effect of the LDOS related to the cavity resonance itself, and the LDOS continuum that leaks in from the vacuum surrounding the cavity. Our new insights provide a unified picture for seemingly disparate results in traditional and nanophotonic nonlinear optics.
Izmodenov, V V; Lallement, R; Glöckler, G; Baranov, V B; Malama, Y G
1998-01-01
The solar system is moving through the partially ionized local interstellar cloud (LIC). The ionized matter of the LIC interacts with the expanding solar wind forming the heliospheric interface. The neutral component (interstellar atoms) penetrates through the heliospheric interface into the heliosphere, where it is measured directly "in situ" as pick-up ions and neutral atoms (and as anomalous cosmic rays) or indirectly through resonant scattering of solar Ly-alpha. When crossing the heliospheric interface, interstellar atoms interact with the plasma component through charge exchange. This interaction leads to changes of both neutral gas and plasma properties. The heliospheric interface is also the source of radio emissions which have been detected by the Voyager since 1983. In this paper, we have used a kinetic model of the flow of the interstellar atoms with updated values of velocity, temperature, and density of the circumsolar interstellar hydrogen and calculated how all quantities which are directly ass...
de Lasson, Jakob Rosenkrantz; Kristensen, Philip Trøst; Mørk, Jesper; Gregersen, Niels
2015-12-15
We present and validate a semianalytical quasi-normal mode (QNM) theory for the local density of states (LDOS) in coupled photonic crystal (PhC) cavity-waveguide structures. By means of an expansion of the Green's function on one or a few QNMs, a closed-form expression for the LDOS is obtained, and for two types of two-dimensional PhCs, with one and two cavities side-coupled to an extended waveguide, the theory is validated against numerically exact computations. For the single cavity, a slightly asymmetric spectrum is found, which the QNM theory reproduces, and for two cavities, a nontrivial spectrum with a peak and a dip is found, which is reproduced only when including both the two relevant QNMs in the theory. In both cases, we find relative errors below 1% in the bandwidth of interest.
Li, Xingfeng; Tian, Jie; Wang, Xiaoxiang; Dai, Jianping; Ai, Lin
2004-04-01
The aim of this study was to assess the validation of the local density random walk (LDRW) function to correct the delayed and dispersed arterial input function (AIF) data derived from dynamic susceptibility contrast magnetic resonance imaging (DSC-MRI). Instead of using the gamma-variate function to smooth and extrapolate the AIF curves, we suggested a method which was based on diffusion with drift approach. Forty-seven AIF curves from ten patients were segmented to test the effectiveness of the proposed method. The results of the comparisons with the gamma-variate function showed that the LDRW distribution function may provide a new means for more accurate correction of AIF curves.
Local density of states study of a spin-orbit-coupling induced Mott insulator Sr2IrO4
Dai, Jixia; Calleja, Eduardo; Cao, Gang; McElroy, Kyle
2014-07-01
We present scanning tunneling microscopy and spectroscopy experiments on the novel Jeff=1/2 Mott insulator Sr2IrO4. Local density of states (LDOS) measurements show an intrinsic insulating gap of 620 meV that is asymmetric about the Fermi level and is larger than previously reported values. The size of this gap suggests that Sr2IrO4 is likely a Mott rather than Slater insulator. In addition, we found a small number of native defects which create in-gap spectral weight. Atomically resolved LDOS measurements on and off the defects show that this energy gap is quite fragile. Together the extended nature of the 5d electrons and poor screening of defects help explain the elusive nature of this gap.
Stellar Spectral Classification with Locality Preserving Projections and Support Vector Machine
Liu Zhong-bao
2016-06-01
With the help of computer tools and algorithms, automatic stellar spectral classification has become an area of current interest. The process of stellar spectral classification mainly includes two steps: dimension reduction and classification. As a popular dimensionality reduction technique, Principal Component Analysis (PCA) is widely used in stellar spectra classification. Another dimensionality reduction technique, Locality Preserving Projections (LPP) has not been widely used in astronomy. The advantage of LPP is that it can preserve the local structure of the data after dimensionality reduction. In view of this, we investigate how to apply LPP+SVM in classifying the stellar spectral subclasses. In the comparative experiment, the performance of LPP is compared with PCA. The stellar spectral classification process is composed of the following steps. Firstly, PCA and LPP are respectively applied to reduce the dimension of spectra data. Then, Support Vector Machine (SVM) is used to classify the 4 subclasses of K-type and 3 subclasses of F-type spectra from Sloan Digital Sky Survey (SDSS). Lastly, the performance of LPP+SVM is compared with that of PCA+SVM in stellar spectral classification, and we found that LPP does better than PCA.
Zhiqin Zhu
2016-11-01
Full Text Available The multi-focus image fusion method is used in image processing to generate all-focus images that have large depth of field (DOF based on original multi-focus images. Different approaches have been used in the spatial and transform domain to fuse multi-focus images. As one of the most popular image processing methods, dictionary-learning-based spare representation achieves great performance in multi-focus image fusion. Most of the existing dictionary-learning-based multi-focus image fusion methods directly use the whole source images for dictionary learning. However, it incurs a high error rate and high computation cost in dictionary learning process by using the whole source images. This paper proposes a novel stochastic coordinate coding-based image fusion framework integrated with local density peaks. The proposed multi-focus image fusion method consists of three steps. First, source images are split into small image patches, then the split image patches are classified into a few groups by local density peaks clustering. Next, the grouped image patches are used for sub-dictionary learning by stochastic coordinate coding. The trained sub-dictionaries are combined into a dictionary for sparse representation. Finally, the simultaneous orthogonal matching pursuit (SOMP algorithm is used to carry out sparse representation. After the three steps, the obtained sparse coefficients are fused following the max L1-norm rule. The fused coefficients are inversely transformed to an image by using the learned dictionary. The results and analyses of comparison experiments demonstrate that fused images of the proposed method have higher qualities than existing state-of-the-art methods.
Pokhrel, Damodar; Murphy, Martin J.; Todor, Dorin A.; Weiss, Elisabeth; Williamson, Jeffrey F. [Department of Radiation Oncology, School of Medicine, Virginia Commonwealth University, Richmond, Virginia 23298 (United States)
2010-09-15
Purpose: To experimentally validate a new algorithm for reconstructing the 3D positions of implanted brachytherapy seeds from postoperatively acquired 2D conebeam-CT (CBCT) projection images. Methods: The iterative forward projection matching (IFPM) algorithm finds the 3D seed geometry that minimizes the sum of the squared intensity differences between computed projections of an initial estimate of the seed configuration and radiographic projections of the implant. In-house machined phantoms, containing arrays of 12 and 72 seeds, respectively, are used to validate this method. Also, four {sup 103}Pd postimplant patients are scanned using an ACUITY digital simulator. Three to ten x-ray images are selected from the CBCT projection set and processed to create binary seed-only images. To quantify IFPM accuracy, the reconstructed seed positions are forward projected and overlaid on the measured seed images to find the nearest-neighbor distance between measured and computed seed positions for each image pair. Also, the estimated 3D seed coordinates are compared to known seed positions in the phantom and clinically obtained VariSeed planning coordinates for the patient data. Results: For the phantom study, seed localization error is (0.58{+-}0.33) mm. For all four patient cases, the mean registration error is better than 1 mm while compared against the measured seed projections. IFPM converges in 20-28 iterations, with a computation time of about 1.9-2.8 min/iteration on a 1 GHz processor. Conclusions: The IFPM algorithm avoids the need to match corresponding seeds in each projection as required by standard back-projection methods. The authors' results demonstrate {approx}1 mm accuracy in reconstructing the 3D positions of brachytherapy seeds from the measured 2D projections. This algorithm also successfully localizes overlapping clustered and highly migrated seeds in the implant.
Beth Hewitt; Juliet Eve
2012-01-01
Objectives – Interviews with library staff and volunteers were conducted to evaluate the use of volunteers in UK public libraries via a case study of the Walter Gardiner Photographic Project, a digitisation project based in Worthing Library, to inform future guidelines on volunteer usage and to make recommendations to existing practice.Methods – Fourteen semi-structured interviews were carried out to explore the perceptions and experiences of both staff and volunteers of the project. All inte...
U.S. Geological Survey, Department of the Interior — Drilling-density cell maps show the number of wells that have been drilled into the storage assessment unit (SAU). Each 1-square-mile cell has a count for the number...
Ihrig, Arvid Conrad; Wieferink, Jürgen; Zhang, Igor Ying; Ropo, Matti; Ren, Xinguo; Rinke, Patrick; Scheffler, Matthias; Blum, Volker
2015-09-01
A key component in calculations of exchange and correlation energies is the Coulomb operator, which requires the evaluation of two-electron integrals. For localized basis sets, these four-center integrals are most efficiently evaluated with the resolution of identity (RI) technique, which expands basis-function products in an auxiliary basis. In this work we show the practical applicability of a localized RI-variant (‘RI-LVL’), which expands products of basis functions only in the subset of those auxiliary basis functions which are located at the same atoms as the basis functions. We demonstrate the accuracy of RI-LVL for Hartree-Fock calculations, for the PBE0 hybrid density functional, as well as for RPA and MP2 perturbation theory. Molecular test sets used include the S22 set of weakly interacting molecules, the G3 test set, as well as the G2-1 and BH76 test sets, and heavy elements including titanium dioxide, copper and gold clusters. Our RI-LVL implementation paves the way for linear-scaling RI-based hybrid functional calculations for large systems and for all-electron many-body perturbation theory with significantly reduced computational and memory cost.
Hida, Yamato; Fukaya, Masahiro; Hagiwara, Akari; Deguchi-Tawarada, Maki; Yoshioka, Toshinori; Kitajima, Isao; Inoue, Eiji; Watanabe, Masahiko; Ohtsuka, Toshihisa
2011-06-01
The planar cell polarity (PCP) protein, Prickle (Pk), is conserved in invertebrates and vertebrates, and regulates cellular morphogenesis and movement. Vertebrate Pk consists of at least two family members, Pk1 and Pk2, both of which are expressed in the brain; however, their localization and function at synapses remain elusive. Here, we show that Pk2 is expressed mainly in the adult brain and is tightly associated with the postsynaptic density (PSD) fraction obtained by subcellular fractionation. In primary cultured rat hippocampal neurons, Pk2 is colocalized with PSD-95 and synaptophysin at synapses. Moreover, immunoelectron microcopy shows that Pk2 is localized at the PSD of asymmetric synapses in the hippocampal CA1 region. Biochemical assays identified that Pk2 forms a complex with PSD proteins including PSD-95 and NMDA receptor subunits via the direct binding to the C-terminal guanylate kinase domain of PSD-95. These results indicate that Pk2 is a novel PSD protein that interacts with PSD-95 and NMDA receptors through complex formations in the brain.
Sun Bo; Zhang Ping
2008-01-01
The electronic structures and properties of PuO2 and Pu2O3 have been studied according to the first principles by using the all-electron projector-augmented-wave (PAW) method. The local density approximation (LDA)+U and the generalized gradient approximation (GGA)+U formalisms have been used to account for the strong on-site Coulomb repulsion among the localized Pu 5f electrons. We discuss how the properties of PuO2 and Pu2O3 are affected by choosing the values of U and exchange-correlation potential. Also, the oxidation reaction of Pu2O3, leading to the formation of PuO2, and its dependence on U and exchange-correlation potential have been studied. Our results show that by choosing an appropriate U it is possible to consistently describe structural, electronic, and thermodynamic properties of PuO2 and Pu2O3, which enable the modelling of the redox process involving Pu-based materials.
Suparb Trethanya
2009-11-01
Full Text Available In developing countries like Thailand, an Environmental Assessment (EA is conducted only for projects prescribed by environmental legislation. Numerous projects, especially those that are small- and medium-scale in size and scope, are implemented in areas by a local authority without any type of EA. Based on a comparative analysis of the environmental status of large-, medium- and small-scale road development projects implemented by a local authority in Thailand, this paper attempts to justify the enforcement of EAs for medium- and small-scale projects. The justification is mainly based on theperceptions of people affected by these projects. Environmental impact scores, computed on the basis of people’s perceptions, reveal that, irrespective of the size of a project, the impacts caused by different sized projects are perceived as similar. Since every development project is implemented for the purpose of human development, this paper proposes to integrate environmental screening and initial EAs into the existing development control measures enforced by urban planning regulations and laws.
Amano, Ken-ichi, E-mail: aman@tohoku-pharm.ac.jp; Takahashi, Ohgi [Faculty of Pharmaceutical Sciences, Tohoku Pharmaceutical University, 4-4-1 Komatsushima, Aoba-ku, Sendai 981-8558 (Japan); Suzuki, Kazuhiro [Department of Electronic Science and Engineering, Kyoto University, Katsura, Nishikyo, Kyoto 615-8510 (Japan); Fukuma, Takeshi [Bio-AFM Frontier Research Center, Kanazawa University, Kakuma-machi, Kanazawa 920-1192 (Japan); Onishi, Hiroshi [Department of Chemistry, Faculty of Science, Kobe University, Nada-ku, Kobe 657-8501 (Japan)
2013-12-14
The density of a liquid is not uniform when placed on a solid. The structured liquid pushes or pulls a probe employed in atomic force microscopy, as demonstrated in a number of experimental studies. In the present study, the relation between the force on a probe and the local density of a liquid is derived based on the statistical mechanics of simple liquids. When the probe is identical to a solvent molecule, the strength of the force is shown to be proportional to the vertical gradient of ln(ρ{sub DS}) with the local liquid's density on a solid surface being ρ{sub DS}. The intrinsic liquid's density on a solid is numerically calculated and compared with the density reconstructed from the force on a probe that is identical or not identical to the solvent molecule.
Spatial optical modulator (SOM): high-density diffractive laser projection display
Yun, SangKyeong; Song, JongHyeong; Yeo, InJae; Choi, YoonJoon; Yurlov, Victor; An, SeungDo; Park, HeungWoo; Yang, HaengSeok; Lee, YeongGyu; Han, KyuBum; Shyshkin, Ihar; Lapchuk, Anatoliy; Oh, KwanYoung; Ryu, SeungWon; Jang, JaeWook; Park, ChangSu; Kim, ChunGi; Kim, SunKi; Kim, EungJu; Woo, KiSuk; Yang, JeongSuong; Kim, EuiJoong; Kim, JooHong; Byun, SungHo; Lee, SeungWoo; Lim, OhkKun; Cheong, JongPil; Hwang, YoungNam; Byun, GiYoung; Kyoung, JeHong; Yoon, SangKee; Lee, JaeKwang; Lee, TaeWon; Hong, SeokKee; Hong, YoonShik; Park, DongHyun; Kang, JungChul; Shin, WooChul; Lee, SungIl; Oh, SungKyung; Song, ByungKi; Kim, HeeYeoun; Koh, ChongMann; Ryu, YungHo; Lee, HyunKee; Baek, YoungKi
2007-02-01
A new type of diffractive spatial optical modulators, named SOM, has been developed by Samsung Electro-Mechanics for laser projection display. It exhibit inherent advantages of fast response time and high-performance light modulation, suitable for high quality embedded laser projection displays. The calculated efficiency and contrast ratio are 75 % and 800:1 respectively in case of 0 th order, 67 % and 1000:1 respectively in case of +/-1st order. The response time is as fast as 0.7 μs. Also we get the displacement of 400 nm enough to display full color with single panel in VGA format, as being 10 V driven. Optical module with VGA was successfully demonstrated for its potential applications in mobile laser projection display such as cellular phone, digital still camera and note PC product. Electrical power consumption is less than 2 W, volume is less than 13 cc. Brightness is enough to watch TV and movie in the open air, being variable up to 6 lm. Even if it's optimal diagonal image size is 10 inch, image quality does not deteriorate in the range of 5 to 50 inch because of the merit of focus-free. Due to 100 % fill factor, the image is seamless so as to be unpleasant to see the every pixel's partition. High speed of response time can make full color display with 24-bit gray scale and cause no scan line artifact, better than any other devices.
