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At least 37 records · Page 2

Scalable implementation of polynomial filtering for density functional theory calculation in PARSEC

In this work, we present an efficient implementation of polynomial filtering methods in PARSEC, a real-space pseudopotential based Kohn–Sham density functional theory solver. The implementation described here improves upon a Chebyshev-filtered subspace iteration algorithm used in the previous version of PARSEC. We present a hybrid polynomial filtering scheme that combines Chebyshev-filtered subspace iteration and a spectrum slicing method that partitions the spectrum into several spectral slices and uses bandpass-filtered subspace iteration to compute approximate eigenpairs within each interior slice simultaneously. We describe a procedure to partition a spectrum and construct polynomial filters. We also discuss a number of practical issues such as the use of appropriate data layouts for carrying out the computation on a two-dimensional process grid and how to achieve good load balance by allocating an appropriate number of process groups to each spectral slice. Numerical examples are presented to demonstrate the effectiveness of the hybrid polynomial filtering method as well as the superior parallel scalability of spectrum slicing in comparison to that of Chebyshev-filtered subspace iteration.

97 MATHEMATICS AND COMPUTING↗

SU-C-207B-03: A Geometrical Constrained Chan-Vese Based Tumor Segmentation Scheme for PET

Purpose: Accurate segmentation of tumor in PET is challenging when part of tumor is connected with normal organs/tissues with no difference in intensity. Conventional segmentation methods, such as thresholding or region growing, cannot generate satisfactory results in this case. We proposed a geometrical constrained Chan-Vese based scheme to segment tumor in PET for this special case by considering the similarity between two adjacent slices. Methods: The proposed scheme performs segmentation in a slice-by-slice fashion where an accurate segmentation of one slice is used as the guidance for segmentation of rest slices. For a slice that the tumor is not directly connected to organs/tissues with similar intensity values, a conventional clustering-based segmentation method under user’s guidance is used to obtain an exact tumor contour. This is set as the initial contour and the Chan-Vese algorithm is applied for segmenting the tumor in the next adjacent slice by adding constraints of tumor size, position and shape information. This procedure is repeated until the last slice of PET containing tumor. The proposed geometrical constrained Chan-Vese based algorithm was implemented in Matlab and its performance was tested on several cervical cancer patients where cervix and bladder are connected with similar activity values. The positive predictive values (PPV) are calculated to characterize the segmentation accuracy of the proposed scheme. Results: Tumors were accurately segmented by the proposed method even when they are connected with bladder in the image with no difference in intensity. The average PPVs were 0.9571±0.0355 and 0.9894±0.0271 for 17 slices and 11 slices of PET from two patients, respectively. Conclusion: We have developed a new scheme to segment tumor in PET images for the special case that the tumor is quite similar to or connected to normal organs/tissues in the image. The proposed scheme can provide a reliable way for segmenting tumors.

60 APPLIED LIFE SCIENCES↗

A Comparison of High Spectral Resolution Infrared Cloud-Top Pressure Altitude Algorithms Using S-HIS Measurements

This paper presents a comparison of cloud-top altitude retrieval methods applied to S-HIS (Scanning High Resolution Interferometer Sounder) measurements. Included in this comparison is an improvement to the traditional CO2 Slicing method. The new method, CO2 Sorting, determines optimal channel pairs to apply the CO2 Slicing. Measurements from collocated samples of the Cloud Physics Lidar (CPL) and Modis Airborne Simulator (MAS) instruments assist in the comparison. For optically thick clouds good correlation between the S-HIS and lidar cloud-top retrievals are found. For tenuous ice clouds there can be large differences between lidar (CPL) and S-HIS retrieved cloud-tops. It is found that CO2 Sorting significantly reduces the cloud height biases for the optically thin cloud (total optical depths less then 1.0). For geometrically thick but optically thin cirrus clouds large differences between the S-HIS infrared cloud top retrievals and the CPL detected cloud top where found. For these cases the cloud height retrieved by the S-HIS cloud retrievals correlated closely with the level the CPL integrated cloud optical depth was approximately 1.0.

Holz, Robert E.↗

Wire blade development for Fixed Abrasive Slicing Technique (FAST) slicing

A low cost, effective slicing method is essential to make ingot technology viable for photovoltaics in terrestrial applications. The fixed abrasive slicing technique (FAST) combines the advantages of the three commercially developed techniques. In its development stage FAST demonstrated cutting effectiveness of 10 cm and 15 cm diameter workpieces. Wire blade development is still the critical element for commercialization of FAST technology. Both impregnated and electroplated wire blades have been developed; techniques have been developed to fix diamonds only in the cutting edge of the wire. Electroplated wires show the most near term promise and this approach is emphasized. With plated wires it has been possible to control the size and shape of the electroplating, it is expected that this feature reduces kerf and prolongs the life of the wirepack.