Ito Kei
2008-12-01
Full Text Available Abstract Background Encoding of olfactory information in insects occurs in the antennal lobe where the olfactory receptor neurons interact with projection neurons and local interneurons in a complex sensory processing circuitry. While several studies have addressed the developmental mechanisms involved in specification and connectivity of olfactory receptor neurons and projection neurons in Drosophila, the local interneurons are far less well understood. Results In this study, we use genetic marking techniques combined with antibody labelling and neuroblast ablation to analyse lineage specific aspects of local interneuron development. We find that a large set of local interneurons labelled by the GAL4-LN1 (NP1227 and GAL4-LN2 (NP2426 lines arise from the lateral neuroblast, which has also been shown to generate uniglomerular projection neurons. Moreover, we find that a remarkable diversity of local interneuron cell types with different glomerular innervation patterns and neurotransmitter expression derives from this lineage. We analyse the birth order of these two distinct neuronal types by generating MARCM (mosaic analysis with a repressible cell marker clones at different times during larval life. This analysis shows that local interneurons arise throughout the proliferative cycle of the lateral neuroblast beginning in the embryo, while uniglomerular projection neurons arise later during the second larval instar. The lateral neuroblast requires the function of the cephalic gap gene empty spiracles for the development of olfactory interneurons. In empty spiracles null mutant clones, most of the local interneurons and lateral projection neurons are lacking. These findings reveal similarities in the development of local interneurons and projection neurons in the olfactory system of Drosophila. Conclusion We find that the lateral neuroblast of the deutocerebrum gives rise to a large and remarkably diverse set of local interneurons as well as to
Local short-duration precipitation extremes in Sweden: observations, forecasts and projections
Olsson, Jonas; Berg, Peter; Simonsson, Lennart
2015-04-01
Local short-duration precipitation extremes (LSPEs) are a key driver of hydrological hazards, notably in steep catchments with thin soils and in urban environments. The triggered floodings, landslides, etc., have large consequences for society in terms of both economy and health. Accurate estimations of LSPEs on both climatological time-scales (past, present, future) and in real-time is thus of great importance for improved hydrological predictions as well as design of constructions and infrastructure affected by hydrological fluxes. Analysis of LSPEs is, however, associated with various limitations and uncertainties. These are to a large degree associated with the small-scale nature of the meteorological processes behind LSPEs and the associated requirements on observation sensors as well as model descriptions. Some examples of causes for the limitations involved are given in the following. - Observations: High-resolution data sets available for LSPE analyses are often limited to either relatively long series from one or a few stations or relatively short series from larger station networks. Radar data have excellent resolutions in both time and space but the estimated local precipitation intensity is still highly uncertain. New and promising techniques (e.g. microwave links) are still in their infancy. - Weather forecasts (short-range): Although forecasts with the required spatial resolution for potential generation of LSPEs (around 2-4 km) are becoming operationally available, the actual forecast precision of LSPEs is largely unknown. Forecasted LSPEs may be displaced in time or, more critically, in space which strongly affects the possibility to assess hydrological risk. - Climate projections: The spatial resolution of the current RCM generation (around 25 km) is not sufficient for proper description of LSPEs. Statistical post-processing (i.e. downscaling) is required which adds substantial uncertainty to the final result. Ensemble generation of sufficiently
Methodology for locale-scale monitoring for the PROTHEGO project: the Choirokoitia case study
Themistocleous, Kyriacos; Agapiou, Athos; Cuca, Branka; Danezis, Chris; Cigna, Francesca; Margottini, Claudio; Spizzichino, Daniele
2016-10-01
PROTHEGO (PROTection of European Cultural HEritage from GeO-hazards) is a collaborative research project funded in the framework of the Joint Programming Initiative on Cultural Heritage and Global Change (JPICH) - Heritage Plus in 2015-2018 (www.prothego.eu). PROTHEGO aims to make an innovative contribution towards the analysis of geohazards in areas of cultural heritage, and uses novel space technology based on radar interferometry (InSAR) to retrieve information on ground stability and motion in the 400+ UNESCO's World Heritage List monuments and sites of Europe. InSAR can be used to measure micro-movements to identify geo-hazards. In order to verify the InSAR image data, field and close range measurements are necessary. This paper presents the methodology for local-scale monitoring of the Choirokoitia study site in Cyprus, inscribed in the UNESCO World Heritage List, and part of the demonstration sites of PROTHEGO. Various field and remote sensing methods will be exploited for the local-scale monitoring, static GNSS, total station, leveling, laser scanning and UAV and compared with the Persistent Scatterer Interferometry results. The in-situ measurements will be taken systematically in order to document any changes and geo-hazards that affect standing archaeological remains. In addition, ground truth from in-situ visits will provide feedback related to the classification results of urban expansion and land use change maps. Available archival and current optical satellite images will be used to calibrate and identify the level of risk at the Cyprus case study site. The ground based geotechnical monitoring will be compared and validated with InSAR data to evaluate cultural heritage sites deformation trend and to understand its behaviour over the last two decades.
Joulain, C.; Kebe, C.M.F. [Centre International de Formation et de Recherche en Energie Solaire (Senegal); Zambeaux, N. [Agence de l' Environnement et de la Maitrise de l' Energie, Paris (France); Galy, S. [La Fondation Nicola Hulot pour la Nature et l' Homme (France)
2008-04-15
The Centre International de Formation et de Recherche en Energie Solaire (CIFRES) is working to set-up a local branch of manufacturers and maintenance staff for small wind turbines destined for producing electricity in Senegal. The EOLSenegal Project stipulates that a minimum of 95 per cent of local materials must be used to manufacture the wind turbines and that all production and maintenance must occur in Senegal. The purpose of the project is to demonstrate the feasibility of rural electrification projects while determining which technology among wind power, solar photovoltaic or biofuel is best suited for contributing to energy independence and the industrial development of the country through job creation. There are multiple applications for wind energy, including domestic lighting; electrification of community buildings; electrification of district housing; pumping for drinking water; the transformation and conservation of agricultural products; driving force for local crafts such as woodworking, metals, sewing, and hairdressing; and, battery recharging for small food appliances. Wind power and solar energy were touted as being the best solution for meeting the electricity needs of rural populations. The first phase of the EOLSenegal Project involves a feasibility study and site selection followed by phase 2 in which the equipment will be installed. The last industrial phase of the project will be based on the experience gained during the first 2 phases with a market study and financial estimate to draw investors. It was concluded that while small wind turbines may solve some of Senegal's electricity needs, they cannot meet the needs alone and should be used in conjunction with other forms of energy such as solar, thermal, biomass or biogas. 4 figs.
Beth Hewitt
2012-03-01
Full Text Available Objectives – Interviews with library staff and volunteers were conducted to evaluate the use of volunteers in UK public libraries via a case study of the Walter Gardiner Photographic Project, a digitisation project based in Worthing Library, to inform future guidelines on volunteer usage and to make recommendations to existing practice.Methods – Fourteen semi-structured interviews were carried out to explore the perceptions and experiences of both staff and volunteers of the project. All interviews were fully transcribed and then coded to identify emergent themes.Results – Key positives for volunteers were professional training, good time management and organization by staff, the friendliness and approachability of staff, and the informal nature of the volunteering. Enjoyment of the work and forming close relationships with others were key motivating factors. For staff, the completion of work which would have otherwise been impossible was the most positive outcome. Problem areas identified by volunteers were lack of contact time with project staff and feeling isolated from other library staff. For project staff, a lack of professionalism on behalf of some volunteers was the primary negative. Key issues to emerge were the need to strike a balance between formal and informal management, the need for good integration between the volunteers and host organization, and the importance of acknowledging the nature of the voluntary commitment.Conclusions – The project proved overall to be a successful example of using volunteers in public library projects with good examples of volunteer recruitment, training, and management being demonstrated. Areas of conflict that did arise stemmed from differing expectations of levels of service between staff and volunteers. Clarification on these expectations through a written volunteer agreement is advocated for further projects.
D Tomasi
Full Text Available Data-driven functional connectivity density (FCD mapping is being increasingly utilized to assess brain connectomics at rest in the healthy brain and its disruption in neuropsychiatric diseases with the underlying assumption that the spatiotemporal hub distribution is stationary. However, recent studies show that functional connectivity is highly dynamic. Here we study the temporal variability of the local FCD (lFCD at high spatiotemporal resolution (2-mm isotropic; 0.72s using a sliding-window approach and 'resting-state' datasets from 40 healthy subjects collected under the Human Connectome Project. Prominent functional connectivity hubs in visual and posterior parietal cortices had pronounced temporal changes in local FCD. These dynamic patterns in the strength of the lFCD hubs occurred in cortical gray matter with high sensitivity (up to 85% and specificity (> 85% and showed high reproducibility (up to 72% across sessions and high test-retest reliability (ICC(3,1 > 0.5. The temporal changes in lFCD predominantly occurred in medial occipitoparietal regions and were proportional to the strength of the connectivity hubs. The temporal variability of the lFCD was associated with the amplitude of the low frequency fluctuations (ALFF. Pure randomness did not account for the probability distribution of lFCD. Shannon entropy increased in proportion to the strength of the lFCD hubs suggesting high average flow of information per unit of time in the lFCD hubs, particularly in medial occipitoparietal regions. Thus, the higher dynamic range of the lFCD hubs is consistent with their role in the complex orchestration of interacting brain networks.
Mechlenburg, Inger
2008-06-01
The typical dysplastic hip joint is characterised by maldirection of the acetabulum and femoral neck, insufficient coverage of the femoral head focally and globally and erosions of the limbus acetabuli (1). An unknown number of persons with hip dysplasia will suffer from pain in hip or groin, decreased hip function and development of osteoarthritis at a young age. The Bernese periacetabular osteotomy is performed to prevent osteoarthritis in patients with hip dysplasia and has been carried out at Aarhus University Hospital, Denmark since 1996 with more than 500 osteotomies performed. Throughout the years, research and quality improvement of the treatment has taken place and this PhD thesis is part of that process. The aims of this PhD thesis were to evaluate outcome aspects after periacetabular osteotomy in terms of I) estimating the projected loadbearing surface before and after periacetabular osteotomy, II) estimating bone density changes in the acetabulum after periacetabular osteotomy, III) developing a technique to precisely and efficiently estimate the thickness of the articular cartilage in the hip joint and IV) examining the stability of the re-orientated acetabulum after periacetabular osteotomy. In study I, we applied a stereologic method based on 3D computed tomography (CT) to estimate the projected loadbearing surface in six normal hip joints and in six dysplastic hips. The dysplastic hips were CT scanned before and after periacetabular osteotomy. We found that the average area of the projected loadbearing surface of the femoral head preoperatively was 7.4 (range 6.5-8.4) cm2 and postoperatively 11 (9.8-14.3) cm2. The area of the projected loadbearing surface was increased significantly with a mean of 49% (34-70%) postoperatively and thus comparable with the load-bearing surface in the normal control group. Double measurements were performed and the error variance of the mean was estimated to be 1.6%. The effect of overprojection, on the projected
Full-viewpoint 3D Space Object Recognition Based on Kernel Locality Preserving Projections
Meng Gang; Jiang Zhiguo; Liu Zhengyi; Zhang Haopeng; Zhao Danpei
2010-01-01
Space object recognition plays an important role in spatial exploitation and surveillance,followed by two main problems:lacking of data and drastic changes in viewpoints.In this article,firstly,we build a three-dimensional (3D) satellites dataset named BUAA Satellite Image Dataset (BUAA-SID 1.0) to supply data for 3D space object research.Then,based on the dataset,we propose to recognize full-viewpoint 3D space objects based on kemel locality preserving projections (KLPP).To obtain more accurate and separable description of the objects,firstly,we build feature vectors employing moment invariants,Fourier descriptors,region covariance and histogram of oriented gradients.Then,we map the features into kernel space followed by dimensionality reduction using KLPP to obtain the submanifold of the features.At last,k-nearest neighbor (kNN) is used to accomplish the classification.Experimental results show that the proposed approach is more appropriate for space object recognition mainly considering changes of viewpoints.Encouraging recognition rate could be obtained based on images in BUAA-SID 1.0,and the highest recognition result could achieve 95.87%.
Optimization of quantum Hamiltonian evolution: From two projection operators to local Hamiltonians
Patel, Apoorva; Priyadarsini, Anjani
Given a quantum Hamiltonian and its evolution time, the corresponding unitary evolution operator can be constructed in many different ways, corresponding to different trajectories between the desired end-points and different series expansions. A choice among these possibilities can then be made to obtain the best computational complexity and control over errors. It is shown how a construction based on Grover's algorithm scales linearly in time and logarithmically in the error bound, and is exponentially superior in error complexity to the scheme based on the straightforward application of the Lie-Trotter formula. The strategy is then extended first to simulation of any Hamiltonian that is a linear combination of two projection operators, and then to any local efficiently computable Hamiltonian. The key feature is to construct an evolution in terms of the largest possible steps instead of taking small time steps. Reflection operations and Chebyshev expansions are used to efficiently control the total error on the overall evolution, without worrying about discretization errors for individual steps. We also use a digital implementation of quantum states that makes linear algebra operations rather simple to perform.
Aspray, Thomas J; Eirian Jones, E; Whipps, John M; Bending, Gary D
2006-04-01
Mycorrhization helper bacteria, Paenibacillus sp. EJP73 and Burkholderia sp. EJP67, were used to study the importance of bacterial inoculum dose and bacterial derived soluble and volatile metabolites localization for enhancing mycorrhiza formation in the Pinus sylvestris-Lactarius rufus symbiosis, using a laboratory based microcosm. EJP73 and EJP67 produced different responses in relation to the inoculum dose; EJP73 significantly enhanced mycorrhiza formation to the same degree at all doses tested (10(5), 10(7), 10(9) and 10(10) CFU mL(-1)), whereas, EJP67 only stimulated mycorrhiza formation within a narrow range of inoculum densities (10(7) and 10(9) CFU mL(-1)). The importance of soluble bacterial metabolites was assessed by applying spent broth derived from exponential and stationary phase bacterial cultures to microcosms. No spent broth enhanced mycorrhiza formation over the control. As EJP73 produced the helper effect over a wide range of inoculum doses, this bacterium was chosen for further study. Physical separation of EJP73 from the fungal and plant symbiosis partners was carried out, in order to determine the contribution of constitutively produced bacterial volatile metabolites to the mycorrhization helper bacteria effect. When EJP73 was physically separated from the symbiosis, it had a significant negative effect on mycorrhiza formation. These results suggest that close proximity, or indeed cell contact, is required for the helper effect. Therefore, fluorescent in situ hybridization in conjunction with cryosectioning was used to determine the localization of EJP73 in mycorrhizal tissue. The cells were found to occur as rows or clusters ( approximately 10 cells) within the mycorrhizal mantle, both at the root tip and along the length of the mycorrhizal short roots.
NONE
1996-04-01
This best practice guide has been prepared for Local Authorities and private sector developers of municipal solid waste combustion and related projects in the United Kingdom. It covers the following topics: the waste management planning framework within the context of European, national and local policy; strategy for waste management and the tendering process; site specific development, including planning, land use and environmental aspects; public consultation and involvement. Best practice guidelines for each of these areas are summarised in a final chapter. Competitive tendering of Local Authority waste disposal contracts is dealt with in the first of two Annexes. An energy from waste case study is presented in the second Annexe. (UK)
Olsen, Stig Irving; Bonou, Alexandra
2012-01-01
The core of the EU FP7 funded project W2Plastic is development of a magnetic density separation (MDS) of polyolefines in order to improve the sorting efficiency of these polymer types in different waste fractions. As part of the project a life cycle assessment is performed in order to firstly...
Heldeweg, M.A.; Sanders, M.P.T.; Harmsen, M.
2015-01-01
Background An important avenue toward a proper ‘energy transition’ through regional and local projects is for government to collaborate with private sector organizations. In the energy sector, these latter organizations are often already involved in private-private partnerships for collaboration tow
Wubs, Martijn
2015-01-01
Motivated by the ongoing debate about nanophotonic control of Foerster resonance energy transfer (FRET), notably by the local density of optical states (LDOS), we study an analytic model system wherein a pair of ideal dipole emitters - donor and acceptor - exhibit energy transfer in the vicinity of an ideal mirror. The FRET rate is controlled by the mirror up to distances comparable to the donor-acceptor distance, that is, the few-nanometer range. For vanishing distance, we find a complete inhibition or a four-fold enhancement, depending on dipole orientation. For mirror distances on the wavelength scale, where the well-known `Drexhage' modification of the spontaneous-emission rate occurs, the FRET rate is constant. Hence there is no correlation between the Foerster (or total) energy transfer rate and the LDOS. At any distance to the mirror, the total energy transfer between a closely-spaced donor and acceptor is dominated by Foerster transfer, i.e., by the static dipole-dipole interaction that yields the cha...
Lemonias, Jenna J; Thilker, David; Wyder, Ted K; Martin, D Christopher; Seibert, Mark; Treyer, Marie A; Bianchi, Luciana; Heckman, Timothy M; Madore, Barry F; Rich, R Michael
2011-01-01
We present results of the first unbiased search for extended UV (XUV)-disk galaxies undertaken to determine the space density of such galaxies. Our sample contains 561 local (0.001 1.5 x 10^4 s) and SDSS DR7 footprints. We explore modifications to the standard classification scheme for our sample that includes both disk- and bulge-dominated galaxies. Visual classification of each galaxy in the sample reveals an XUV-disk frequency of up to 20% for the most nearby portion of our sample. On average over the entire sample (out to z=0.05) the frequency ranges from a hard limit of 4% to 14%. The GALEX imaging allows us to detect XUV-disks beyond 100 Mpc. The XUV regions around XUV-disk galaxies are consistently bluer than the main bodies. We find a surprisingly high frequency of XUV emission around luminous red (NUV-r > 5) and green valley (3 1.5-4.2 x 10^-3 Mpc^-3. Using the XUV emission as an indicator of recent gas accretion, we estimate that the cold gas accretion rate onto these galaxies is > 1.7-4.6 x 10^-3...
Fitzgerald, James E; Robinson, Robert L; Gasem, Khaled A M
2006-11-07
The simplified local-density (SLD) theory was investigated regarding its ability to provide accurate representations and predictions of high-pressure supercritical adsorption isotherms encountered in coalbed methane (CBM) recovery and CO2 sequestration. Attention was focused on the ability of the SLD theory to predict mixed-gas adsorption solely on the basis of information from pure gas isotherms using a modified Peng-Robinson (PR) equation of state (EOS). An extensive set of high-pressure adsorption measurements was used in this evaluation. These measurements included pure and binary mixture adsorption measurements for several gas compositions up to 14 MPa for Calgon F-400 activated carbon and three water-moistened coals. Also included were ternary measurements for the activated carbon and one coal. For the adsorption of methane, nitrogen, and CO2 on dry activated carbon, the SLD-PR can predict the component mixture adsorption within about 2.2 times the experimental uncertainty on average solely on the basis of pure-component adsorption isotherms. For the adsorption of methane, nitrogen, and CO2 on two of the three wet coals, the SLD-PR model can predict the component adsorption within the experimental uncertainties on average for all feed fractions (nominally molar compositions of 20/80, 40/60, 60/40, and 80/20) of the three binary gas mixture combinations, although predictions for some specific feed fractions are outside of their experimental uncertainties.
Li, Jun-Bao
2012-09-01
This paper presents Gabor filter based optical image recognition using Fractional Power Polynomial model based Common Kernel Discriminant Locality Preserving Projection. This method tends to solve the nonlinear classification problem endured by optical image recognition owing to the complex illumination condition in practical applications, such as face recognition. The first step is to apply Gabor filter to extract desirable textural features characterized by spatial frequency, spatial locality and orientation selectivity to cope with the variations in illumination. In the second step we propose Class-wise Locality Preserving Projection through creating the nearest neighbor graph guided by the class labels for the textural features reduction. Finally we present Common Kernel Discriminant Vector with Fractional Power Polynomial model to reduce the dimensions of the textural features for recognition. For the performance evaluation on optical image recognition, we test the proposed method on a challenging optical image recognition problem, face recognition.
谭明秋; 陶向明
2001-01-01
We report on a self-consistent full-potential linear muffin tin orbital band-structure calculation for the heavy fermion (HF) compound LiV2O4. It is found that a stable local spin density approximation solution for LiV2O4 is lower in total energy than the local density approximation calculation. We speculate that the mechanism responsible for HF properties in LiV2O4 might be of spin fluctuation type and is different from the Kondo mechanism in conventional 4f and 5f HF compounds.
Andrade, Xavier; Alberdi-Rodriguez, Joseba; Strubbe, David A.; Oliveira, Micael J. T.; Nogueira, Fernando; Castro, Alberto; Muguerza, Javier; Arruabarrena, Agustin; Louie, Steven G.; Aspuru-Guzik, Alán; Rubio, Angel; Marques, Miguel A. L.
2012-06-01
Octopus is a general-purpose density-functional theory (DFT) code, with a particular emphasis on the time-dependent version of DFT (TDDFT). In this paper we present the ongoing efforts to achieve the parallelization of octopus. We focus on the real-time variant of TDDFT, where the time-dependent Kohn-Sham equations are directly propagated in time. This approach has great potential for execution in massively parallel systems such as modern supercomputers with thousands of processors and graphics processing units (GPUs). For harvesting the potential of conventional supercomputers, the main strategy is a multi-level parallelization scheme that combines the inherent scalability of real-time TDDFT with a real-space grid domain-partitioning approach. A scalable Poisson solver is critical for the efficiency of this scheme. For GPUs, we show how using blocks of Kohn-Sham states provides the required level of data parallelism and that this strategy is also applicable for code optimization on standard processors. Our results show that real-time TDDFT, as implemented in octopus, can be the method of choice for studying the excited states of large molecular systems in modern parallel architectures.
Building a Universal Nuclear Energy Density Functional (UNEDF). SciDAC-2 Project
Vary, James P. [Iowa State University, Ames, IA (United States); Carlson, Joe; Furnstahl, Dick; Horoi, Mihai; Lusk, Rusty; Nazarewicz, Witek; Ng, Esmond; Thompson, Ian
2012-09-29
An understanding of the properties of atomic nuclei is crucial for a complete nuclear theory, for element formation, for properties of stars, and for present and future energy and defense applications. During the period of Dec. 1 2006 – Jun. 30, 2012, the UNEDF collaboration carried out a comprehensive study of all nuclei, based on the most accurate knowledge of the strong nuclear interaction, the most reliable theoretical approaches, the most advanced algorithms, and extensive computational resources, with a view towards scaling to the petaflop platforms and beyond. Until recently such an undertaking was hard to imagine, and even at the present time such an ambitious endeavor would be far beyond what a single researcher or a traditional research group could carry out. The UNEDF SciDAC project has developed several key computational codes and algorithms for reaching the goal of solving the nuclear quantum many-body problem throughout the chart of nuclei. Without such developments, scientific progress would not be possible. In addition the UNEDF SciDAC successfully applied these developments to solve many forefront research problems.
Otabe, E.S., E-mail: otabe@cse.kyutech.ac.j [Faculty of Computer Science and Systems Engineering, Kyushu Institute of Technology, 680-4 Kawazu, Iizuka, Fukuoka 820-8502 (Japan); Kiuchi, M.; Kawai, S. [Faculty of Computer Science and Systems Engineering, Kyushu Institute of Technology, 680-4 Kawazu, Iizuka, Fukuoka 820-8502 (Japan); Morita, Y.; Ge, J.; Ni, B. [Department of Life, Environment and Material Science, Fukuoka Institute of Technology, 3-30-1 Wajirohigashi, Higashi-ku, Fukuoka 811-0295 (Japan); Gao, Z.; Wang, L.; Qi, Y.; Zhang, X.; Ma, Y. [Key Laboratory of Applied Superconductivity, Institute of Electrical Engineering, Chinese Academy of Sciences, P.O. Box 2703, Beijing 100190 (China)
2009-11-01
The critical current densities of polycrystalline bulk SmFeAsO{sub 1-x}F{sub x} prepared by the powder-in-tube (PIT) method and by a conventional solid-state reaction were investigated using the remnant magnetic moment method and Campbell's method. Two types of shielding current, corresponding to global and local critical current densities J{sub c} were observed using both measurement methods. The global and local J{sub c} were on the order of 10{sup 7} A/m{sup 2} and 10{sup 10} A/m{sup 2} at 5 K, respectively. The local J{sub c} decreased slightly with increasing magnetic field. The global J{sub c} was independent of the preparation method, while the local J{sub c} was larger for samples prepared by PIT than for those prepared by solid-state reaction.
Yazan M. Alomari
2015-01-01
Full Text Available Analysis of whole-slide tissue for digital pathology images has been clinically approved to provide a second opinion to pathologists. Localization of focus points from Ki-67-stained histopathology whole-slide tissue microscopic images is considered the first step in the process of proliferation rate estimation. Pathologists use eye pooling or eagle-view techniques to localize the highly stained cell-concentrated regions from the whole slide under microscope, which is called focus-point regions. This procedure leads to a high variety of interpersonal observations and time consuming, tedious work and causes inaccurate findings. The localization of focus-point regions can be addressed as a clustering problem. This paper aims to automate the localization of focus-point regions from whole-slide images using the random patch probabilistic density method. Unlike other clustering methods, random patch probabilistic density method can adaptively localize focus-point regions without predetermining the number of clusters. The proposed method was compared with the k-means and fuzzy c-means clustering methods. Our proposed method achieves a good performance, when the results were evaluated by three expert pathologists. The proposed method achieves an average false-positive rate of 0.84% for the focus-point region localization error. Moreover, regarding RPPD used to localize tissue from whole-slide images, 228 whole-slide images have been tested; 97.3% localization accuracy was achieved.
Alomari, Yazan M; Sheikh Abdullah, Siti Norul Huda; MdZin, Reena Rahayu; Omar, Khairuddin
2015-01-01
Analysis of whole-slide tissue for digital pathology images has been clinically approved to provide a second opinion to pathologists. Localization of focus points from Ki-67-stained histopathology whole-slide tissue microscopic images is considered the first step in the process of proliferation rate estimation. Pathologists use eye pooling or eagle-view techniques to localize the highly stained cell-concentrated regions from the whole slide under microscope, which is called focus-point regions. This procedure leads to a high variety of interpersonal observations and time consuming, tedious work and causes inaccurate findings. The localization of focus-point regions can be addressed as a clustering problem. This paper aims to automate the localization of focus-point regions from whole-slide images using the random patch probabilistic density method. Unlike other clustering methods, random patch probabilistic density method can adaptively localize focus-point regions without predetermining the number of clusters. The proposed method was compared with the k-means and fuzzy c-means clustering methods. Our proposed method achieves a good performance, when the results were evaluated by three expert pathologists. The proposed method achieves an average false-positive rate of 0.84% for the focus-point region localization error. Moreover, regarding RPPD used to localize tissue from whole-slide images, 228 whole-slide images have been tested; 97.3% localization accuracy was achieved.
Sedee, A.G.J.; Swart, R.J.; Pater, de F.; Goosen, H.; Pijnappels, M.H.J.; Vellinga, P.
2014-01-01
Since the turn of the century, an increasing number of local and regional authorities in Europe started making their city or region resilient to climate change, or ‘climate-proof’. Publications about the actual experiences with implementing these adaptation policies are as yet anecdotal, determined
Saldin, D K; Shneerson, V L; Starodub, D; Spence, J C H
2010-01-01
Diffraction from the individual molecules of a molecular beam, aligned parallel to a single axis by a strong electric field or other means, has been proposed as a means of structure determination of individual molecules. As in fiber diffraction, all the information extractable is contained in a diffraction pattern from incidence of the diffracting beam normal to the molecular alignment axis. The limited size of the object results in continuous diffraction patterns characterized by neither Bragg spots nor layer lines. Equations relating the scattered amplitudes to the molecular electron density may be conveniently formulated in terms of cylindrical harmonics. For simulated diffraction patterns from short C nanotubes aligned along their axes, iterative solution of the equation for the zeroth-order cylindrical harmonic and its inverse with appropriate constraints in real and reciprocal space enables the phasing of the measured amplitudes, and hence a reconstruction of the azimuthal projection of the molecule.
Smeyers, Y.G.; Delgado-Barrio, G.
1976-05-01
The half-projected Hartree--Fock function for singlet states (HPHF) is analyzed in terms of natural electronic configurations. For this purpose the HPHF spinless density matrix and its natural orbitals are first deduced. It is found that the HPHF function does not contain any contribution from odd-times excited configurations. It is seen in addition, in the case of the singlet ground states, this function is approximately equivalent to two closed-shell configurations, although the nature of the excited one depends on the nuclear geometry. An example is given in the case of the LiH ground state. Finally, the application of this model for studying systems of more than two atoms is criticized.
Schroer, Bert
2006-04-15
The holographic encoding is generalized to subalgebras of QFT localized in double cones. It is shown that as a result of this radically different spacetime encoding the modular group acts geometrically on the holographic image. As a result we obtain a formula for localization entropy which is identical to the previously derived formula for the wedge-localized subalgebra. The symmetry group in the holographic encoding turns out to be the Bondi-Metzner-Sachs group. (author)
Akasaki, Kenji; Shiotsu, Keiko; Michihara, Akihiro; Ide, Norie; Wada, Ikuo
2014-07-01
Lysosome-associated membrane protein-1 (LAMP-1) is a type I transmembrane protein with a short cytoplasmic tail that possesses a lysosome-targeting signal of GYQTI(382)-COOH. Wild-type (WT)-LAMP-1 was exclusively localized in high density lysosomes, and efficiency of LAMP-1's transport to lysosomes depends on its COOH-terminal amino acid residue. Among many different COOH-terminal amino acid substitution mutants of LAMP-1, a leucine-substituted mutant (I382L) displays the most efficient targeting to late endosomes and lysosomes [Akasaki et al. (2010) J. Biochem. 148: , 669-679]. In this study, we generated two human hepatoma cell lines (HepG2 cell lines) that stably express WT-LAMP-1 and I382L, and compared their intracellular distributions. The subcellular fractionation study using Percoll density gradient centrifugation revealed that WT-LAMP-1 had preferential localization in the high density secondary lysosomes where endogenous human LAMP-1 was enriched. In contrast, a major portion of I382L was located in a low density fraction. The low density fraction also contained approximately 80% of endogenous human LAMP-1 and significant amounts of endogenous β-glucuronidase and LAMP-2, which probably represents occurrence of low density lysosomes in the I382L-expressing cells. Double immunofluorescence microscopic analyses distinguished I382L-containing intracellular vesicles from endogenous LAMP-1-containing lysosomes and early endosomes. Altogether, constitutive expression of I382L causes its aberrant intracellular localization and generation of low density lysosomes, indicating that the COOH-terminal isoleucine is critical for normal localization of LAMP-1 in the dense lysosomes.
Michal Kudláček
2012-03-01
Full Text Available BACKGROUND: Inter-sectoral collaboration and social equity for all inhabitants of European Union in the sphere of approaching infrastructure for leisure-time physical activity (PA were the main reasons for implementation and financing of international project IMPALA. The project was divided into three stages. AIM: The aim of presented part of IMPALA project is to assess national policy (legislation and regulation of the development of local infrastructures for leisure-time PA. METHODS: According to the requirements established by project coordinator we carried out structured qualitative interviews with experts and policy makers on diﬀerent decision-making levels. Further, the invited representatives of end users participated in focus group meeting. Also various available sources and documents were used for detailed analysis. RESULTS: Qualitative interviews provided information, which includes the issue of sports facilities in terms of national level and which documents deal with them. At the regional level whole sphere of infrastructures for leisure-time PA is organized by local and regional governments (municipalities. Participants in the focus group meeting shared with others their own positive and negative experiences with the management of infrastructures and finally made some concrete recommendations. The issue of mechanisms for infrastructure development devotes firstly to the relevant conceptual documents at national and regional level, and then describes specific examples of Olomouc and the Olomouc region in terms of planning, financing, construction and management of infrastructures for leisure-time PA. CONCLUSION: In this part of the project we found out that in the Czech Republic there is no specific national political strategy for the development of infrastructures for leisure-time PA. Development is done primarily at the local level. The biggest problem faced by end-operators is the lack of financial resources and outstanding
Yasumi Uchida
Full Text Available OBJECTIVES: Oxidized low-density lipoprotein (oxLDL plays a key role in the formation of atherosclerotic plaques. However, its localization in human coronary arterial wall is not well understood. The present study was performed to visualize deposition sites and patterns of native oxLDL and their relation to plaque morphology in human coronary artery. METHODS: Evans blue dye (EB elicits a violet fluorescence by excitation at 345-nm and emission at 420-nm, and a reddish-brown fluorescence by excitation at 470-nm and emission at 515-nm characteristic of oxLDL only. Therefore, native oxLDL in excised human coronary artery were investigated by color fluorescent microscopy (CFM using EB as a biomarker. RESULTS: (1 By luminal surface scan with CFM, the % incidence of oxLDL in 38 normal segments, 41 white plaques and 32 yellow plaques that were classified by conventional angioscopy, was respectively 26, 44 and 94, indicating significantly (p<0.05 higher incidence in the latter than the former two groups. Distribution pattern was classified as patchy, diffuse and web-like. Web-like pattern was observed only in yellow plaques with necrotic core. (2 By transected surface scan, oxLDL deposited within superficial layer in normal segments and diffusely within both superficial and deep layers in white and yellow plaques. In yellow plaques with necrotic core, oxLDL deposited not only in the marginal zone of the necrotic core but also in the fibrous cap. CONCLUSION: Taken into consideration of the well-known process of coronary plaque growth, the results suggest that oxLDL begins to deposit in human coronary artery wall before plaque formation and increasingly deposits with plaque growth, exhibiting different deposition sites and patterns depending on morphological changes.
Bröker, Sebastian; Kück, Dennis; Timmer, Alexander; Lauermann, Iver; Ümsür, Bünyamin; Greiner, Dieter; Kaufmann, Christian A; Mönig, Harry
2015-06-17
The unusual defect chemistry of polycrystalline Cu(In,Ga)Se2 (CIGSe) thin films is a main issue for a profound understanding of recombination losses in chalcopyrite thin-film solar cells. Especially, impurity-driven passivation of electronic levels due to point defects segregating at the surface and at grain boundaries is extensively debated. By combining current imaging tunneling spectroscopy with photoelectron spectroscopy, the local defect-level density and unusual optoelectronic grain-boundary properties of this material are correlated with the macroscopic energy levels and surface composition. Vacuum annealing of different CIGSe materials provides evidence that Na diffusion from the glass substrate does not affect the surface defect passivation or grain-boundary properties of standard Cu-poor materials. Furthermore, we find no major impact on the observed thermally activated dipole compensation or the accompanying change in surface band bending (up to 0.6 eV) due to Na. In contrast, Cu-rich CIGSe shows an opposing surface defect chemistry with only minor heat-induced band bending. Our results lead to a comprehensive picture, where the highly desirable type inversion at the p/n interface in standard chalcopyrite thin-film solar cells is dominated by band bending within the CIGSe absorber rather than the result of Na impurities or an n-type defect phase segregating at the interface. This is in accordance with recent studies suggesting a surface reconstruction as the origin for Cu depletion and band-gap widening at the surface of chalcopyrite thin films.
Kafaie Shirmanesh, Ghazaleh; Sokhoyan, Ruzan; Han, Seunghoon; Atwater, Harry A.
2016-09-01
During recent years, advances in the design of arrays of subwavelength optical elements with special electromagnetic properties have enabled quasi two-dimensional structures that control and manipulate electromagnetic phase, amplitude and polarization. Active control of the response of metasurfaces is possible using transparent conducting oxides such as Indium Tin Oxide (ITO) as a tunable active material [1]. Changing the complex permittivity of ITO by applying a voltage yields modulation of reflected wave phase and amplitude. To achieve this, we designed subwavelength antenna arrays consisting of a gold back reflector and gold fishbone antennas. Planar dielectric layers containing a gate tunable layer of ITO are sandwiched between the back reflector and the antenna. The obtained structure shows resonance around 1.5 µm. As a result, based on the 1.54 µm photoluminescence emission of Er doped Al2O3 films, we embedded trivalent erbium ions as quantum emitters inside an alumina host within the metasurface in order to enhance the local density of optical states (LDOS). Simulations indicate the designed structure shows a significant LDOS enhancement (of order of hundreds). By applying a bias between the antenna and the ITO layer, across an HfO2 gate dielectric, we can control the permittivity of ITO and hence dynamically modulate the decay rate of quantum emitters embedded within the structure. In this way, we can achieve LDOS enhancement modulation of about 325%. 1. Y. W Huang, H. W. H. Lee, R. Sokhoyan, R. Pala, K. Thyagarajan, S. Han, D. P. Tsai, H. A. Atwater, "Gate-tunable conducting oxide metasurfaces". (arXiv:1511.09380).