Khattak, C. P.↗

Imaging phonon dynamics with ultrafast electron microscopy: Kinematical and dynamical simulations

Ultrafast x-ray and electron scattering techniques have proven to be useful for probing the transient elastic lattice deformations associated with photoexcited coherent acoustic phonons. Indeed, femtosecond electron imaging using an ultrafast electron microscope (UEM) has been used to directly image the influence of nanoscale structural and morphological discontinuities on the emergence, propagation, dispersion, and decay behaviors in a variety of materials. Here, we describe our progress toward the development of methods ultimately aimed at quantifying acoustic-phonon properties from real-space UEM images via conventional image simulation methods extended to the associated strain-wave lattice deformation symmetries and extents. Using a model system consisting of pristine single-crystal Ge and a single, symmetric Lamb-type guided-wave mode, we calculate the transient strain profiles excited in a wedge specimen and then apply both kinematical- and dynamical-scattering methods to simulate the resulting UEM bright-field images. While measurable contrast strengths arising from the phonon wavetrains are found for optimally oriented specimens using both approaches, incorporation of dynamical scattering effects via a multi-slice method returns better qualitative agreement with experimental observations. Contrast strengths arising solely from phonon-induced local lattice deformations are increased by nearly an order of magnitude when incorporating multiple electron scattering effects. We also explicitly demonstrate the effects of changes in global specimen orientation on the observed contrast strength, and we discuss the implications for increasing the sophistication of the model with respect to quantification of phonon properties from UEM images.

36 MATERIALS SCIENCE↗

On the Retrieval and Analysis of Multilevel Clouds

An accurate satellite retrieval of cloud properties depends upon the detection and analysis of multilayered, overlapping cloud systems that surface observations show to be common. Multiple cloud layers are often found, for instance, in frontal situations, where cirrus overlays boundary layer convective cloud or low-to mid-level stratus cloud. Surface observers (Hahan et al., 1982) indicate that over ocean in the Northern Hemisphere between 30 deg. N and 60 deg. N, 51 percent of observations are of multilevel clouds. A satellite analysis by Coakley (1983) over the Pacific Ocean finds that more than 50 percent of 500 (250 sq km) frames exhibit evidence of multilayered cloud systems. The questions addressed in this study are the following: What error is introduced when inferring the cloud pressure from a Field-Of-View (FOV) that contains some arbitrary amount of transparent cloud overlaying a lower-level black cloud, such as stratus, by making the assumption that there is only a single cloud layer in the FOV, and what may be done to improve the cloud retrieval? The CO2 slicing methods (e.g. McCleese and Wilson, 1976; Smith and Platt, 1978; Chahine, 1974) have been shown to provide accurate means of inferring cirrus cloud altitude from passive infrared radiance measurements. The CO2 techniques have been applied to radiometric data from several instruments, notably the High Resolution Infrared Radiometric Sounder (HIRS/2, hereafter referred to as HIRS), the VISSR Atmospheric Sounder (VAS) (e.g., Menzel et al., 1983; Wylie and Menzel, 1989), and most recently to the High Resolution Interferometer Sounder (HIS) (Smith and Frey, 1990). The methods take advantage of the fact that infrared CO2 sounding channels spaced closely in wavenumber each have varying opacity to CO2, thereby causing each channel to be sensitive to a different level in the atmosphere. The techniques have been shown to be effective for single-layered, nonblack, mid- to high-level clouds such as cirrus, but are generally applied operationally to any given cloud occurrence. The CO2 slicing algorithms are most accurate for clouds than occur in a single, well-defined layer, or for multi-layered cloud cases in which the uppermost cloud layer is nearly black. Significant cloud height retrieval errors may ensue if the HIRS Field-Of-View (FOV) is cotaminated with low cloud. McCleese and Wilson (1976) have shown that the retrieved cloud height for the case of multiple cloud layers is a weighted average of the cloud heights actually present. The weight is approximately proportional to the product of the cloud heigt and the effective cloud amount. The effect of their result is that the uppermost cloud layer dominates the cloud pressure retrieval. Beyond stating that the higher cloud dominates the cloud pressure retrieval, there is no quantitative information to provide a way of estimating the errors in cloud pressure retrieval one should expect for certain common multilevel cloud situations or any suggestions on how to reduce the errors. In this paper we estimate the magnitude of the errors and use a simple algorithm to reduce the errors in optically thin cloud height retrival.

Baum, Bryan A.↗

Systems and methods for generating slice files from native CAD geometries

A system and method for improving the production of objects with fully defined CAD models by generating CAD slice files from the native CAD geometries for use by AM machines. An electronic processing element receives the CAD model having a native and/or neutral format with metadata, determines a desired resolution, slices the CAD model to create the slice files having a slice format (e.g., point, edge, surface, volume) and retaining the metadata, and evaluates the slice files to determine whether the resolution has been achieved. If so, the slice files are sent to the AM machine. If not, a new desired resolution is determined and the CAD model is re-sliced, which may include combining the slice files to regenerate the CAD model. A support structure for the object may be analyzed, and if distortion is predicted, a modified CAD model may be created and sliced to create modified slice files.

Vernon, Gregory J.↗

Impact of isolation and fiducial cuts on qT and N-jettiness subtractions

Kinematic selection cuts and isolation requirements are a necessity in experimental measurements for identifying prompt leptons and photons that originate from the hard-interaction process of interest. We analyze how such cuts affect the application of the q T and N-jettiness subtraction methods for fixed-order calculations. We consider both fixed-cone and smooth-cone isolation methods. We find that kinematic selection and isolation cuts both induce parametrically enhanced power corrections with considerably slower convergence compared to the standard power corrections that are already present in inclusive cross sections without additional cuts. Using analytic arguments at next-to-leading order we derive their general scaling behavior as a function of the subtraction cutoff. We also study their numerical impact for the case of gluon-fusion Higgs production in the H → γγdecay mode and for pp → γγ direct diphoton production. We find that the relative enhancement of the additional cut-induced power corrections tends to be more severe forq T , where it can reach an order of magnitude or more, depending on the choice of parameters and subtraction cutoffs. We discuss how all such cuts can be incorporated without causing additional power corrections by implementing the subtractions differentially rather than through a global slicing method. We also highlight the close relation of this formulation of the subtractions to the projection-to-Born method.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗

Non-local slicing approaches for NNLO QCD in MCFM

We present the implementation of several processes at Next-to-Next-to Leading Order (NNLO) accuracy in QCD in the parton-level Monte Carlo program MCFM. The processes treated are pp → H, W ± , Z, W ± H, ZH, W ± γ, Zγ and γγ and, for the first time in the code, W + W - , W ± Z and ZZ. Decays of the unstable bosons are fully included, resulting in a flexible fully differential Monte Carlo code. The NNLO corrections have been calculated using two non-local slicing approaches, isolating the doubly unresolved region by cutting on the zero-jettiness, $\mathscr{T}_0$, or on q T , the transverse momentum of the colour singlet final-state particles. We find that for most, but not all processes the q T slicing method leads to smaller power corrections for equal computational burden.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

The pp → W(→ lν) + γ process at next-to-next-to-leading order

We present details of the calculation of the pp → W(→ lν)γ process at next-to-next-to-leading order in QCD, calculated using the jettiness slicing method. The calculation is based entirely on analytic amplitudes. Because of the radiation zero, the NLO QCD contribution from the gq channel is as important as the contribution from the Born $ q\overline{q} $ process, disrupting the normal counting of leading and sub-leading contributions. We also assess the importance of electroweak (EW) corrections, including the EW corrections to both the six-parton channel 0 →$ \overline{u} d\nu {e}^{+}\gamma g $ and the five-parton channel 0 →$ \overline{u} d\nu {e}^{+}\gamma $. Previous experimental results have been shown to agree with theoretical predictions, taking into account the large experimental errors. With the advent of run II data from the LHC, the statistical errors on the data will decrease, and will be competitive with the error on theoretical predictions for the first time. We present numerical results for $ \sqrt{s} $ = 7 and 13 TeV. Analytic results for the one-loop six-parton QCD amplitude and the tree-level seven-parton QCD amplitude are presented in appendices.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Inverse regression for ridge recovery: a data-driven approach for parameter reduction in computer experiments

Parameter reduction can enable otherwise infeasible design and uncertainty studies with modern computational science models that contain several input parameters. In statistical regression, techniques for sufficient dimension reduction (SDR) use data to reduce the predictor dimension of a regression problem. A computational scientist hoping to use SDR for parameter reduction encounters a problem: a computer prediction is best represented by a deterministic function of the inputs, so data comprised of computer simulation queries fail to satisfy the SDR assumptions. To address this problem, here we interpret SDR methods sliced inverse regression (SIR) and sliced average variance estimation (SAVE) as estimating the directions of a ridge function, which is a composition of a low-dimensional linear transformation with a nonlinear function. Within this interpretation, SIR and SAVE estimate matrices of integrals whose column spaces are contained in the ridge directions’ span; we analyze and numerically verify convergence of these column spaces as the number of computer model queries increases. Moreover, we show example functions that are not ridge functions but whose inverse conditional moment matrices are low-rank. Consequently, the computational scientist should beware when using SIR and SAVE for parameter reduction, since SIR and SAVE may mistakenly suggest that truly important directions are unimportant.