Lācis, Uǧis; Bagheri, Shervin
2015-01-01
Dispersion of low-density rigid particles with complex geometries is ubiquitous in both natural and industrial environments. We show that while explicit methods for coupling the incompressible Navier-Stokes equations and Newton's equations of motion are often sufficient to solve for the motion of cylindrical particles with low density ratios, for more complex particles - such as a body with a protrusion - they become unstable. We present an implicit formulation of the coupling between rigid body dynamics and fluid dynamics within the framework of the immersed boundary projection method. Similar to previous work on this method, the resulting matrix equation in the present approach is solved using a block-LU decomposition. Each step of the block-LU decomposition is modified to incorporate the rigid body dynamics. We show that our method achieves second-order accuracy in space and first-order in time (third-order for practical settings), only with a small additional computational cost to the original method. Our...
Staljanssens, Willeke; Strobbe, Gregor; Van Holen, Roel; Birot, Gwenael; Michel, Christophe; Seeck, Margitta; Vulliémoz, Serge; van Mierlo, Pieter
2015-01-01
Functional connectivity analysis of ictal intracranial EEG (icEEG) recordings can help with seizure-onset zone (SOZ) localization in patients with focal epilepsy1. However, it would be of high clinical value to be able to localize the SOZ based on non-invasive ictal EEG recordings to better target or avoid icEEG and improve surgical outcome. In this work, we propose an approach to localize the SOZ based on non-invasive ictal high- density EEG (hd-EEG) recordings. We considered retrospectiv...
Markus G Stetter
Full Text Available Plant root hairs increase the root surface to enhance the uptake of sparingly soluble and immobile nutrients, such as the essential nutrient phosphorus, from the soil. Here, root hair traits and the response to scarce local phosphorus concentration were studied in 166 accessions of Arabidopsis thaliana using split plates. Root hair density and length were correlated, but highly variable among accessions. Surprisingly, the well-known increase in root hair density under low phosphorus was mostly restricted to genotypes that had less and shorter root hairs under P sufficient conditions. By contrast, several accessions with dense and long root hairs even had lower hair density or shorter hairs in local scarce phosphorus. Furthermore, accessions with whole-genome duplications developed more dense but phosphorus-insensitive root hairs. The impact of genome duplication on root hair density was confirmed by comparing tetraploid accessions with their diploid ancestors. Genome-wide association mapping identified candidate genes potentially involved in root hair responses tp scarce local phosphate. Knock-out mutants in identified candidate genes (CYR1, At1g32360 and RLP48 were isolated and differences in root hair traits in the mutants were confirmed. The large diversity in root hair traits among accessions and the diverse response when local phosphorus is scarce is a rich resource for further functional analyses.
Sperber, Bram L. H. M.; Schols, Henk A.; Stuart, Martien A. Cohen; Norde, Willem; Voragen, Alphons G. J.
2009-01-01
The complex formation between beta-lactoglobulin (beta-lg) and pectin is studied using pectins with different physicochemical characteristics. Pectin allows for the control of both the overall charge by degree of methyl-esterification as well as local charge density by the degree of blockiness. Vary
Eugênia Rosa Cabral
2015-04-01
Full Text Available The study analyzes the actions of social responsibility expressed by the Environmental and Heritage Education Project (PEAP, which has been implemented in the Boa Vista and Moura communities, both located in Oriximiná, State of Pará. This project purported to promote the rescue and preservation of environmental and cultural heritage in local communities, developed in a partnership between the Museu Paraense Emilio Goeldi (Emilio Goeldi [a painter] Pará Museum] (MPEG, the private company Mineração Rio do Norte (Rio do Norte Mining (MRN and representatives of local communities. This study examines to what extent the actions of PEAP can be considered drivers of sustainable local development. To answer this question, the research focused on the implementation of the PEAP actions and their effects on the two communities under study. Specifically, we sought to identify potential social, cultural and economic impacts of the actions of PEAP on both communities, and to identify future expectations of social subjects involved. This is a case study that follows a qualitative approach. The data collected in documents and interviews were analyzed according to the concepts of sustainable local development, corporate social responsibility and tri-sector partnership. The study identified that the actions taken by the PEAP result of management practices and participatory social planning, and reflecting the redemption of traditional practices, socialization of information and income generation, which together contribute to sustainable local development.
Zhang, Gaigong; Hu, Wei; Yang, Chao; Pask, John E
2015-01-01
Recently, we have proposed the adaptive local basis set for electronic structure calculations based on Kohn-Sham density functional theory in a pseudopotential framework. The adaptive local basis set is efficient and systematically improvable for total energy calculations. In this paper, we present the calculation of atomic forces, which can be used for a range of applications such as geometry optimization and molecular dynamics simulation. We demonstrate that, under mild assumptions, the computation of atomic forces can scale nearly linearly with the number of atoms in the system using the adaptive local basis set. We quantify the accuracy of the Hellmann-Feynman forces for a range of physical systems, benchmarked against converged planewave calculations, and find that the adaptive local basis set is efficient for both force and energy calculations, requiring at most a few tens of basis functions per atom to attain accuracy required in practice. Since the adaptive local basis set has implicit dependence on a...
Noel, Stéphanie; Billo Bah, Boubacar
2009-01-01
Pollution of water resources (surface waters and ground waters) by pesticide uses is one of the key point of the European policy with the implementation of the Water Frame Work Directive (2000/60/EC) and the thematic Strategy on the Sustainable use of pesticides. According to this legislation, the Member States must initiate measures to limit environmental and toxicological effects caused by pesticide uses. The Agricultural Research Centre of Wallonia (CRA-W) emphasized the need of a tool for spatial risk analysis and develOPs it within the framework of PESTEAUX project. The originality of the approach proposed by the CRA-W is to generate maps to identify the risk of pollution at locale scale (agricultural parcel). The risk will be assessed according to the study of different factors, grouped under 3 data's layers: polluting pressure, vulnerability of the physical environment (soil) and meteorological data. This approach is directly based on the risk's definition which takes into account the polluting pressure, linked to the human activities, and the vulnerability of the soil, defined by factors of physical environment which characterize the water flow in the parcel. Moreover, meteorological data influence the intensity and likelihood flow of water, and indirectly pesticide by leaching or runoff. The PESTEAUX's approach to study the pollution is based on the model "source-vector-target". The source is the polluting pressure, in other words, the pesticides which could reach the targets. The main vector is the water which vehicles the pesticide on and trough the soil until the target which are the surface waters or ground waters. In this paper we introduce the factors contributing to the polluting pressure. These factors are linking to the human activities and more precisely, to the pesticide uses. The factors considered have an influence on pesticide's transport by water (in its solid state or in dissolved state by leaching, run-off, or erosion) but also on a set of
Sustainability and Local Knowledge: The Case of the Brazilian ESP Project 1980-2005
Holmes, John; Celani, Maria Antonieta A.
2006-01-01
On the occasion of the 25th anniversary of the Brazilian ESP Project, this paper discusses why it has been able to sustain itself and develop over such a long period. The analysis focuses on two main areas of decision-making which led to this success: the structure of the project itself and the ESP methodology which was developed. Comparing the…
The Local Brewery: A Project for Use in Differential Equations Courses
Starling, James K.; Povich, Timothy J.; Findlay, Michael
2016-01-01
We describe a modeling project designed for an ordinary differential equations (ODEs) course using first-order and systems of first-order differential equations to model the fermentation process in beer. The project aims to expose the students to the modeling process by creating and solving a mathematical model and effectively communicating their…
Ribeiro, M., E-mail: ribeiro.jr@oorbit.com.br [Office of Operational Research for Business Intelligence and Technology, Principal Office, Buffalo, Wyoming 82834 (United States)
2015-06-21
Ab initio calculations of hydrogen-passivated Si nanowires were performed using density functional theory within LDA-1/2, to account for the excited states properties. A range of diameters was calculated to draw conclusions about the ability of the method to correctly describe the main trends of bandgap, quantum confinement, and self-energy corrections versus the diameter of the nanowire. Bandgaps are predicted with excellent accuracy if compared with other theoretical results like GW, and with the experiment as well, but with a low computational cost.
Regional and Local Geoid Undulations for Computing Orthometric Heights from GPS Measurements Project
National Aeronautics and Space Administration — This proposal explains procedures of using regional and local geoid undulations to improve and convert the global positioning system (GPS) elevations (ellipsoidal...
Fournais, Søren; Hoffmann-Ostenhof, Maria; Hoffmann-Ostenhof, Thomas
2008-01-01
We review recent results by the authors on the regularity of molecular eigenfunctions ψ and their corresponding one-electron densities ρ, as well as of the spherically averaged one-electron atomic density ρ. Furthermore, we prove an exponentially decreasing lower bound for ρ in the case when the ...
Qiao Yingjuan
2008-01-01
Full Text Available Abstract Background DNA methylation based techniques are important tools in both clinical diagnostics and therapeutics. But most of these methods only analyze a few CpG sites in a target region. Indeed, difference of site-specific methylation may also lead to a change of methylation density in many cases, and it has been found that the density of methylation is more important than methylation of single CpG site for gene silencing. Results We have developed a novel approach for quantitative analysis of CpG methylation density on the basis of microarray-based hybridization and incorporation of Cy5-dCTP into the Cy3 labeled target DNA by using Taq DNA Polymerase on microarray. The quantification is achieved by measuring Cy5/Cy3 signal ratio which is proportional to methylation density. This methylation-sensitive technique, termed RMEAM (regional methylation elongation assay on microarray, provides several advantages over existing methods used for methylation analysis. It can determine an exact methylation density of the given region, and has potential of high throughput. We demonstrate a use of this method in determining the methylation density of the promoter region of the tumor-related gene MLH1, TERT and MGMT in colorectal carcinoma patients. Conclusion This technique allows for quantitative analysis of regional methylation density, which is the representative of all allelic methylation patterns in the sample. The results show that this technique has the characteristics of simplicity, rapidness, specificity and high-throughput.
van der Sluijs, Jeroen; Wardekker, Arjan
2015-01-01
In order to enable anticipation and proactive adaptation, local decision makers increasingly seek detailed foresight about regional and local impacts of climate change. To this end, the Netherlands Models and Data-Centre implemented a pilot chain of sequentially linked models to project local climat
Raven, Rob P. J. M.; Heiskanen, Eva; Lovio, Raimo; Hodson, Mike; Brohmann, Bettina
2008-01-01
This article examines how local experiments and negotiation processes contribute to social and field-level learning. The analysis is framed within the niche development literature, which offers a framework for analyzing the relation between projects in local contexts and the transfer of local experiences into generally applicable rules. The…
A study of local government HIV/AIDS projects in South Africa
Chantel
Keywords: local government, HIV/AIDS, home/community-based care, Department of Social Development. RÉSUMÉ ... (Educational & Training Unit, 2001;Whiteside &. Sunter, 2000 ..... tendency among many companies and private business.
Lin, Yue; Li, Cheng
2012-01-01
Nearest neighbors search is a fundamental problem in various research fields like machine learning, data mining and pattern recognition. Recently, hashing-based approaches, e.g., Locality Sensitive Hashing (LSH), are proved to be effective for scalable high dimensional nearest neighbors search. Many hashing algorithms found their theoretic root in random projection. Since these algorithms generate the hash tables (projections) randomly, a large number of hash tables (i.e., long codewords) are required in order to achieve both high precision and recall. To address this limitation, we propose a novel hashing algorithm called {\\em Density Sensitive Hashing} (DSH) in this paper. DSH can be regarded as an extension of LSH. By exploring the geometric structure of the data, DSH avoids the purely random projections selection and uses those projective functions which best agree with the distribution of the data. Extensive experimental results on real-world data sets have shown that the proposed method achieves better ...
Model-based sphere localization (MBSL) in x-ray projections
Sawall, Stefan; Maier, Joscha; Leinweber, Carsten; Funck, Carsten; Kuntz, Jan; Kachelrieß, Marc
2017-08-01
The detection of spherical markers in x-ray projections is an important task in a variety of applications, e.g. geometric calibration and detector distortion correction. Therein, the projection of the sphere center on the detector is of particular interest as the used spherical beads are no ideal point-like objects. Only few methods have been proposed to estimate this respective position on the detector with sufficient accuracy and surrogate positions, e.g. the center of gravity, are used, impairing the results of subsequent algorithms. We propose to estimate the projection of the sphere center on the detector using a simulation-based method matching an artificial projection to the actual measurement. The proposed algorithm intrinsically corrects for all polychromatic effects included in the measurement and absent in the simulation by a polynomial which is estimated simultaneously. Furthermore, neither the acquisition geometry nor any object properties besides the fact that the object is of spherical shape need to be known to find the center of the bead. It is shown by simulations that the algorithm estimates the center projection with an error of less than 1% of the detector pixel size in case of realistic noise levels and that the method is robust to the sphere material, sphere size, and acquisition parameters. A comparison to three reference methods using simulations and measurements indicates that the proposed method is an order of magnitude more accurate compared to these algorithms. The proposed method is an accurate algorithm to estimate the center of spherical markers in CT projections in the presence of polychromatic effects and noise.
Eskandari, M.; Yadegari-Dehnavi, M. R.; Zarei-Hanzaki, A.; Mohtadi-Bonab, M. A.; Basu, R.; Szpunar, J. A.
2015-04-01
The effect of deformation temperature on the strain localization has been evaluated by an adapted digital image correlation (DIC) technique during tensile deformation. The progress of strain localization was traced by the corresponding strain maps. The electron backscatter diffraction analysis and tint etching technique were utilized to determine the impact of martensitic transformation and deformation twinning on the strain localization in both elastic and plastic regimes. In elastic regime the narrow strain bands which are aligned perpendicular to the tension direction were observed in temperature range of 25 to 180 °C due to the stress-assisted epsilon martensite. The strain bands were disappeared by increasing the temperature to 300 °C and reappeared at 400 °C due to the stress-assisted deformation twinning. In plastic regime strain localization continued at 25 °C and 180 °C due to the strain-induced alfa-martensite and deformation twinning, respectively. The intensity of plastic strain localization was increased by increasing the strain due to the enhancement of martensite and twin volume fraction. The plastic strain showed more homogeneity at 300 °C due to the lack of both strain-induced martensite and deformation twinning. Effect of deformation mechanism by changing temperature on strain localization is investigated by digital image correlation. EBSD technique is served to validate deformation mechanism as well as microstructural evolution. Strain induced martensite as well as deformation twinning is activated in the present steel affecting strain localization.
Anshu, Anurag; Arad, Itai; Jain, Aditya
2016-11-01
Two-dimensional tensor networks such as projected entangled pairs states (PEPS) are generally hard to contract. This is arguably the main reason why variational tensor network methods in two dimensions are still not as successful as in one dimension. However, this is not necessarily the case if the tensor network represents a gapped ground state of a local Hamiltonian; such states are subject to many constraints and contain much more structure. In this paper, we introduce an approach for approximating the expectation value of a local observable in ground states of local Hamiltonians that are represented by PEPS tensor networks. Instead of contracting the full tensor network, we try to estimate the expectation value using only a local patch of the tensor network around the observable. Surprisingly, we demonstrate that this is often easier to do when the system is frustrated. In such case, the spanning vectors of the local patch are subject to nontrivial constraints that can be utilized via a semidefinite program to calculate rigorous lower and upper bounds on the expectation value. We test our approach in one-dimensional systems, where we show how the expectation value can be calculated up to at least 3 or 4 digits of precision, even when the patch radius is smaller than the correlation length.
Hoeke, Ron; Hemer, Mark; Contardo, Stephanie; Symonds, Graham; Mcinnes, Kathy
2016-04-01
As demonstrated by the Australian Wave Energy Atlas (AWavEA), the southern and western margins of the country possess considerable wave energy resources. The Australia Government has made notable investments in pre-commercial wave energy developments in these areas, however little is known about how this technology may impact local wave climate and subsequently affect neighbouring coastal environments, e.g. altering sediment transport, causing shoreline erosion or accretion. In this study, a network of in-situ wave measurement devices have been deployed surrounding the 3 wave energy converters of the Carnegie Wave Energy Limited's Perth Wave Energy Project. This data is being used to develop, calibrate and validate numerical simulations of the project site. Early stage results will be presented and potential simulation strategies for scaling-up the findings to larger arrays of wave energy converters will be discussed. The intended project outcomes are to establish zones of impact defined in terms of changes in local wave energy spectra and to initiate best practice guidelines for the establishment of wave energy conversion sites.
Development of Local Supply Chain : The Missing Link for Concentrated Solar Power Projects in India
World Bank
2013-01-01
Amid the success of Solar Photovoltaic (PV) projects in India, Concentrated Solar Power (CSP) technology also provides a compelling case for support by the government as among solar technologies; CSP is the only techno-economically viable option at present that provides a storage option for dispatchable and dependable solar energy. Furthermore, the conversion of solar to steam is a relativ...
Hogeun Park
2017-03-01
Full Text Available The purpose of this paper is to investigate the connection between local development projects and the residents’ social capital in Bohol, The Philippines. From this perspective, we hypothesized that social behaviors of local farmers are influenced by the availability of canal irrigation due to the collective water management required in irrigated societies. By combining the results of the ultimatum game (UG with a household survey on 245 villagers in Bohol, this paper (1 measures the degree of social capital at the individual level and (2 quantifies the effects of irrigation on social capital by controlling household as well as individual characteristics. Moreover, we employed a Spatial Autoregressive model to explore the spatial effects and social contexts of farmers’ behavioral patterns. The empirical results show that the level of measured social behavior is strongly associated with access to community irrigation water and asset holdings. Additionally, increased physical distance between residents leads to a decrease in social capital, or interdependency, among them. The results suggest that community engagement (e.g., irrigation management committee and turnout service association with local development projects would not only improve agricultural productivity but also enhance social relationships among farmers, highlighting its importance.
Kerrigan, Deanna; Kennedy, Caitlin E; Cheng, Alison Surdo; Sandison, Sarah J; Fonner, Virginia A; Holtgrave, David R; Brahmbhatt, Heena
2015-01-01
In the field of HIV prevention, there is renewed interest in operations research (OR) within an implementation science framework. The ultimate goal of such studies is to generate new knowledge that can inform local programmes and policies, thus improving access, quality, efficiency and effectiveness. Using four case studies from the USAID-funded Research to Prevention (R2P) project, we highlight the strategic use of OR and the impact it can have on shaping the focus and content of HIV prevention programming across geographic and epidemic settings and populations. These case studies, which include experiences from several sub-Saharan African countries and the Caribbean, emphasize four unique ways that R2P projects utilized OR to stimulate change in a given context, including: (1) translating findings from clinical trials to real-world settings; (2) adapting promising structural interventions to a new context; (3) tailoring effective interventions to underserved populations; and (4) prioritizing key populations within a national response to HIV. Carefully crafted OR can bridge the common gap that exists between research-generated knowledge and field-based practice, lead to substantial, real-world changes in national policies and programmes, and strengthen local organizations and the use of data to be more responsive to a given topic or population, ultimately supporting a locally tailored HIV response.
Agyare, Benjamin; Riseborough, Peter
2017-01-01
Intrinsically Localized Modes (ILMs) have purportedly been observed in NaI but only for wave-vectors, q at the corner of the 3-D Brillouin Zone. It has been suggested that, for high-symmetry q vectors, several van Hove singularities may converge at one frequency producing a large peak in the two-phonon density of state and giving rise to ILMs with these q values. We fit the experimentally determined acoustic and the optic phonon modes using a nearest neighbor and a next-nearest neighbor force constant. We find that the two-phonon density of states, for fixed q exhibits non-divergent van Hove singularities. The frequencies of these features are found to vary as q is varied. We intend to search for q values at which the two-phonon density of states is enhanced and then examine whether the anharmonic interactions can bind the two-phonon excitations to produce a quantized ILM.
Jug, Giancarlo; Ziegler, Klaus
1997-10-01
We present a calculation for the second moment of the local density of states in a model of a two-dimensional quantum dot array near the quantum Hall transition. The quantum dot array model is a realistic adaptation of the lattice model for the quantum Hall transition in the two-dimensional electron gas in an external magnetic field proposed by Ludwig, Fisher, Shankar, and Grinstein. We make use of a Dirac fermion representation for the Green's functions in the presence of fluctuations for the quantum dot energy levels. A saddle-point approximation yields nonperturbative results for the first and second moments of the local density of states, showing interesting fluctuation behavior near the quantum Hall transition. To our knowledge we discuss here one of the first analytic characterizations of chaotic behavior for a two-dimensional mesoscopic structure. The connection with possible experimental investigations of the local density of states in the quantum dot array structures (by means of NMR Knight-shift or single-electron-tunneling techniques) and our work is also established.
Nazemi, S Majid; Amini, Morteza; Kontulainen, Saija A; Milner, Jaques S; Holdsworth, David W; Masri, Bassam A; Wilson, David R; Johnston, James D
2017-01-01
Quantitative computed tomography based subject-specific finite element modeling has potential to clarify the role of subchondral bone alterations in knee osteoarthritis initiation, progression, and pain. However, it is unclear what density-modulus equation(s) should be applied with subchondral cortical and subchondral trabecular bone when constructing finite element models of the tibia. Using a novel approach applying neural networks, optimization, and back-calculation against in situ experimental testing results, the objective of this study was to identify subchondral-specific equations that optimized finite element predictions of local structural stiffness at the proximal tibial subchondral surface. Thirteen proximal tibial compartments were imaged via quantitative computed tomography. Imaged bone mineral density was converted to elastic moduli using multiple density-modulus equations (93 total variations) then mapped to corresponding finite element models. For each variation, root mean squared error was calculated between finite element prediction and in situ measured stiffness at 47 indentation sites. Resulting errors were used to train an artificial neural network, which provided an unlimited number of model variations, with corresponding error, for predicting stiffness at the subchondral bone surface. Nelder-Mead optimization was used to identify optimum density-modulus equations for predicting stiffness. Finite element modeling predicted 81% of experimental stiffness variance (with 10.5% error) using optimized equations for subchondral cortical and trabecular bone differentiated with a 0.5g/cm(3) density. In comparison with published density-modulus relationships, optimized equations offered improved predictions of local subchondral structural stiffness. Further research is needed with anisotropy inclusion, a smaller voxel size and de-blurring algorithms to improve predictions. Copyright © 2016 Elsevier Ltd. All rights reserved.
Nakai, Kenji; Takahashi, Shin; Suzuki, Atsushi; Hagiwara, Nobuhisa; Futagawa, Keisuke; Shoda, Morio; Shiga, Tsuyoshi; Takahashi, Ken; Okabayashi, Hitoshi; Itoh, Manabu; Kasanuki, Hiroshi
2011-03-01
The noninvasive evaluation of ventricular T-wave alternans (TWA) in patients with lethal ventricular arrhythmias is an important issue. In this study, we propose a novel algorithm to identify T-wave current density alternans (TWCA) using synthesized 187-channel vector-projected body surface mapping (187-ch SAVP-ECG). We recorded 10 min of 187-ch SAVP-ECG using a Mason-Likar lead system in the supine position. A recovery time (RT) dispersion map was obtained by averaging the 187-ch SAVP-ECG. The TWCA value was determined from the relative changes in the averaged current density in the T-wave zone (Tpeak ± 50 ms) for two T-wave types. We registered 20 ECG recordings from normal controls and 11 ECG recordings from nine subjects with long QT syndrome (LQT). We divided LQT syndrome subjects into two groups: group 1 provided 9 ECG recordings without visually apparent TWAs, and group 2 provided 2 ECG recordings with visually apparent TWAs. The QTc interval values in the LQT groups were higher than those in the control (515 ± 60 ms in LQT G-1, 600 ± 27 ms in LQT G-2 vs. 415 ± 19 ms in control, P < 0.001). The RTendc dispersion values among the LQT subjects were higher than those of the control subjects (48 ± 19 ms in LQT G-1, 65 ± 30 ms in LQT G-2 vs. 24 ± 10 ms in control, P < 0.01). The mean TWCA value was significantly higher in the LQT G-2 group with visually apparent TWCAs (0.5 ± 0.2% in control, 2.1 ± 1.2% in LQT G-1, and 32.3 ± 6.9% in LQT G-2). Interestingly, the two-dimensional distribution of TWCA in LQT was inhomogeneous and correlated with the distribution of increased RT dispersion. We conclude that a novel algorithm using 187-ch SAVP-ECG might provide new insights into body surface TWCA.
Mastropietro, A. J.; Pauken, Michael; Sunada, Eric; Gray, Sandria
2013-01-01
The thermal design and analysis of the experimental Supersonic Flight Dynamics Test (SFDT) vehicle is presented. The SFDT vehicle is currently being designed as a platform to help demonstrate key technologies for NASA's Low Density Supersonic Decelerator (LDSD) project. The LDSD project is charged by NASA's Office of the Chief Technologist (OCT) with the task of advancing the state of the art in Mars Entry, Descent, and Landing (EDL) systems by developing and testing three new technologies required for landing heavier payloads on Mars. The enabling technologies under development consist of a large 33.5 meter diameter Supersonic Ringsail (SSRS) parachute and two different types of Supersonic Inflatable Aerodynamic Decelerator (SIAD) devices - a robotic class, SIAD-R, that inflates to a 6 meter diameter torus, and an exploration class, SIAD-E, that inflates to an 8 meter diameter isotensoid. As part of the technology development effort, the various elements of the new supersonic decelerator system must be tested in a Mars-like environment. This is currently planned to be accomplished by sending a series of SFDT vehicles into Earth's stratosphere. Each SFDT vehicle will be lifted to a stable float altitude by a large helium carrier balloon. Once at altitude, the SFDT vehicles will be released from their carrier balloon and spun up via spin motors to provide trajectory stability. An onboard third stage solid rocket motor will propel each test vehicle to supersonic flight in the upper atmosphere. After main engine burnout, each vehicle will be despun and testing of the deceleration system will begin: first an inflatable decelerator will be deployed around the aeroshell to increase the drag surface area, and then the large parachute will be deployed to continue the deceleration and return the vehicle back to the Earth's surface. The SFDT vehicle thermal system must passively protect the vehicle structure and its components from cold temperatures experienced during the
Dovrolis, Konstantinos [Georgia Tech
2014-04-15
We present the development of a middleware service, called Pythia, that is able to detect, localize, and diagnose performance problems in the network paths that interconnect research sites that are of interest to DOE. The proposed service can analyze perfSONAR data collected from all participating sites.
Gonzalez, Margarita Rosales; Salgado, Margarita Ines Zarco
2004-01-01
This paper focuses on the capacity building of "local partnership" members or leaders as development agents in their Mayan communities. It relates to an education/training process started in 1995 in four different regions of the Yucatan Peninsula, Mexico, which was carried out by Non Governmental Organizations (NGO) and academic…
Wang, Huiyuan; Yang, Xiaohu; Zhang, Youcai; Shi, JingJing; Jing, Y P; Liu, Chengze; Li, Shijie; Kang, Xi; Gao, Yang
2016-01-01
A method we developed recently for the reconstruction of the initial density field in the nearby Universe is applied to the Sloan Digital Sky Survey Data Release 7. A high-resolution N-body constrained simulation (CS) of the reconstructed initial condition, with $3072^3$ particles evolved in a 500 Mpc/h box, is carried out and analyzed in terms of the statistical properties of the final density field and its relation with the distribution of SDSS galaxies. We find that the statistical properties of the cosmic web and the halo populations are accurately reproduced in the CS. The galaxy density field is strongly correlated with the CS density field, with a bias that depend on both galaxy luminosity and color. Our further investigations show that the CS provides robust quantities describing the environments within which the observed galaxies and galaxy systems reside. Cosmic variance is greatly reduced in the CS so that the statistical uncertainties can be controlled effectively even for samples of small volumes...
Bourgain, Pascaline
2015-04-01
Bridging Science and Society has now become a necessity for scientists to develop new partnerships with local communities and to raise the public interest for scientific activities. The French-Greenlandic educational project called "Angalasut" reflects this desire to create a bridge between science, local people and the general public. This program was set up on the 2012-2013 school year, as part of an international scientific program dedicated to study the interactions between the ocean and glaciers on the western coast of Greenland, in the Uummannaq fjord. Greenlandic and French school children were involved in educational activities, in classrooms and out on the field, associated with the scientific observations conducted in Greenland (glacier flow, ocean chemical composition and circulation, instrumentation...). In Greenland, the children had the opportunity to come on board the scientific sailing boat, and in France, several meetings were organized between the children and the scientists of the expedition. In the small village of Ikerasak, the children interviewed Elders about sea ice evolution in the area. These activities, coupled to the organization of public conferences and to the creation of a trilingual website of the project (French, Greenlandic, English) aimed at explaining why scientists come to study Greenland environment. This was the opportunity for scientists to discuss with villagers who could testify on their changing environment over the past decades. A first step toward a future collaboration between scientists and villagers that would deserve further development... The project Angalasut was also the opportunity for Greenlandic and French school children to exchange about their culture and their environment through Skype communications, the exchange of mails (drawings, shells...), the creation of a society game about European fauna and flora... A meeting in France between the two groups of children is considered, possibly in summer 2015
Kelly, Scott D.; Wortley, Pascale M.; Drenzek, Cherie L.
2016-01-01
Background Tools using local HIV data to help jurisdictions estimate future demand for medical and support services are needed. We present an interactive prevalence projection model using data obtainable from jurisdictional HIV surveillance and publically available data. Methods Using viral load data from Georgia’s enhanced HIV/AIDS Reporting System, state level death rates for people living with HIV and the general population, and published estimates for HIV transmission rates, we developed a model for projecting future HIV prevalence. Keeping death rates and HIV transmission rates for undiagnosed, in care/viral load >200, in care/viral load<200, and out of care (no viral load for 12 months) constant, we describe results from simulations with varying inputs projecting HIV incidence and prevalence from 2014 to 2024. Results In this model, maintaining Georgia’s 2014 rates for diagnosis, transitions in care, viral suppression (VS), and mortality by sub-group through 2020, resulted in 85% diagnosed, 59% in care, and 44% VS among diagnosed (85%/58%/44%) with a total of 67 815 PLWH, 33 953 in care, and more than 1000 new cases per year by 2020. Neither doubling the diagnosis rate nor tripling rates of re-engaging out of care PLWH into care alone were adequate to reach 90/90/80 by 2020. We demonstrate a multicomponent scenario that achieved NHAS goals and resulted in 63 989 PLWH, 57 546 in care, and continued annual prevalence increase through 2024. Conclusions Jurisdictions can use this HIV prevalence prediction tool, accessible at https://dph.georgia.gov/hiv-prevalence-projections to assess local capacity to meet future HIV care and social services needs. In this model, achieving 90/90/80 by 2020 in Georgia slowed but did not reverse increases in HIV prevalence, and the number of HIV-infected persons needing care and support services more than doubled. Improving the HIV care infrastructure is imperative. PMID:27459717
Snover, A. K.; Littell, J. S.; Mantua, N. J.; Salathe, E. P.; Hamlet, A. F.; McGuire Elsner, M.; Tohver, I.; Lee, S.
2010-12-01
Assessing and planning for the impacts of climate change require regionally-specific information. Information is required not only about projected changes in climate but also the resultant changes in natural and human systems at the temporal and spatial scales of management and decision making. Therefore, climate impacts assessment typically results in a series of analyses, in which relatively coarse-resolution global climate model projections of changes in regional climate are downscaled to provide appropriate input to local impacts models. This talk will describe recent examples in which coarse-resolution (~150 to 300km) GCM output was “translated” into information requested by decision makers at relatively small (watershed) and large (multi-state) scales using regional climate modeling, statistical downscaling, hydrologic modeling, and sector-specific impacts modeling. Projected changes in local air temperature, precipitation, streamflow, and stream temperature were developed to support Seattle City Light’s assessment of climate change impacts on hydroelectric operations, future electricity load, and resident fish populations. A state-wide assessment of climate impacts on eight sectors (agriculture, coasts, energy, forests, human health, hydrology and water resources, salmon, and urban stormwater infrastructure) was developed for Washington State to aid adaptation planning. Hydro-climate change scenarios for approximately 300 streamflow locations in the Columbia River basin and selected coastal drainages west of the Cascades were developed in partnership with major water management agencies in the Pacific Northwest to allow planners to consider how hydrologic changes may affect management objectives. Treatment of uncertainty in these assessments included: using “bracketing” scenarios to describe a range of impacts, using ensemble averages to characterize the central estimate of future conditions (given an emissions scenario), and explicitly assessing
2009-01-01
Global agreements have proliferated in the past ten years. One of these is the Kyoto Protocol, which contains provisions for emissions reductions by trading carbon through the Clean Development Mechanism (CDM). The CDM is a market-based instrument that allows companies in Annex I countries to offset their greenhouse gas emissions through energy and tree offset projects in the global South. I set out to examine the governance challenges posed by the institutional design of carbon sequestration...
Saha, Sajib; Tahtali, Murat; Gureyev, Timur E
2014-01-01
Electroencephalography (EEG) has enjoyed considerable attention over the past century and has been applied for diagnosis of epilepsy, stroke, traumatic brain injury and other disorders where 3D localization of electrical activity in the brain is potentially of great diagnostic value. In this study we evaluate the precision and accuracy of spatial localization of electrical activity in the brain delivered by a popular reconstruction technique sLORETA applied to EEG data collected by two commonly used low-density headsets with 14 and 19 measurement channels, respectively. Numerical experiments were performed for a realistic head model obtained by segmentation of MRI images. The EEG source localization study was conducted with a simulated single active dipole, as well as with two spatially separated simultaneously active dipoles, as a function of dipole positions across the neocortex, with several different noise levels in the EEG signals registered on the scalp. The results indicate that while the reconstructio...