97 MATHEMATICS AND COMPUTING↗

Measurement of the π - -Ar total hadronic cross section at the LArIAT experiment

We present the first measurement of the negative pion total hadronic cross section on argon in a restricted phase space, which we performed at the Liquid Argon In A Testbeam (LArIAT) experiment. All hadronic reaction channels, as well as hadronic elastic interactions with scattering angle greater than 5° are included. The pions have kinetic energies in the range 100–700 MeV and are produced by a beam of charged particles impinging on a solid target at the Fermilab test beam facility. LArIAT employs a 0.24 ton active mass liquid argon time projection chamber (LArTPC) to measure the pion hadronic interactions. For this measurement, LArIAT has developed the “thin slice method,” a new technique to measure cross sections with LArTPCs. While moderately higher, our measurement of the π - -Ar total hadronic cross section is generally in agreement with the geant4 prediction.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗

Application of an electronic image analyzer to dimensional measurements from neutron radiographs

Means of obtaining improved dimensional measurements from neutron radiographs of nuclear fuel elements are discussed. The use of video-electronic image analysis relative to edge definition in radiographic images is described. Based on this study, an edge definition criterion is proposed for overcoming image unsharpness effects in taking accurate diametral measurements from radiographs. An electronic density slicing method for automatic edge definition is described. Results of measurements made with video micrometry are compared with scanning microdensitometer and micrometric physical measurements. An image quality indicator for estimating photographic and geometric unsharpness is described.

Vary, A.↗

Analysis and Evaluation of Processes and Equipment in Tasks 2 and 4 of the Low-cost Solar Array Project

The significant economic data for the current production multiblade wafering and inner diameter slicing processes were tabulated and compared to data on the experimental and projected multiblade slurry, STC ID diamond coated blade, multiwire slurry and crystal systems fixed abrasive multiwire slicing methods. Cost calculations were performed for current production processes and for 1982 and 1986 projected wafering techniques.

Goldman, H.↗

Toward a unified theory of atmospheric convective instability

A nonlinear three-dimensional truncated spectral model of shallow and moist Boussinesq convection indicates that parallel instability and thermal forcing are linked, in view of the fact that only one convective mode exists in which either or both mechanisms are operating to generate convection in the planetary boundary layer. It is also established that the wind field causes two-dimensional roll convection formation, an alignment of the convection with the wind in a preferred manner, and a propagation speed that is related to the wind component perpendicular to the roll axis. Latent heating is responsible for the decrease of the critical value of the environmental lapse rate in accordance with the slice method stability criterion. When only the upper part of the upward branch is moist and all of the downward branch is dry, latent heating also causes a finite-amplitude convective solution for Rayleigh number values lower than the critical value of linear analysis.

Shirer, H. N.↗

Improved cloud motion wind vector and altitude assignment using VAS

A CO2 cloud tracking technique to determine simultaneous heights and velocities of cloud motion winds is presented. Using animated CO2 channel imagery from VAS (Visible Infrared Spin-Scan Radiometer Atmospheric Sounder), multi-level cloud situations are separated into high, middle and low level cloud motion wind vectors by the CO2 slicing method. The VAS CO2 channel radiometric values are used in the CO2 absorption method to assign quantitative heights to the cloud vectors; cloud top pressures are determined from the ratio of the deviations in cloud produced radiances and the corresponding clear air values for three CO2 channels in a radiative transfer equation formulation. Two case studies are presented that show CO2 cloud-motion wind vectors to be in good agreement with radiosonde wind observations and CO2 cloud heights to be within a 50 mb rms deviation of radiosonde, bispectral and stereo height determinations.

Menzel, W. P.↗

Properties of cirrus from multispectral AVHRR imagery data

The discovery that the 11 and 12 microns window channels of AVHRR could be used to detect and even characterize the properties of cirrus stimulated the present study which reexamines the general multispectral approach for retrieving cirrus cloud top temperature and emissivity. The generalized multispectral approach described compliments the CO2 slicing method used by Wylie and the bispectral threshold methods used by Minnis et al. While the results shown were for 11 and 12 micron radiances, better definition of the cloud top temperature is probably obtainable using 3.7 micron radiances in combination with the 11 and 12 micron radiances. During the day reflection of solar radiation at 3.7 micron by low level water clouds makes the analysis untenable. At night, at least with the NOAA-9 AVHRR, instrument noise in the 3.7 micron channel also makes the analysis untenable. The identification of semitransparent systems using 3.7 micron radiances has been noted elsewhere.

Coakley, James A., Jr.↗