Cembran, Alessandro; Song, Lingchun; Mo, Yirong; Gao, Jiali
2009-10-13
A multistate density functional theory in the framework of the valence bond model is described. The method is based on a block-localized density functional theory (BLDFT) for the construction of valence-bond-like diabatic electronic states and is suitable for the study of electron transfer reactions and for the representation of reactive potential energy surfaces. The method is equivalent to a valence bond theory with the treatment of the localized configurations by using density functional theory (VBDFT). In VBDFT, the electron densities and energies of the valence bond states are determined by BLDFT. A functional estimate of the off-diagonal matrix elements of the VB Hamiltonian is proposed, making use of the overlap integral between Kohn-Sham determinants and the exchange-correlation functional for the ground state substituted with the transition (exchange) density. In addition, we describe an approximate approach, in which the off-diagonal matrix element is computed by wave function theory using block-localized Kohn-Sham orbitals. The key feature is that the electron density of the adiabatic ground state is not directly computed nor used to obtain the ground-state energy; the energy is determined by diagonalization of the multistate valence bond Hamiltonian. This represents a departure from the standard single-determinant Kohn-Sham density functional theory. The multistate VBDFT method is illustrated by the bond dissociation of H2+ and a set of three nucleophilic substitution reactions in the DBH24 database. In the dissociation of H2+, the VBDFT method yields the correct asymptotic behavior as the two protons stretch to infinity, whereas approximate functionals fail badly. For the S(N)2 nucleophilic substitution reactions, the hybrid functional B3LYP severely underestimates the barrier heights, while the approximate two-state VBDFT method overcomes the self-interaction error, and overestimates the barrier heights. Inclusion of the ionic state in a three
Ghadar, Yasaman; Clark, Aurora E
2012-02-07
The interaction potentials between immiscible polar and non-polar solvents are a major driving force behind the formation of liquid:liquid interfaces. In this work, the interaction energy of water-pentane dimer has been determined using coupled-cluster theory with single double (triple) excitations [CCSD(T)], 2nd order Möller Plesset perturbation theory (MP2), density fitted local MP2 (DF-LMP2), as well as density functional theory using a wide variety of density functionals and several different basis sets. The M05-2X exchange correlation functionals exhibit excellent agreement with CCSD(T) and DF-LMP2 after taking into account basis set superposition error. The gas phase water-pentane interaction energy is found to be quite sensitive to the specific pentane isomer (2,2-dimethylpropane vs. n-pentane) and relative orientation of the monomeric constituents. Subsequent solution phase cluster calculations of 2,2-dimethylpropane and n-pentane solvated by water indicate a positive free energy of solvation that is in good agreement with available experimental data. Structural parameters are quite sensitive to the density functional employed and reflect differences in the two-body interaction energy calculated by each method. In contrast, cluster calculations of pentane solvation of H(2)O solute are found to be inadequate for describing the organic solvent, likely due to limitations associated with the functionals employed (B3LYP, BHandH, and M05-2X).
van Milligen, B Ph; Garcia, L; Bruna, D Lopez; Carreras, B A; Xu, Y; Ochando, M; Hidalgo, C; Reynolds-Barredo, J M; Fraguas, A Lopez
2016-01-01
This work explores the relation between magnetic islands, long range temporal correlations and heat transport. A low order rational surface ($\\iota/2\\pi = 3/2$) was purposely scanned outward through an Electron Cyclotron Resonance Heated (ECRH) plasma in the TJ-II stellarator. Density turbulence and the poloidal flow velocity (or radial electric field) were characterized using a two channel Doppler Reflectometer. Simultaneously, the ECRH power was modulated to characterize heat transport, using measurements from a 12 channel Electron Cyclotron Emission diagnostic. A systematic variation of the poloidal velocity was found to be associated with the stationary $\\iota/2\\pi = 3/2$ magnetic island. Inside from the rational surface, the Hurst coefficient, quantifying the nature of long-range correlations, was found to be significantly enhanced. Simultaneously, heat transport was enhanced as well, establishing a clear link between density fluctuations and anomalous heat transport. The variation of the Hurst coefficie...
Kiyokawa, Shuji
2007-04-01
We give the derivation of the Fano profile (the resonance energy position, the resonance width Γ , and q value) from the time-dependent nonrelativistic density-functional theory (DFT) and propose a scheme for calculating the photoabsorption cross section of hot dense plasmas. As a consequence of this derivation, we show the line profile is obtained as a superposition of Fano and Lorentz profiles when the competition of two optically allowed bound-bound and bound-free transitions occurs. We also show the results of the photoabsorption cross section by applying our scheme to an Fe plasma (density is 7.85g/cm3 , temperature is 100eV ), where the calculation is carried out without numerical divergence for any photon energy. The calculated results are in good agreement with those of Grimaldi.
Localization of deformable tumors from short-arc projections using Bayesian estimation
Hoegele, W.; Zygmanski, P.; Dobler, B.; Kroiss, M.; Koelbl, O.; Loeschel, R. [Department of Radiation Oncology, Regensburg University Medical Center, 93053 Regensburg (Germany) and Department of Computer Science and Mathematics, University of Applied Sciences, 93053 Regensburg (Germany); Department of Radiation Oncology, Brigham and Women' s Hospital and Harvard Medical School, Boston, Massachusetts 02115 (United States); Department of Radiation Oncology, Regensburg University Medical Center, 93053 Regensburg (Germany); Department of Radiation Oncology, Hospital of the Sisters of Mercy, 4010 Linz (Austria); Department of Radiation Oncology, Regensburg University Medical Center, 93053 Regensburg (Germany); Department of Computer Science and Mathematics, University of Applied Sciences, 93053 Regensburg (Germany)
2012-12-15
Purpose: The authors present a stochastic framework for radiotherapy patient positioning directly utilizing radiographic projections. This framework is developed to be robust against anatomical nonrigid deformations and to cope with challenging imaging scenarios, involving only a few cone beam CT projections from short arcs. Methods: Specifically, a Bayesian estimator (BE) is explicitly derived for the given scanning geometry. This estimator is compared to reference methods such as chamfer matching (CM) and the minimization of the median absolute error adapted as tools of robust image processing and statistics. In order to show the performance of the stochastic short-arc patient positioning method, a CIRS IMRT thorax phantom study is presented with movable markers and the utilization of an Elekta Synergy{sup Registered-Sign} XVI system. Furthermore, a clinical prostate CBCT scan of a Varian{sup Registered-Sign} On-Board Imager{sup Registered-Sign} system is utilized to investigate the robustness of the method for large variations of image quality (anterior-posterior vs lateral views). Results: The results show that the BE shifts reduce the initial setup error of up to 3 cm down to 3 mm at maximum for an imaging arc as short as 10 Degree-Sign while CM achieves residual errors of 7 mm at maximum only for arcs longer than 40 Degree-Sign . Furthermore, the BE can compensate robustly for low image qualities using several low quality projections simultaneously. Conclusions: In conclusion, an estimation method for marker-based patient positioning for short imaging arcs is presented and shown to be robust and accurate for deformable anatomies.
k-MED - from a local project to a service provider for eLearning
Wagner, Richard
2006-11-01
Full Text Available k-MED evolved from a single medical subject project in 1999 to a provider of comprehensive technology, infrastructure and content for authors and learners. It currently offers about 170 courses covering 16 medical subjects. The k-MED community consists of medical authors and experts for technology, graphical and instructional design. It has its proprietary authoring tools and an internet based learning management system, both being continually improved corresponding to service experiences. k-MED aims at ongoing development as a service provider for educational institutions for undergraduate or continuing medical education. For further information see http://www.k-med.org.
Franc J. Zakrajšek
1999-01-01
Full Text Available The project objective is to strengthen the development, establishment, maintenance and use of the geographical data bases in the processes of physical planning and urban management on local level. It is a part of the Slovenian environmental project Onix. The current state is the phase of implementation.
Jan Z. Szopinski; Xiao Hong Teng; Georg P. Lochner; Tomasz Macura; Iwona Karcz-Socha; Anna Kasprzyk-Minkner; Krzysztof Kielan; Barbara Krupa-Jezierska; Dariusz J. Nasiek; Piotr Warakomski
2006-01-01
Background:Localization of auricular projection area of the liver and evaluation of its usefulness in the monitoring of viral hepatitis. Design, Patients and Setting: Comparative study of the degree of electrical rectification measured at various spots in the auricular concha region, in 19 inpatients with hepatitis B and 15 clinically healthy volunteers, at the Department of Infectious Diseases, Provincial Teaching Hospital,Tychy, Poland. Intervention: Evaluation of electrical rectification at various spots on the auricular concha using a "rectification ratio" that quantifies the degree of rectification (normal range:0-60%). Main outcome measure: The location of the skin area where a statistically significant difference existed between the rectification ratios was observed in patients (82±12% at the time of the 'peak period') versus controls (42±8%). Results: A location was identified on the ear auricle where the electrical rectification phenomenon demonstrated a dependence on the presence of hepatitis. Conclusions: Liver projection area exists on the ear auricle which is located within the region of cymba conchae, next to anthelix and the cavity of concha. The existence of viral hepatitis causes this skin area to show a higher degree of electrical rectification once the skin resistance 'breakthrough effect' has been induced. Evaluation of the rectification phenomenon of the liver projection area provides a method of non-invasive monitoring of viral hepatitis.
Phipps, M J S; Fox, T; Tautermann, C S; Skylaris, C-K
2016-07-12
We report the development and implementation of an energy decomposition analysis (EDA) scheme in the ONETEP linear-scaling electronic structure package. Our approach is hybrid as it combines the localized molecular orbital EDA (Su, P.; Li, H. J. Chem. Phys., 2009, 131, 014102) and the absolutely localized molecular orbital EDA (Khaliullin, R. Z.; et al. J. Phys. Chem. A, 2007, 111, 8753-8765) to partition the intermolecular interaction energy into chemically distinct components (electrostatic, exchange, correlation, Pauli repulsion, polarization, and charge transfer). Limitations shared in EDA approaches such as the issue of basis set dependence in polarization and charge transfer are discussed, and a remedy to this problem is proposed that exploits the strictly localized property of the ONETEP orbitals. Our method is validated on a range of complexes with interactions relevant to drug design. We demonstrate the capabilities for large-scale calculations with our approach on complexes of thrombin with an inhibitor comprised of up to 4975 atoms. Given the capability of ONETEP for large-scale calculations, such as on entire proteins, we expect that our EDA scheme can be applied in a large range of biomolecular problems, especially in the context of drug design.
Swanson, B. I.; Donohoe, R. J.; Worl, L. A.; Bulou, A. D.F.; Arrington, C. A.; Gammel, J. T.; Saxena, A.; Bishop, A. R.
1990-01-01
We have undertaken a combined theoretical and experimental effort directed toward the examination of both the ground and defect states in halide-bridged mixed-valence metal linear chains materials as they are tuned within and between broken symmetry phases. Novel low-dimensional highly correlated electronic materials offer a difficult theoretical challenge as we must span from a description of electronic structure on a molecular scale to the meso scale structure that is intrinsic to these solids. Our theoretical effort at Los Alamos combines quantum chemistry, band structure calculations, and many body modeling using Peierls-Hubbard Hamiltonians in order to model ground and local states. The experimental effort combines synthesis and a variety of microscopic structural and spectroscopic probes and macroscopic measurements in an effort to fully characterize both ground and local states as these materials are tuned in the phase boundary regions between broken symmetry states. The present article summarizes some of our recent research using optical spectroscopy to obtain signatures of photoexcited and intrinsic local states and compares these experimental results with Peierls-Hubbard calculations of the optical properties of these materials. Details concerning the theoretical and experimental approaches can be found elsewhere.
Alejandro Morales-Bayuelo
2014-01-01
Full Text Available We present a topological analysis to the inductive effect through steric and electrostatic scales of quantitative convergence. Using the molecular similarity field based in the local guantum similarity (LQS with the Topo-Geometrical Superposition Algorithm (TGSA alignment method and the chemical reactivity in the density function theory (DFT context, all calculations were carried out with Amsterdam Density Functional (ADF code, using the gradient generalized approximation (GGA and local exchange correlations PW91, in order to characterize the electronic effect by atomic size in the halogens group using a standard Slater-type-orbital basis set. In addition, in this study we introduced news molecular bonding relationships in the inductive effect and the nature of the polar character in the C–H bond taking into account the global and local reactivity descriptors such as chemical potential, hardness, electrophilicity, and Fukui functions, respectively. These descriptors are used to find new alternative considerations on the inductive effect, unlike to the binding energy and dipole moment performed in the traditional organic chemical.
Loibl, Stefan; Schütz, Martin
2012-08-28
An efficient method for the calculation of nuclear magnetic resonance (NMR) shielding tensors is presented, which treats electron correlation at the level of second-order Mo̸ller-Plesset perturbation theory. It uses spatially localized functions to span occupied and virtual molecular orbital spaces, respectively, which are expanded in a basis of gauge including atomic orbitals (GIAOs or London atomic orbitals). Doubly excited determinants are restricted to local subsets of the virtual space and pair energies with an interorbital distance beyond a certain threshold are omitted. Furthermore, density fitting is employed to factorize the electron repulsion integrals. Ordinary Gaussians are employed as fitting functions. It is shown that the errors in the resulting NMR shielding constant, introduced (i) by the local approximation and (ii) by density fitting, are very small or even negligible. The capabilities of the new program are demonstrated by calculations on some extended molecular systems, such as the cyclobutane pyrimidine dimer photolesion with adjacent nucleobases in the native intrahelical DNA double strand (ATTA sequence). Systems of that size were not accessible to correlated ab initio calculations of NMR spectra before. The presented method thus opens the door to new and interesting applications in this area.
Olsen, Stig Irving; Bonou, Alexandra
2012-01-01
The core of the EU FP7 funded project W2Plastic is development of a magnetic density separation (MDS) of polyolefines in order to improve the sorting efficiency of these polymer types in different waste fractions. As part of the project a life cycle assessment is performed in order to firstly...... identify eco-design criteria for the development and secondly to document the potential environmental improvement of polyolefin recycling using the MDS technology. A preliminary study focusing solely on the carbon footprint benefits of recycling plastic waste compared to virgin production of polymers...
Kerdpol, Sakon
2016-01-01
This paper presents an investigation of a research entitled, " An Application of Project-based Learning on the Development of Young Local Tour Guides on Tai Phuan's Culture and Tourist Attractions in Sisatchanalai District, Sukhothai Province. It was intended to develop young local tour guides on Tai Phuan's culture and tourist attractions in…
Su, Shin-Yi
Longitudinal/seasonal (l/s) variations of ion density structures at the 600-km low-latitude ionosphere observed by ROCSAT-1 between two similar solar activity years of 2000 and 2002 are examined at four different local-time (LT) regions. The gross feature of l/s density structure is almost identical to each other at the four LT regions examined. A complete reproducibility of density structure can be assumed, including the shape of equatorial ionization anomaly (EIA), for identical solar flux input that also implicitly affect other atmospheric components such as the neutral O/N2 ratio and neutral wind variation. The fact that the solar variability effect is thought as the ultimate driver to shape the global ionospheric structure can be confirmed with the reproduction of ROCSAT observations with the simulation results of the TIEGCM model runs using the observed solar flux inputs for various seasons. However, the EIA crestto-valley ratio or no-valley signature in this background density structure can not be used to infer the post-sunset irregularity occurrence rates because the l/s variation of the magnetic declination effect that determines the post-sunset ionospheric conductivity for the ionospheric electrodynamics can not be readily obtained from this ionospheric background structure.
Gritsenko, O V; Mentel, Ł M; Baerends, E J
2016-05-28
In spite of the high quality of exchange-correlation energies Exc obtained with the generalized gradient approximations (GGAs) of density functional theory, their xc potentials vxc are strongly deficient, yielding upshifts of ca. 5 eV in the orbital energy spectrum (in the order of 50% of high-lying valence orbital energies). The GGAs share this deficiency with the local density approximation (LDA). We argue that this error is not caused by the incorrect long-range asymptotics of vxc or by self-interaction error. It arises from incorrect density dependencies of LDA and GGA exchange functionals leading to incorrect (too repulsive) functional derivatives (i.e., response parts of the potentials). The vxc potential is partitioned into the potential of the xc hole vxchole (twice the xc energy density ϵxc), which determines Exc, and the response potential vresp, which does not contribute to Exc explicitly. The substantial upshift of LDA/GGA orbital energies is due to a too repulsive LDA exchange response potential vxresp (LDA) in the bulk region. Retaining the LDA exchange hole potential plus the B88 gradient correction to it but replacing the response parts of these potentials by the model orbital-dependent response potential vxresp (GLLB) of Gritsenko et al. [Phys. Rev. A 51, 1944 (1995)], which has the proper step-wise form, improves the orbital energies by more than an order of magnitude. Examples are given for the prototype molecules: dihydrogen, dinitrogen, carbon monoxide, ethylene, formaldehyde, and formic acid.
Hoessli, D.C.; Poincelet, M.; Gupta, Ramneek;
2003-01-01
In addition to the major carbohydrate moieties of the glycosylphosphatidylinositol (GPI) anchor, we report that Plasmodium falciparum merozoite surface protein 1 (MSP-1) bears O-GlcNAc modifications predominantly in beta-anomeric configuration, in both the C- and N-terminal portions of the protein....... Subcellular fractionation of parasitized erythrocytes in the late trophozoite/schizont stage reveals that GPI-anchored C-terminal fragments of MSP-1 are recovered in Triton X-100 resistant, low-density membrane fractions. Our results suggest that O -GlcNAc-modified MSP-1 N-terminal fragments tend to localize...... within the parasitophorous vacuolar membrane while GPI-anchored MSP-1 C-terminal fragments associate with low-density, Triton X-100 resistant membrane domains (rafts), redistribute in the parasitized erythrocyte and are eventually shed as membrane vesicles that also contain the endogenous, GPI-linked CD...
Aird, H. M.
2016-12-01
A research project into the local petrology was integrated into the Spring 2016 Petrology and Optical Mineralogy course at California State University, Chico. This is a required majors course, typically taken during spring of the junior year, with an enrollment of 10-20 students. Since the labs for this course have a strong focus on petrography, a research project was introduced to give students experience in using a multi-faceted approach to investigate a problem. In many cases, this is their first taste of research. During the first week of the Spring 2016 class, students were introduced to the research question: In the broader context of Californian tectonic history, are the Bucks Lake and Grizzly plutons of the northern Sierra Nevada petrogenetically related? With faculty guidance over the course of the semester, students carried out fieldwork and sampling, lithologic description, selection of the best samples for further analysis, thin section production, petrographic description, and analysis and interpretation of published geochemical data. Research activities were strategically scheduled within the course framework such that students were academically prepared to carry out each task. Each student was responsible for generating all the data for one sample, and data were then collated as a class, so students wrote their individual final reports using all the data collected by the class. Careful scaffolding of writing assignments throughout the semester guided students through the preparation of an academic-style scientific report, while allowing for repeated feedback on their writing style and content. In mid-May, the class presented a group poster at the College of Natural Sciences annual poster symposium, and were awarded `Best Student Class Project' by the judges. Anecdotal student feedback indicated they highly valued the research experience and some were inspired to pursue individual undergraduate research projects under faculty supervision.
de Lasson, Jakob Rosenkrantz; Kristensen, Philip Trøst; Mørk, Jesper
2015-01-01
We present and validate a semi-analytical quasi-normal mode (QNM) theory for the local density of states (LDOS) in coupled photonic crystal (PhC) cavity-waveguide structures. By means of an expansion of the Green's function on one or a few QNMs, a closed-form expression for the LDOS is obtained......, and for two types of two-dimensional PhCs, with one and two cavities side-coupled to an extended waveguide, the theory is validated against numerically exact computations. For the single cavity, a slightly asymmetric spectrum is found, which the QNM theory reproduces, and for two cavities a non...
Fasano, Y.; Maggio-Aprile, I.; Zhigadlo, N. D.; Katrych, S.; Karpinski, J.; Fischer, Ø.
2010-10-01
We probe the local quasiparticles density of states in micron-sized SmFeAsO1-xFx single crystals by means of scanning tunnelling spectroscopy. Spectral features resemble those of cuprates, particularly a dip-hump-like structure developed at energies larger than the gap that can be ascribed to the coupling of quasiparticles to a collective mode, quite likely a resonant spin mode. The energy of the collective mode revealed in our study decreases when the pairing strength increases. Our findings support spin-fluctuation-mediated pairing in pnictides.
Strubbe, David A.; Andrade, Xavier; Rubio, Angel; Louie, Steven G.
2010-03-01
Chloroform is often used as a solvent when measuring non-linear optical properties of organic molecules. We assess the influence of the solution environment on the molecular properties by calculating directly the non-linear susceptibilities of liquid chloroform at optical frequencies. We use the Sternheimer equation in time-dependent density-functional theory [J. Chem. Phys. 126, 184106 (2007)], on snapshots from ab initio molecular dynamics. We compare the results to those in the gas and solid phases, and to experimental values. We also calculate ab initio local-field factors, used to analyze electric-field-induced second-harmonic generation (EFISH) and hyper-Rayleigh scattering (HRS) experiments.
Michele Maglione
2012-01-01
Full Text Available The purpose of this research was to compare the reliability of two different methods for cranial midline localization through cephalometric analysis of mandibular condyle asymmetries. A retrospective cohort study was performed analyzing consecutively the SMV radiograms of 47 patients undergoing oral surgery before orthodontic treatment at the Dental School, University of Trieste (Italy from 2003 to 2008. Two different cephalometric analyses were used to identify the basicranium midline (Tracing 1: initial landmarks = craniostat ear rods; Tracing 2: initial landmarks = spinosum foramina, and the left/right symmetry ratio (SR for four parameters (condylar length, condylar angle, intra-condylar hemidistance, extra-condylar hemidistance was calculated. The main result showed that no significant statistical difference between the SRs of the intra-condylar and extra-condylar hemidistance obtained with the same tracing was found (-test; =NS; C.I. 95%. Conversely, the difference between the SRs obtained with the two different tracings was statistically significant (-test; <0.000; C.I. 95%. In conclusion, if the analysis of condylar asymmetries is performed in growing subjects, utilization of anatomic references such as the neurovascular foramina seems to guarantee a lower error compared to non-fixed references such as ear rods.
Towards a comparable carbon footprint for local initiatives: The FP7 project TESS
Reusser, Dominik E.; Kropp, Jürgen P.
2014-05-01
TESS (Towards European Societal Sustainability -- www.tess-transition.eu) is a three-year, European-wide research project. It aims to reach an understanding of the potential for community-led initiatives to help deliver a truly sustainable, low-carbon future. Transitions to low-carbon societies take place at multiple and complementary scales. Transition processes are highly dependent on the innovative potential of community-based initiatives and their articulation with appropriate institutional architecture. Community-based initiatives are potentially more adaptable and less constrained by current structural circumstances than top-down policies and can give impetus to large-scale and technology driven changes. TESS will provide an understanding on the upscaling possibilities of such high-potential community-based initiatives by addressing two main questions: What is the impact of community-based initiatives in terms of carbon reduction potential and economic effect? What institutional structures (values, policies and mechanisms) support these initiatives in persisting beyond the initial phase and moving into an acceleration phase, spreading desired impacts? Answers will be provided through (1) a novel measuring, reporting and verification (MRV) framework for benchmarking community-based initiatives. This will enable quantifiable, comparable and standardised evaluation, and (2) the identification of success factors for the emergence, persistence and diffusion of promising initiatives, including online initiatives. We will identify these initiatives through case studies across regions and sectors and produce a systemic understanding of their impact on societal transitions towards sustainability. Our research will be integrated and transdisciplinary, with the unique opportunity to bring together social and natural scientists to foster a transition towards European societal sustainability. Our work will feed into and extend the Climate Adapt database to facilitate
Yarch, Jeff; Federer, Frederick; Angelucci, Alessandra
2017-01-11
Decades of anatomical studies on the primate primary visual cortex (V1) have led to a detailed diagram of V1 intrinsic circuitry, but this diagram lacks information about the output targets of V1 cells. Understanding how V1 local processing relates to downstream processing requires identification of neuronal populations defined by their output targets. In primates, V1 layers (L)2/3 and 4B send segregated projections to distinct cytochrome oxidase (CO) stripes in area V2: neurons in CO blob columns project to thin stripes while neurons outside blob columns project to thick and pale stripes, suggesting functional specialization of V1-to-V2 CO streams. However, the conventional diagram of V1 shows all L4B neurons, regardless of their soma location in blob or interblob columns, as projecting selectively to CO blobs in L2/3, suggesting convergence of blob/interblob information in L2/3 blobs and, possibly, some V2 stripes. However, it is unclear whether all L4B projection neurons show similar local circuitries. Using viral-mediated circuit tracing, we have identified the local circuits of L4B neurons projecting to V2 thick stripes in macaque. Consistent with previous studies, we found the somata of this L4B subpopulation to reside predominantly outside blob columns; however, unlike previous descriptions of local L4B circuits, these cells consistently projected outside CO blob columns in all layers. Thus, the local circuits of these L4B output neurons, just like their extrinsic projections to V2, preserve CO streams. Moreover, the intra-V1 laminar patterns of axonal projections identify two distinct neuron classes within this L4B subpopulation, including a rare novel neuron type, suggestive of two functionally specialized output channels.
Sloan, J. V.; Hotz, M.; Boutan, C.; Bradley, R.; Carosi, G.; Carter, D.; Clarke, J.; Crisosto, N.; Daw, E. J.; Gleason, J.; Hoskins, J.; Khatiwada, R.; Lyapustin, D.; Malagon, A.; O'Kelley, S.; Ottens, R. S.; Rosenberg, L. J.; Rybka, G.; Stern, I.; Sullivan, N. S.; Tanner, D. B.; van Bibber, K.; Wagner, A.; Will, D.
2016-12-01
The μeV-scale axion is a compelling cold dark matter candidate. The Axion Dark Matter eXperiment (ADMX) searches for axions by stimulating the decay of galactic dark matter halo axions into detectable microwave photons by their conversion in a resonant cavity permeated by a strong, static magnetic field. The signal depends on properties of the Milky Way's dark matter halo; the choice of halo model has significant implications for the sensitivity of direct detection searches, e.g., ADMX. This paper explores the sensitivity of the data taken by ADMX from 2008 to 2010 to various dark matter halo models. New models for the phase-space distribution of local axions are considered; the analysis demonstrates that certain assumptions about the dark matter halo improve limits on axion-photon coupling. In addition, new ADMX data covering 860-892 MHz are included in the analysis.
Hernandez-Trujillo, Jesus [Programa de Ingenieria Molecular, Instituto Mexicano del Petroleo, Eje Central Lazaro Cardenas 152, Colonia San Bartolo Atepehuacan, Mexico, D.F. 07730 (Mexico)]. E-mail: jesus.hernandez@correo.unam.mx; Garcia-Cruz, Isidoro [Programa de Ingenieria Molecular, Instituto Mexicano del Petroleo, Eje Central Lazaro Cardenas 152, Colonia San Bartolo Atepehuacan, Mexico, D.F. 07730 (Mexico); Martinez-Magadan, Jose Manuel [Programa de Ingenieria Molecular, Instituto Mexicano del Petroleo, Eje Central Lazaro Cardenas 152, Colonia San Bartolo Atepehuacan, Mexico, D.F. 07730 (Mexico)
2005-01-10
The topological properties of the charge distribution of pyrene and the three derived monoradicals in their ground state and of didehydrogenated pyrenes in the lowest singlet and triplet electronic states are discussed in detail by means of the quantum theory of atoms in molecules (TAIM) and by the electron localization function (ELF). The non-equivalence of the fused aromatic rings of pyrene prevents one from anticipating the stability and reactivity of these species from the chemistry of didehydrogenated species derived from benzene only. Whereas some of these didehydrogenated molecules were found to display a diradical character in the singlet ground state, the topological analysis reveals that others correspond to normal closed shells. Using these theoretical tools, the energetic and geometric details of o-, m- and p-benzyne-like pyrene derivatives are explained.
Lu, Deyu; Li, Yan; Rocca, Dario; Viet Nguyen, H.; Gygi, Francois; Galli, Giulia
2010-03-01
A recently developed technique to diagonalize iteratively dielectric matrices [1], is used to carry out efficient, ab-initio calculations of dispersion interactions, and excited state properties of nanostructures. In particular, we present results for the binding energies of weakly bonded molecular crystals [2], obtained at the EXX/RPA level of theory, and for absorption spectra of semiconducting clusters, obtained by an iterative solution of the Bethe-Salpeter equations [3]. We show that the ability to obtain the eigenmodes of dielectric matrices from Density Functional perturbation theory, without computing single particle excited states, greatly improves the efficiency of both EXX/RPA and many body perturbation theory [3,4] calculations and opens the way to large scale computations. [1] H. Wilson, F. Gygi and G. Galli, Phys. Rev. B , 78, 113303, 2008; and H. Wilson, D. Lu, F. Gygi and G. Galli, Phys. Rev. B, 79, 245106, 2009. [2] D. Lu, Y. Li, D. Rocca and G. Galli, Phys. Rev. Lett, 102, 206411, 2009; and Y. Li, D. Lu, V. Nguyen and G. Galli, J. Phys. Chem. C (submitted) [3] D. Rocca, D. Lu and G. Galli, submitted. [4] D. Lu, F. Gygi and G. Galli, Phys. Rev. Lett. 100, 147601, 2008. Work was funded by DOE/Scidac DE-FC02-06ER25794 and DOE/BES DE-FG02-06ER46262.
Huang, Chengjun; Chen, Xiang; Cao, Shuai; Zhang, Xu
2016-12-01
Objective. Some skeletal muscles can be subdivided into smaller segments called muscle-tendon units (MTUs). The purpose of this paper is to propose a framework to locate the active region of the corresponding MTUs within a single skeletal muscle and to analyze the activation level varieties of different MTUs during a dynamic motion task. Approach. Biceps brachii and gastrocnemius were selected as targeted muscles and three dynamic motion tasks were designed and studied. Eight healthy male subjects participated in the data collection experiments, and 128-channel surface electromyographic (sEMG) signals were collected with a high-density sEMG electrode grid (a grid consists of 8 rows and 16 columns). Then the sEMG envelopes matrix was factorized into a matrix of weighting vectors and a matrix of time-varying coefficients by nonnegative matrix factorization algorithm. Main results. The experimental results demonstrated that the weightings vectors, which represent invariant pattern of muscle activity across all channels, could be used to estimate the location of MTUs and the time-varying coefficients could be used to depict the variation of MTUs activation level during dynamic motion task. Significance. The proposed method provides one way to analyze in-depth the functional state of MTUs during dynamic tasks and thus can be employed on multiple noteworthy sEMG-based applications such as muscle force estimation, muscle fatigue research and the control of myoelectric prostheses. This work was supported by the National Nature Science Foundation of China under Grant 61431017 and 61271138.
Colas, L., E-mail: laurent.colas@cea.fr [CEA, IRFM, F-13108 Saint-Paul-Lez-Durance (France); Jacquet, Ph. [CCFE, Culham Science Centre, Abingdon OX14 3DB (United Kingdom); Van Eester, D. [LPP-ERM-KMS, TEC partner, Brussels (Belgium); Bobkov, V. [Max-Planck-Institut für Plasmaphysik, Garching (Germany); Brix, M.; Meneses, L. [CCFE, Culham Science Centre, Abingdon OX14 3DB (United Kingdom); Tamain, P. [CEA, IRFM, F-13108 Saint-Paul-Lez-Durance (France); Marsen, S. [CCFE, Culham Science Centre, Abingdon OX14 3DB (United Kingdom); Silva, C. [Instituto de Plasmas e Fusão Nuclear, Instituto Superior Técnico, Universidade de Lisboa (Portugal); Carralero, D.; Kočan, M.; Müller, H.-W. [Max-Planck-Institut für Plasmaphysik, Garching (Germany); Crombé, K.; Křivska, A. [LPP-ERM-KMS, TEC partner, Brussels (Belgium); Goniche, M. [CEA, IRFM, F-13108 Saint-Paul-Lez-Durance (France); Lerche, E. [LPP-ERM-KMS, TEC partner, Brussels (Belgium); Rimini, F.G. [CCFE, Culham Science Centre, Abingdon OX14 3DB (United Kingdom)
2015-08-15
Combining Lithium beam emission spectroscopy and edge reflectometry, localized Scrape-Off Layer (SOL) density modifications by Ion Cyclotron Range of Frequencies (ICRF) near fields were characterized in JET L-mode plasmas. When using the ICRF wave launchers connected magnetically to the Li-beam chord, the density decreased more steeply 2–3 cm outside the last closed flux surface (mapped onto the outer mid-plane) and its value at the outer limiter radial position was half the ohmic value. The depletion depends on the ICRF power and on the phasing between adjacent radiating straps. Convection due to ponderomotive effects and/or E × B{sub 0} drifts is suspected: during ICRF-heated H-mode discharges in 2013, DC potentials up to 70 V were measured locally in the outer SOL by a floating reciprocating probe, located toroidally several metres from the active antennas. These observations are compared with probe measurements on ASDEX-Upgrade. Their implications for wave coupling, heat loads and impurity production are discussed.
Loibl, Stefan; Schütz, Martin
2014-07-14
In this paper, we present theory and implementation of an efficient program for calculating magnetizabilities and rotational g tensors of closed-shell molecules at the level of local second-order Møller-Plesset perturbation theory (MP2) using London orbitals. Density fitting is employed to factorize the electron repulsion integrals with ordinary Gaussians as fitting functions. The presented program for the calculation of magnetizabilities and rotational g tensors is based on a previous implementation of NMR shielding tensors reported by S. Loibl and M. Schütz [J. Chem. Phys. 137, 084107 (2012)]. Extensive test calculations show (i) that the errors introduced by density fitting are negligible, and (ii) that the errors of the local approximation are still rather small, although larger than for nuclear magnetic resonance (NMR) shielding tensors. Electron correlation effects for magnetizabilities are tiny for most of the molecules considered here. MP2 appears to overestimate the correlation contribution of magnetizabilities such that it does not constitute an improvement over Hartree-Fock (when comparing to higher-order methods like CCSD(T)). For rotational g tensors the situation is different and MP2 provides a significant improvement in accuracy over Hartree-Fock. The computational performance of the new program was tested for two extended systems, the larger comprising about 2200 basis functions. It turns out that a magnetizability (or rotational g tensor) calculation takes about 1.5 times longer than a corresponding NMR shielding tensor calculation.
Heid, Rolf; Bohnen, Klaus-Peter; Zeyher, Roland; Manske, Dirk
2008-04-04
Using the local density approximation and a realistic phonon spectrum we determine the momentum and frequency dependence of alpha(2)F(k,omega) in YBa(2)Cu(3)O(7) for the bonding, antibonding, and chain band. The resulting self-energy Sigma is rather small near the Fermi surface. For instance, for the antibonding band the maximum of ReSigma as a function of frequency is about 7 meV at the nodal point in the normal state and the ratio of bare and renormalized Fermi velocities is 1.18. These values are a factor of 3-5 too small compared to the experiment showing that only a small part of Sigma can be attributed to phonons. Furthermore, the frequency dependence of the renormalization factor Z(k,omega) is smooth and has no anomalies at the observed kink frequencies which means that phonons cannot produce well-pronounced kinks in stoichiometric YBa(2)Cu()3)O(7), at least, within the local density approximation.
Jaquet, O.; Siegel, P. [Colenco Power Engineering Ltd, Baden-Daettwil (Switzerland)
2004-09-01
A hydrogeological model was developed for Beberg with the aim of evaluating the impact of a repository (for the operational and post-closure phases) while accounting for the effects of density-driven flow. Two embedded scales were taken into account for this modelling study: a local scale at which the granitic medium was considered as a continuum and a repository scale, where the medium is fractured and therefore was regarded to be discrete. The following step-wise approach was established to model density-driven flow at both repository and local scale: (a) modelling fracture networks at the repository scale, (b) upscaling the hydraulic properties to a continuum at local scale and (c) modelling density-driven flow to evaluate repository impact at local scale. The results demonstrate the strong impact of the repository on the flow field during the phase of operation. The distribution of the salt concentration is affected by a large upcoming effect with increased relative concentration and by the presence of fracture zones carrying freshwater from the surface. The concentrations obtained for the reference case, expressed in terms of percentage with respect to the maximum (prescribed) value in the model, are as follows: ca 30% for the phase of desaturation, and ca 20% for the resaturation phase. For the reference case, the impact of repository operations appears no longer visible after a resaturation period of about 20 years after repository closure; under resaturation conditions, evidence of the operational phase has already disappeared in terms of the observed hydraulic and concentration fields. Sensitivity calculations have proven the importance of explicitly discretising repository tunnels when assessing resaturation time and maximum concentration values. Furthermore, the definition of a fixed potential as boundary condition along the model's top surface is likely to provide underestimated values for the maximum concentration and overestimated flow rates in
National Aeronautics and Space Administration — This Phase I SBIR project seeks to develop a 500 Wh/kg Lithium primary battery for intended application as the primary power source on landers and probes for future...
Kawaguchi, Genta; Maesato, Mitsuhiko; Komatsu, Tokutaro; Imakubo, Tatsuro; Kitagawa, Hiroshi
2016-02-01
We present the results of high-pressure transport measurements on the anion-mixed molecular conductors (DIETSe)2M Br2Cl2 [DIETSe = diiodo(ethylenedithio)tetraselenafulvalene; M =Fe , Ga]. They undergo a metal-insulator (M-I) transition below 9 K at ambient pressure, which is suppressed by applying pressure, indicating a spin-density-wave (SDW) transition caused by a nesting instability of the quasi-one-dimensional (Q1D) Fermi surface, as observed in the parent compounds (DIETSe)2M Cl4 (M =Fe , Ga). In the metallic state, the existence of the Q1D Fermi surface is confirmed by observing the Lebed resonance. The critical pressures of the SDW, Pc, of the M Br2Cl2 (M =Fe , Ga) salts are significantly lower than those of the the M Cl4 (M = Fe, Ga) salts, suggesting chemical pressure effects. Above Pc, field-induced SDW transitions appear, as evidenced by kink structures in the magnetoresistance (MR) in both salts. The FeBr2Cl2 salt also shows antiferromagnetic (AF) ordering of d spins at 4 K, below which significant spin-charge coupling is observed. A large positive MR change up to 150% appears above the spin-flop field at high pressure. At low pressure, in particular below Pc, a dip or kink structure appears in MR at the spin-flop field, which shows unconventionally large hysteresis at low temperature (T hysteresis region clearly decreases with increasing pressure towards Pc, strongly indicating that the coexisting SDW plays an important role in the enhancement of magnetic hysteresis besides the random exchange interaction.
Beck, Christoph; Weitnauer, Claudia; Brosy, Caroline; Hald, Cornelius; Lochbihler, Kai; Siegmund, Stefan; Jacobeit, Jucundus
2016-04-01
Particulate matter with an aerodynamic diameter of 10 μm or less (PM10) may have distinct adverse effects on human health. Spatial and temporal variations in PM10 concentrations reflect local emission rates, but are as well influenced by the local and synoptic-scale atmospheric conditions. Against this background, it can be furthermore argued that potential future climate change and associated variations in large-scale atmospheric circulation and local meteorological parameters will probably provoke corresponding changes in future PM10 concentration levels. The DFG-funded research project „Particulate matter and climate change in Bavaria" aimed at establishing quantitative relationships between daily and monthly PM10 indices at different Bavarian urban stations and the corresponding large-scale atmospheric circulation as well as local meteorological conditions. To this end, several statistical downscaling approaches have been developed for the period 1980 to 2011. PM10 data from 19 stations from the air quality monitoring network (LÜB) of the Bavarian Environmental Agency (LfU) have been utilized as predictands. Large-scale atmospheric gridded data from the NCEP/NCAR reanalysis data base and local meteorological observational data provided by the German Meteorological Service (DWD) served as predictors. The downscaling approaches encompass the synoptic downscaling of daily PM10 concentrations and several multivariate statistical models for the estimation of daily and monthly PM10, i.e.monthly mean and number of days exceeding a certain PM10 concentration threshold. Both techniques utilize objective circulation type classifications, which have been optimized with respect to their synoptic skill for the target variable PM10. All downscaling approaches have been evaluated via cross validation using varying subintervals of the 1980-2011 period as calibration and validation periods respectively. The most suitable - in terms of model skill determined from cross
Ochoa-Calle, A J; Zicovich-Wilson, C M; Hernández-Lamoneda, R; Ramírez-Solís, A
2015-03-10
The experimentally characterized ε and ζ phases of solid oxygen are studied by periodic Hartree-Fock (HF) and Density Functional Theory calculations at pressures from 10 to 160 GPa using different types of exchange-correlation functionals with Gaussian atomic basis sets. Full geometry optimizations of the monoclinic C2/m (O2)4 unit cell were done to study the evolution of the structural and electronic properties with pressure. Vibrational calculations were performed at each pressure. While periodic HF does not predict the ε-ζ phase transition in the considered range, Local Density approximation and Generalized Gradient approximation methods predict too low transition pressures. The performance of hybrid functional methods is dependent on the amount of non-local HF exchange. PBE0, M06, B3PW91, and B3LYP approaches correctly predict the structural and electronic changes associated with the phase transition. GGA and hybrid functionals predict a pressure range where both phases coexist, but only the latter type of methods yield results in agreement with experiment. Using the optimized (O2)4 unit cell at each pressure we show, through CASSCF(8,8) calculations, that the greater accuracy of the optimized geometrical parameters with increasing pressure is due to a decreasing multireference character of the unit cell wave function. The mechanism of the transition from the non-conducting to the conducting ζ phase is explained through the Electron Pair Localization Function, which clearly reveals chemical bonding between O2 molecules in the ab crystal planes belonging to different unit cells due to much shorter intercell O2-O2 distances.
Gritsenko, O. V.; Mentel, Ł. M.; Baerends, E. J.
2016-05-01
In spite of the high quality of exchange-correlation energies Exc obtained with the generalized gradient approximations (GGAs) of density functional theory, their xc potentials vxc are strongly deficient, yielding upshifts of ca. 5 eV in the orbital energy spectrum (in the order of 50% of high-lying valence orbital energies). The GGAs share this deficiency with the local density approximation (LDA). We argue that this error is not caused by the incorrect long-range asymptotics of vxc or by self-interaction error. It arises from incorrect density dependencies of LDA and GGA exchange functionals leading to incorrect (too repulsive) functional derivatives (i.e., response parts of the potentials). The vxc potential is partitioned into the potential of the xc hole vxchole (twice the xc energy density ɛxc), which determines Exc, and the response potential vresp, which does not contribute to Exc explicitly. The substantial upshift of LDA/GGA orbital energies is due to a too repulsive LDA exchange response potential vxresp L D A in the bulk region. Retaining the LDA exchange hole potential plus the B88 gradient correction to it but replacing the response parts of these potentials by the model orbital-dependent response potential vxresp G L L B of Gritsenko et al. [Phys. Rev. A 51, 1944 (1995)], which has the proper step-wise form, improves the orbital energies by more than an order of magnitude. Examples are given for the prototype molecules: dihydrogen, dinitrogen, carbon monoxide, ethylene, formaldehyde, and formic acid.
Menushenkov, A. P.; Ivanov, V. G.; Chepikov, V. N.; Nygaard, R. R.; Soldatenko, A. V.; Rudnev, I. A.; Osipov, M. A.; Mineev, N. A.; Kaul, A. R.; Mathon, O.; Monteseguro, V.
2017-04-01
We have studied the influence of BaZrO3 nanoinclusions on the local structure and critical current density of second-generation high temperature superconducting tapes based on YBa2Cu3O7-δ (YBCO) films. The films were made by metal-organic chemical vapor deposition (MOCVD). The crystal and local structure of the materials under study were analysed by x-ray diffraction and x-ray absorption spectroscopy (EXAFS + XANES). We have found that, being added at MOCVD process, Zr forms BaZrO3 nanoinclusions in YBCO matrix. The distance between Zr and the neighboring atoms is shorter than that one in a bulk crystalline BaZrO3, so we conclude that the nanoinclusions are in compressed state. The incorporation of 5 mol% BaZrO3 minimizes the static disorder of Cu-O bonds and maximizes their stiffness in YBCO. We show that the local structure peculiarities correlate well with the observed critical current behavior and consider this to be additional evidence in favor of small amounts of BaZrO3 nanoinclusions as efficient pinning centers.
Calanca, Pierluigi; Semenov, Mikhail A.
2013-08-01
We present the integration of early 21st century climate projections for Europe based on simulations carried out within the EU-FP6 ENSEMBLES project with the LARS-WG stochastic weather generator. The aim was to upgrade ELPIS, a repository of local-scale climate scenarios for use in impact studies and risk assessments that already included global projections from the CMIP3 ensemble and regional scenarios for Japan. To obtain a more reliable simulation of daily rainfall and extremes, changes in wet and dry series derived from daily ENSEMBLES outputs were taken into account. Kernel average smoothers were used to reduce noise arising from sampling artefacts. Examples of risk analyses based on 25-km climate projections from the ENSEMBLES ensemble of regional climate models illustrate the possibilities offered by the updated version of ELPIS. The results stress the importance of tailored information for local-scale impact assessments at the European level.
Inuggi, Alberto; Filippi, Massimo; Chieffo, Raffaella; Agosta, Federica; Rocca, Maria A; González-Rosa, Javier J; Cursi, Marco; Comi, Giancarlo; Leocani, Letizia
2010-01-13
The localization of human hand primary motor area (M1) has been the object of several studies during the last decades. EEG source analysis, functional magnetic resonance imaging (fMRI) and focal transcranial magnetic stimulation (TMS) are non-invasive methods for localizing M1 with good accuracy compared to direct electrocorticography (ECoG) results. EEG sources were reconstructed with Cortical Current Density (CCD) method, allowing to evaluate simultaneous and distributed patterns of activation and to increase accuracy by constraining on information derived from fMRI (fMRI-CCD). The aim of this study was to compare the M1 contribution of movement-related cortical potentials (MRCP) with TMS and fMRI results and to test the effect of constraints strength, algorithm norm and localization methods over CCD reconstruction. Seven right-handed healthy subjects underwent 64-channel EEG recording of MRCP to right thumb movement, focal TMS mapping of the right abductor pollicis brevis muscle and fMRI during right hand movement. We found fMRI activations, EEG sources and TMS mapping corresponding to the anatomical landmark of the hand area in all subjects with fMRI and TMS center-of-gravity and in almost all subjects using fMRI-CCD with moderate constraint. A significant improvement was found using fMRI-CCD compared to CCD alone. This study confirms the usefulness of multimodal integration of fMRI, EEG and TMS in localizing M1 and the possibility to increase EEG spatial resolution using fMRI information.
Hummelshøj, Jens Strabo; Landis, David; Voss, Johannes
2009-01-01
We present a computational screening study of ternary metal borohydrides for reversible hydrogen storage based on density functional theory. We investigate the stability and decomposition of alloys containing 1 alkali metal atom, Li, Na, or K (M1); and 1 alkali, alkaline earth or 3d/4d transition...
Jim, C. Y.; Yang, Felix Y.
2006-10-01
Large-scale infrastructural developments in rural areas often impose significant direct and indirect impacts on environment and people. The Three Gorges Project to dam the Yangtze River in China will create a huge reservoir, inundate farmlands and villages, and incur large-scale resettlement. The concurrent de-farming program to reforest marginal farmlands on steep slopes imposes additional stresses on local people. This study evaluates the ecological and economic adjustments in rural areas affected by both projects, and explores villagers’ knowledge, attitudes, perceptions, and expectations vis-à-vis the drastic changes. Eleven villages in Yunyang County in Sichuan Province, stratified into three zones based on topography and agriculture, were assessed by field studies, questionnaire surveys, maps, satellite imagery, and census and government reports. Multiple regressions identified predictors for 17 dependent variables. Spatial variations in the difficult terrain imposed zone-differentiated agricultural constraints, ecological impacts, and human responses. The dominant farming population—mainly young adults working as migrant laborers in cities—has adopted some nonagricultural work to supplement incomes. Expected per-capita standardized farmland (SF) exceeded threshold SF, which surpasses existing SF. Motivations to reclaim more farmlands, de-farm marginal lands, and become migrant laborers were explained by different multiple-regression predictors. Reduction in farmland stock by inundation and de-farming, aggravated by unwillingness towards nonlocal resettlement, would impose ecological pressures and stimulate demands for nonfarming incomes. Common anticipation of better future income and occupation has been subdued by unfavorable feedbacks from early relocatees. Future environmental and landscape changes are hinged upon changing human responses. Government policies could be informed by research findings to match economic, ecological, and social realities.
de Lasson, Jakob Rosenkrantz; Mørk, Jesper; Gregersen, Niels
2015-01-01
We present and validate a semi-analytical quasi-normal mode (QNM) theory for the local density of states (LDOS) in coupled photonic crystal (PhC) cavity-waveguide structures. By means of an expansion of the Green's function on one or a few QNMs, a closed-form expression for the LDOS is obtained, and for two types of two-dimensional PhCs, with one and two cavities side-coupled to an extended waveguide, the theory is validated against numerically exact computations. For the single cavity, a slightly asymmetric spectrum is found, which the QNM theory reproduces, and for two cavities a non-trivial spectrum with a peak and a dip is found, which is reproduced only when including both the two relevant QNMs in the theory. In both cases, we find relative errors below 1% in the bandwidth of interest.
Indukuri, Chaitanya; Mukherjee, Arnab; Basu, J. K.
2015-03-01
We report results of controlled tuning of the local density of states (LDOS) in versatile, flexible, and hierarchical self assembled plasmonic templates. Using 5 nm diameter gold (Au) spherical nanoantenna within a polymer template randomly dispersed with quantum dots, we show how the photoluminescence intensity and lifetime anisotropy of these dots can be significantly enhanced through LDOS tuning. Finite difference time domain simulations corroborate the experimental observations and extend the regime of enhancement to a wider range of geometric and spectral parameters bringing out the versatility of these functional plasmonic templates. It is also demonstrated how the templates act as plasmonic resonators for effectively engineer giant enhancement of the scattering efficiency of these nano antenna embedded in the templates. Our work provides an alternative method to achieve spontaneous emission intensity and anisotropy enhancement with true nanoscale plasmon resonators.
2011-08-12
We measure the penetration depth {lambda}{sub ab}(T) in Ba(Fe{sub 1-x}Co{sub x}){sub 2}As{sub 2} using local techniques that do not average over the sample. The superfluid density {rho}{sub s}(T) {triple_bond} 1/{lambda}{sub ab}(T){sup 2} has three main features. First, {rho}{sub s}(T = 0) falls sharply on the underdoped side of the dome. Second, {lambda}{sub ab}(T) is flat at low T at optimal doping, indicating fully gapped superconductivity, but varies more strongly in underdoped and overdoped samples, consistent with either a power law or a small second gap. Third, {rho}{sub s}(T) varies steeply near T{sub c} for optimal and underdoping. These observations are consistent with an interplay between magnetic and superconducting phases.
Frimmer, Martin
2012-01-01
We theoretically investigate how the enhancement of the radiative decay rate of a spontaneous emitter provided by coupling to an optical antenna is modified when this "superemitter" is introduced into a complex photonic environment that provides an enhanced local density of optical states (LDOS) itself, such as a microcavity. We show that photonic environments with increased LDOS further boost the performance of antennas that scatter weakly, i.e. that are far from the unitary limit, for which a simple multiplicative LDOS lumping rule holds. In contrast, enhancements provided by antennas close to the unitary limit, i.e. antennas close to the limit of maximally possible scattering strength, are strongly reduced by an enhanced LDOS of the environment. Thus, we identify multiple scattering in hybrid photonic systems as a powerful mechanism for LDOS engineering.
Wang, Peng; Menon, Rajesh
2014-01-13
Recent work has shown that using a high-index cladding atop a lower-index photovoltaic absorber enables absorption of light beyond the ergodic (4n2) limit. In this paper, we propose a generalized optimization method for deriving optimal geometries that allow for such enhancement. Specifically, we adapted the direct-binary-search algorithm to optimize a complex 2-D multi-layer structure with the explicit goal of increasing photocurrent. We show that such an optimization results in enhancing the local density of optical states in an ultra-thin absorber, which forms a slot-waveguide geometry in the presence of a higher-index overcladding. Numerical simulations confirmed optical absorption approaching 100% and absorption-enhancement beyond the ergodic (4n2) limit for specific spectral bands of interest. Our method provides a direct, intuitive and computationally scalable approach for designing light-trapping nanostructures.
Arshad, Suhana; Pillai, Renjith Raveendran; Zainuri, Dian Alwani; Khalib, Nuridayanti Che; Razak, Ibrahim Abdul; Armaković, Stevan; Armaković, Sanja J.
2017-09-01
In the present study, single crystals of E)-3-(3,5-dichlorophenyl)-1-(4-fluorophenyl)prop-2-en-1-one, were prepared and structurally characterized by single crystal X-ray diffraction analysis. The molecular structure crystallized in monoclinic crystal system with P21/c space group. Sensitivity of the title molecule towards electrophilic attacks has been examined by calculations of average localized ionization energies (ALIE) and their mapping to electron density surface. Further determination of atoms that could be important reactive centres has been performed by calculations of Fukui functions. Sensitivity of title molecule towards autoxidation and hydrolysis mechanisms has been assessed by calculations of bond dissociation energies and radial distribution functions (RDF), respectively. Also, in order to explore possible binding mode of the title compound towards Dihydrofolate reductase enzyme, we have utilized in silico molecular docking to explore possible binding modes of the title compound with the DHFR enzyme.
Investors sought for local railway projects in Shandong%山东地方铁路建设首次对外招商
无
2005-01-01
@@ The State Assets Supervision and Administration Commission of Shandong Province recently made public a plan to seek public investment at home and abroad for the construction of six local reilways. Multiple forms,such as equity and non-eyuiqy joint venture,solely owned venture and even property right or equity transfer will be permitted in undertaking the projects. For three of the projects, solely foreign-owned venture will be permitted and for two projects, proterty transfer to foreign investors is proposed.